data_1srb_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 1srb _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.469 ' SG ' ' CD2' ' A' ' 16' ' ' HIS . 63.6 m . . . . . 0 N--CA 1.493 1.696 0 CA-C-O 121.531 0.682 . . . . 0.0 111.42 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 71.0 p -128.12 126.22 40.7 Favored 'General case' 0 N--CA 1.492 1.65 0 CA-C-N 114.062 -1.426 . . . . 0.0 110.207 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 14.6 m -120.6 80.94 1.69 Allowed 'General case' 0 N--CA 1.496 1.865 0 N-CA-C 105.812 -1.922 . . . . 0.0 105.812 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 80.9 tttt -110.99 97.16 6.61 Favored 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 113.779 1.029 . . . . 0.0 113.779 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.3 t70 100.8 21.64 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.5 0 C-N-CA 127.762 2.425 . . . . 0.0 106.445 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -130.63 -170.95 2.44 Favored 'General case' 0 N--CA 1.494 1.74 0 CA-C-N 114.151 -1.386 . . . . 0.0 110.375 -179.842 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 55.2 p -110.72 -145.4 0.4 Allowed 'General case' 0 N--CA 1.499 1.986 0 N-CA-C 106.505 -1.665 . . . . 0.0 106.505 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -112.91 -60.27 1.9 Allowed 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 105.805 -1.924 . . . . 0.0 105.805 179.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.22 -51.88 10.14 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 124.134 0.896 . . . . 0.0 109.241 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -65.47 -55.7 16.47 Favored 'General case' 0 N--CA 1.496 1.842 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.216 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 49.0 t -40.08 -51.42 2.6 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 124.644 1.215 . . . . 0.0 110.892 179.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.434 ' C ' ' H ' ' A' ' 14' ' ' PHE . 0.7 OUTLIER -56.9 -44.59 82.5 Favored 'General case' 0 N--CA 1.495 1.794 0 CA-C-N 114.784 -1.098 . . . . 0.0 110.785 179.697 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 11.7 t80 -58.13 -3.91 0.29 Allowed 'General case' 0 N--CA 1.493 1.711 0 CA-C-N 115.054 -0.975 . . . . 0.0 111.4 179.593 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.434 ' H ' ' C ' ' A' ' 12' ' ' LEU . 2.6 m-85 -116.66 -46.0 2.77 Favored 'General case' 0 N--CA 1.504 2.236 0 C-N-CA 123.219 0.608 . . . . 0.0 110.775 -179.8 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 21.2 t -98.97 -37.04 9.54 Favored 'General case' 0 N--CA 1.5 2.071 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.469 ' CD2' ' SG ' ' A' ' 1' ' ' CYS . 30.6 m170 -102.74 40.08 1.43 Allowed 'General case' 0 N--CA 1.502 2.171 0 CA-C-O 121.515 0.674 . . . . 0.0 109.897 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -112.72 45.07 1.37 Allowed 'General case' 0 N--CA 1.497 1.921 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 179.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -107.02 70.22 0.79 Allowed 'General case' 0 N--CA 1.489 1.525 0 CA-C-N 113.035 -1.893 . . . . 0.0 109.658 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 34.0 m -102.84 133.04 47.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 CA-C-N 112.746 -2.024 . . . . 0.0 109.406 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 19.2 tt . . . . . 0 N--CA 1.498 1.953 0 CA-C-O 123.357 1.551 . . . . 0.0 108.175 -179.95 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 60.3 m . . . . . 0 N--CA 1.489 1.507 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.6 p 14.97 83.75 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.547 0 N-CA-C 115.165 1.543 . . . . 0.0 115.165 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 66.2 m -94.99 65.81 2.95 Favored 'General case' 0 N--CA 1.494 1.747 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.041 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -104.05 137.92 41.32 Favored 'General case' 0 N--CA 1.496 1.865 0 CA-C-N 113.933 -1.485 . . . . 0.0 108.283 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.7 t70 52.91 31.97 11.74 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 114.213 -1.358 . . . . 0.0 110.302 -179.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 4.1 mtp -133.86 173.75 11.2 Favored 'General case' 0 N--CA 1.503 2.207 0 CA-C-N 114.452 -1.249 . . . . 0.0 108.756 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 61.9 p -112.52 163.9 13.94 Favored 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 106.364 -1.717 . . . . 0.0 106.364 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 28.1 m-20 -47.61 -67.63 0.26 Allowed 'General case' 0 N--CA 1.497 1.908 0 O-C-N 123.906 0.754 . . . . 0.0 111.947 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 23.1 ttmm -47.28 -53.2 14.08 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 123.988 0.805 . . . . 0.0 111.839 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -49.8 -60.47 2.87 Favored 'General case' 0 N--CA 1.498 1.955 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.367 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 6.6 t -49.48 -49.82 43.96 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 124.381 1.05 . . . . 0.0 110.494 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.417 HD11 ' CE1' ' A' ' 16' ' ' HIS . 1.3 mt -49.85 -52.99 28.37 Favored 'General case' 0 N--CA 1.498 1.931 0 CA-C-O 121.716 0.77 . . . . 0.0 111.522 179.76 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -48.18 -21.64 0.52 Allowed 'General case' 0 N--CA 1.498 1.929 0 CA-C-N 114.684 -1.144 . . . . 0.0 113.201 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -102.7 -39.65 6.95 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 123.743 0.652 . . . . 0.0 109.543 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 16.1 t -89.99 -68.09 0.8 Allowed 'General case' 0 N--CA 1.498 1.933 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.899 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.417 ' CE1' HD11 ' A' ' 12' ' ' LEU . 3.7 m170 -47.26 -42.73 21.19 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 123.652 0.595 . . . . 0.0 110.633 179.659 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 36.7 tt0 69.92 67.92 0.23 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 125.646 1.841 . . . . 0.0 106.608 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -106.14 73.25 0.97 Allowed 'General case' 0 N--CA 1.492 1.665 0 CA-C-N 112.836 -1.984 . . . . 0.0 108.973 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 26.8 m -106.25 168.69 2.81 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 CA-C-N 112.568 -2.105 . . . . 0.0 107.41 179.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 18.3 tt . . . . . 0 N--CA 1.499 2.022 0 CA-C-O 121.383 0.611 . . . . 0.0 111.66 -179.909 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 83.7 m . . . . . 0 N--CA 1.493 1.701 0 CA-C-O 121.319 0.581 . . . . 0.0 111.462 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.2 t -132.69 159.56 39.27 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-N 113.867 -1.515 . . . . 0.0 108.716 179.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 68.1 m -126.39 24.43 6.75 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 124.289 0.993 . . . . 0.0 109.636 179.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.4 tppt? -24.5 126.16 0.04 OUTLIER 'General case' 0 N--CA 1.512 2.651 0 O-C-N 124.563 1.165 . . . . 0.0 111.863 179.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.3 p30 33.69 35.0 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.362 0 N-CA-C 116.364 1.987 . . . . 0.0 116.364 -179.457 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 23.8 mtm -122.6 -170.04 2.02 Favored 'General case' 0 N--CA 1.505 2.29 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 179.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.7 t -110.61 -159.14 0.67 Allowed 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 106.333 -1.728 . . . . 0.0 106.333 179.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -103.2 -61.46 1.41 Allowed 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -37.25 -36.46 0.14 Allowed 'General case' 0 N--CA 1.501 2.082 0 O-C-N 124.943 1.402 . . . . 0.0 112.987 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -87.62 -54.72 4.12 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-N 114.731 -1.122 . . . . 0.0 108.942 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 20.8 t -41.14 -44.06 2.43 Favored 'General case' 0 N--CA 1.505 2.276 0 CA-C-O 122.019 0.914 . . . . 0.0 110.556 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.433 HD11 ' ND1' ' A' ' 16' ' ' HIS . 0.8 OUTLIER -52.37 -56.38 15.32 Favored 'General case' 0 N--CA 1.489 1.525 0 CA-C-N 114.323 -1.308 . . . . 0.0 111.243 179.739 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 47.0 t80 -47.05 -26.92 1.17 Allowed 'General case' 0 N--CA 1.498 1.967 0 CA-C-N 114.476 -1.238 . . . . 0.0 112.72 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -89.84 -43.31 10.72 Favored 'General case' 0 N--CA 1.498 1.959 0 CA-C-N 114.428 -1.26 . . . . 0.0 110.728 -179.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 49.4 t -99.91 -63.05 1.16 Allowed 'General case' 0 N--CA 1.5 2.074 0 O-C-N 123.724 0.64 . . . . 0.0 111.886 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.433 ' ND1' HD11 ' A' ' 12' ' ' LEU . 11.7 m170 -50.71 -40.06 53.22 Favored 'General case' 0 N--CA 1.504 2.26 0 CA-C-O 121.19 0.519 . . . . 0.0 111.609 179.818 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -118.59 51.22 1.11 Allowed 'General case' 0 N--CA 1.493 1.688 0 CA-C-N 114.074 -1.421 . . . . 0.0 108.68 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 59.3 t0 -69.38 -48.84 59.98 Favored 'General case' 0 N--CA 1.493 1.718 0 CA-C-N 113.471 -1.695 . . . . 0.0 106.716 179.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.9 p -120.16 168.18 12.78 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.908 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 179.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 42.1 mm . . . . . 0 N--CA 1.497 1.891 0 O-C-N 124.579 1.174 . . . . 0.0 111.304 -179.918 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 39.1 m . . . . . 0 N--CA 1.492 1.64 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.1 m -120.85 151.17 39.97 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.782 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 67.9 m -125.51 73.9 1.36 Allowed 'General case' 0 N--CA 1.497 1.922 0 N-CA-C 106.296 -1.742 . . . . 0.0 106.296 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -108.73 103.21 12.25 Favored 'General case' 0 N--CA 1.495 1.822 0 CA-C-N 113.949 -1.478 . . . . 0.0 111.505 -179.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.3 t70 90.34 37.53 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.121 0 O-C-N 125.871 1.982 . . . . 0.0 107.644 179.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -136.05 -177.2 4.59 Favored 'General case' 0 N--CA 1.493 1.702 0 CA-C-N 112.956 -1.929 . . . . 0.0 109.619 179.815 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 40.7 p -107.5 -114.86 0.27 Allowed 'General case' 0 N--CA 1.496 1.848 0 N-CA-C 104.984 -2.228 . . . . 0.0 104.984 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -130.18 -64.83 0.84 Allowed 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 106.618 -1.623 . . . . 0.0 106.618 179.601 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.6 ttmt -52.17 -49.32 64.04 Favored 'General case' 0 N--CA 1.493 1.689 0 CA-C-N 113.77 -1.559 . . . . 0.0 112.547 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -59.02 -55.63 32.68 Favored 'General case' 0 N--CA 1.498 1.966 0 C-N-CA 119.796 -0.762 . . . . 0.0 109.431 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 27.2 t -44.57 -51.26 9.14 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 124.258 0.974 . . . . 0.0 109.64 179.698 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.429 HD21 ' CD2' ' A' ' 16' ' ' HIS . 0.6 OUTLIER -52.86 -53.93 41.85 Favored 'General case' 0 N--CA 1.496 1.871 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.161 179.565 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 40.9 t80 -45.77 -18.7 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.104 0 CA-C-N 115.073 -0.967 . . . . 0.0 113.139 179.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.404 ' CD1' ' N ' ' A' ' 14' ' ' PHE . 1.7 m-85 -103.03 -41.17 6.19 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 124.186 0.929 . . . . 0.0 111.831 -179.798 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 42.2 t -97.42 -51.01 4.31 Favored 'General case' 0 N--CA 1.503 2.176 0 N-CA-C 114.277 1.214 . . . . 0.0 114.277 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.429 ' CD2' HD21 ' A' ' 12' ' ' LEU . 42.1 m-70 -79.45 -22.97 43.46 Favored 'General case' 0 N--CA 1.496 1.84 0 N-CA-C 114.855 1.428 . . . . 0.0 114.855 -179.698 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -118.17 40.48 3.16 Favored 'General case' 0 N--CA 1.5 2.074 0 N-CA-C 114.803 1.408 . . . . 0.0 114.803 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -125.26 -73.51 0.63 Allowed 'General case' 0 N--CA 1.504 2.246 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.377 179.558 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 19.7 m -120.42 146.12 25.77 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.358 0 O-C-N 124.57 1.169 . . . . 0.0 109.969 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 19.2 tt . . . . . 0 N--CA 1.497 1.891 0 CA-C-O 124.064 1.888 . . . . 0.0 106.834 179.789 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 87.1 m . . . . . 0 N--CA 1.493 1.69 0 CA-C-O 121.14 0.495 . . . . 0.0 111.57 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 53.1 m -116.2 89.09 3.03 Favored 'General case' 0 N--CA 1.496 1.827 0 CA-C-N 114.62 -1.173 . . . . 0.0 108.702 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 46.9 m -104.08 58.96 0.72 Allowed 'General case' 0 N--CA 1.499 2.006 0 CA-C-N 114.671 -1.15 . . . . 0.0 110.075 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -67.99 115.6 7.69 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-N 114.357 -1.292 . . . . 0.0 110.411 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.3 t70 59.18 39.74 22.52 Favored 'General case' 0 N--CA 1.498 1.952 0 CA-C-N 114.049 -1.432 . . . . 0.0 110.293 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 4.9 mtp -131.12 -178.59 4.9 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-N 113.906 -1.497 . . . . 0.0 108.532 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 60.3 p -108.89 -157.07 0.6 Allowed 'General case' 0 N--CA 1.501 2.101 0 N-CA-C 105.851 -1.907 . . . . 0.0 105.851 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -105.47 -67.74 0.9 Allowed 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 104.357 -2.46 . . . . 0.0 104.357 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.4 tpmt? -34.51 -46.98 0.3 Allowed 'General case' 0 N--CA 1.501 2.085 0 O-C-N 124.731 1.269 . . . . 0.0 113.326 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -80.28 -54.68 5.51 Favored 'General case' 0 N--CA 1.492 1.65 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.542 -179.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 48.0 t -44.32 -43.34 7.4 Favored 'General case' 0 N--CA 1.503 2.215 0 CA-C-O 121.615 0.722 . . . . 0.0 111.321 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.42 HD21 ' CD2' ' A' ' 16' ' ' HIS . 0.6 OUTLIER -53.35 -44.06 68.23 Favored 'General case' 0 N--CA 1.494 1.728 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.727 179.7 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 44.5 t80 -51.5 -17.67 0.87 Allowed 'General case' 0 N--CA 1.5 2.066 0 CA-C-N 115.245 -0.889 . . . . 0.0 111.535 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -106.27 -49.54 3.34 Favored 'General case' 0 N--CA 1.494 1.741 0 CA-C-N 114.92 -1.037 . . . . 0.0 112.489 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 42.1 t -104.77 16.78 25.35 Favored 'General case' 0 N--CA 1.505 2.317 0 N-CA-C 118.048 2.611 . . . . 0.0 118.048 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.42 ' CD2' HD21 ' A' ' 12' ' ' LEU . 1.1 m-70 -133.95 -47.22 0.79 Allowed 'General case' 0 N--CA 1.501 2.107 0 CA-C-O 120.809 0.338 . . . . 0.0 110.365 179.706 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 27.4 tt0 45.73 44.78 10.9 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 125.025 1.453 . . . . 0.0 109.047 -179.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -47.04 -50.88 18.71 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-N 113.69 -1.595 . . . . 0.0 110.233 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 12.2 p -124.22 158.54 30.73 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.759 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.032 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 18.6 tt . . . . . 0 N--CA 1.495 1.794 0 CA-C-N 112.875 -1.966 . . . . 0.0 108.895 179.897 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.41 ' SG ' ' CD2' ' A' ' 16' ' ' HIS . 80.6 m . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.583 0.706 . . . . 0.0 112.393 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.7 t -132.5 125.6 31.0 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 106.788 -1.56 . . . . 0.0 106.788 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 93.2 m -123.24 74.79 1.26 Allowed 'General case' 0 N--CA 1.497 1.894 0 N-CA-C 114.249 1.203 . . . . 0.0 114.249 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.478 ' O ' ' SD ' ' A' ' 6' ' ' MET . 91.7 mttt -96.04 168.11 10.81 Favored 'General case' 0 N--CA 1.498 1.953 0 N-CA-C 106.51 -1.663 . . . . 0.0 106.51 179.617 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.1 p30 29.44 35.18 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.438 0 N-CA-C 115.501 1.667 . . . . 0.0 115.501 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' MET . . . . . 0.478 ' SD ' ' O ' ' A' ' 4' ' ' LYS . 0.6 OUTLIER -142.13 -173.18 3.75 Favored 'General case' 0 N--CA 1.495 1.812 0 CA-C-N 113.479 -1.691 . . . . 0.0 108.196 179.77 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.8 t -112.83 -136.87 0.37 Allowed 'General case' 0 N--CA 1.495 1.776 0 N-CA-C 103.837 -2.653 . . . . 0.0 103.837 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -112.62 -68.14 0.95 Allowed 'General case' 0 N--CA 1.497 1.918 0 CA-C-N 119.051 0.841 . . . . 0.0 112.977 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.4 tmtt? -45.85 -62.17 1.42 Allowed 'General case' 0 N--CA 1.498 1.946 0 O-C-N 123.44 0.462 . . . . 0.0 110.408 -179.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -47.16 -60.98 2.11 Favored 'General case' 0 N--CA 1.5 2.029 0 C-N-CA 120.467 -0.493 . . . . 0.0 111.55 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 53.2 t -41.74 -52.32 3.94 Favored 'General case' 0 N--CA 1.505 2.31 0 CA-C-O 121.443 0.639 . . . . 0.0 111.107 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -54.7 -56.14 22.34 Favored 'General case' 0 N--CA 1.492 1.66 0 CA-C-N 115.168 -0.924 . . . . 0.0 109.555 179.715 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 36.0 t80 -37.12 -27.54 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.943 0 O-C-N 124.756 1.285 . . . . 0.0 113.01 179.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -97.06 -49.81 4.85 Favored 'General case' 0 N--CA 1.503 2.224 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 -179.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 47.6 t -91.08 -41.16 11.21 Favored 'General case' 0 N--CA 1.504 2.272 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -179.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.41 ' CD2' ' SG ' ' A' ' 1' ' ' CYS . 33.9 m-70 -89.58 -17.14 29.09 Favored 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -125.85 41.47 3.51 Favored 'General case' 0 N--CA 1.501 2.104 0 N-CA-C 116.975 2.213 . . . . 0.0 116.975 -179.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 43.3 m-20 -119.78 -82.1 0.64 Allowed 'General case' 0 N--CA 1.507 2.402 0 N-CA-C 114.168 1.173 . . . . 0.0 114.168 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.7 t -119.92 156.35 22.62 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.245 0 CA-C-N 118.757 0.708 . . . . 0.0 109.986 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 61.3 mt . . . . . 0 N--CA 1.495 1.818 0 CA-C-N 114.112 -1.404 . . . . 0.0 108.155 179.962 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.3 m . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.008 0.432 . . . . 0.0 110.382 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 29.0 t -123.98 -174.76 3.06 Favored 'General case' 0 N--CA 1.499 2.008 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 91.2 m -130.92 -48.42 1.03 Allowed 'General case' 0 N--CA 1.495 1.776 0 CA-C-N 115.177 -0.919 . . . . 0.0 109.553 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 34.7 ttmt 9.61 58.11 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.533 0 O-C-N 126.916 2.635 . . . . 0.0 113.119 -179.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.6 t70 166.54 -44.49 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.89 0 CA-C-N 112.752 -2.022 . . . . 0.0 106.267 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 3.6 mpp? -98.34 -175.23 3.05 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 124.209 0.943 . . . . 0.0 111.623 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 55.2 p -94.39 -94.2 0.17 Allowed 'General case' 0 N--CA 1.496 1.838 0 CA-C-N 114.939 -1.028 . . . . 0.0 110.926 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -145.02 -60.05 0.35 Allowed 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 24.5 tptt -46.74 -53.46 11.77 Favored 'General case' 0 N--CA 1.503 2.184 0 CA-C-O 122.135 0.969 . . . . 0.0 109.425 -179.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -53.63 -64.86 0.69 Allowed 'General case' 0 N--CA 1.495 1.779 0 CA-C-N 113.316 -1.765 . . . . 0.0 107.399 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 9.3 m -32.26 -56.54 0.33 Allowed 'General case' 0 N--CA 1.501 2.083 0 CA-C-N 113.896 -1.502 . . . . 0.0 111.17 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.424 HD21 ' CD2' ' A' ' 16' ' ' HIS . 3.0 mt -52.95 -56.2 17.72 Favored 'General case' 0 N--CA 1.49 1.569 0 CA-C-N 113.832 -1.531 . . . . 0.0 112.62 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 35.1 t80 -38.71 -34.76 0.16 Allowed 'General case' 0 N--CA 1.499 1.977 0 CA-C-N 114.808 -1.087 . . . . 0.0 112.689 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -90.08 -51.89 5.23 Favored 'General case' 0 N--CA 1.498 1.971 0 CA-C-N 113.809 -1.541 . . . . 0.0 111.033 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 48.3 t -78.7 -64.48 1.17 Allowed 'General case' 0 N--CA 1.497 1.915 0 O-C-N 123.645 0.591 . . . . 0.0 112.169 -179.74 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.424 ' CD2' HD21 ' A' ' 12' ' ' LEU . 1.5 m-70 -45.68 -55.39 6.49 Favored 'General case' 0 N--CA 1.503 2.216 0 CA-C-O 121.831 0.824 . . . . 0.0 111.994 179.842 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 54.53 66.65 1.18 Allowed 'General case' 0 N--CA 1.488 1.446 0 CA-C-N 112.153 -2.294 . . . . 0.0 108.451 -179.66 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -90.62 -44.9 9.23 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-N 113.39 -1.732 . . . . 0.0 111.388 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 35.9 m -114.65 140.75 34.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 123.883 0.739 . . . . 0.0 110.721 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 14.2 tt . . . . . 0 N--CA 1.493 1.693 0 CA-C-N 114.083 -1.417 . . . . 0.0 108.625 179.999 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 84.3 m . . . . . 0 N--CA 1.49 1.567 0 CA-C-O 121.752 0.787 . . . . 0.0 111.849 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 43.5 t -120.42 79.42 1.47 Allowed 'General case' 0 N--CA 1.488 1.445 0 CA-C-N 113.638 -1.619 . . . . 0.0 107.518 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.2 m -75.63 -44.63 41.76 Favored 'General case' 0 N--CA 1.497 1.91 0 CA-C-N 114.744 -1.116 . . . . 0.0 108.166 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 19.1 tptm 54.4 82.8 0.09 Allowed 'General case' 0 N--CA 1.498 1.972 0 CA-C-N 115.001 -0.999 . . . . 0.0 112.495 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 65.42 44.01 3.26 Favored 'General case' 0 N--CA 1.504 2.237 0 N-CA-C 117.402 2.371 . . . . 0.0 117.402 179.875 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 38.1 mtm -130.54 -165.04 1.49 Allowed 'General case' 0 N--CA 1.5 2.064 0 N-CA-C 106.38 -1.711 . . . . 0.0 106.38 179.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 44.8 p -100.65 -153.18 0.44 Allowed 'General case' 0 N--CA 1.503 2.179 0 N-CA-C 107.029 -1.471 . . . . 0.0 107.029 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -108.57 -61.96 1.53 Allowed 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 106.292 -1.744 . . . . 0.0 106.292 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 35.7 ttmt -43.24 -45.41 5.74 Favored 'General case' 0 N--CA 1.5 2.062 0 CA-C-O 121.388 0.613 . . . . 0.0 112.022 179.725 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -69.13 -59.77 2.8 Favored 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 42.6 t -36.64 -49.29 0.75 Allowed 'General case' 0 N--CA 1.503 2.198 0 O-C-N 124.9 1.375 . . . . 0.0 111.721 179.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -53.65 -57.79 9.52 Favored 'General case' 0 N--CA 1.486 1.344 0 CA-C-N 114.637 -1.165 . . . . 0.0 110.784 179.831 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 36.5 t80 -43.11 -23.04 0.04 OUTLIER 'General case' 0 N--CA 1.503 2.204 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.437 ' N ' ' CD1' ' A' ' 14' ' ' PHE . 1.3 m-85 -96.05 -47.29 6.15 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 124.072 0.857 . . . . 0.0 110.384 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 51.6 t -95.01 -50.0 5.29 Favored 'General case' 0 N--CA 1.502 2.163 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 34.7 m170 -90.4 -66.05 0.96 Allowed 'General case' 0 N--CA 1.507 2.379 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 64.5 47.6 2.92 Favored 'General case' 0 N--CA 1.499 2.008 0 N-CA-C 113.31 0.856 . . . . 0.0 113.31 179.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -25.35 -67.0 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.201 0 N-CA-C 114.341 1.238 . . . . 0.0 114.341 179.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 3.5 p -120.97 149.23 23.89 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 CA-C-N 114.466 -1.243 . . . . 0.0 110.226 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 15.8 tt . . . . . 0 N--CA 1.49 1.533 0 CA-C-N 112.404 -2.18 . . . . 0.0 108.291 179.938 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 34.2 m . . . . . 0 N--CA 1.493 1.706 0 CA-C-O 121.297 0.57 . . . . 0.0 110.481 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.9 m -114.23 126.2 54.77 Favored 'General case' 0 N--CA 1.5 2.026 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.775 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 78.1 m -114.28 69.56 0.71 Allowed 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.83 112.54 24.25 Favored 'General case' 0 N--CA 1.499 2.007 0 N-CA-C 105.045 -2.205 . . . . 0.0 105.045 -179.83 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 44.7 62.77 1.93 Allowed 'General case' 0 N--CA 1.497 1.917 0 CA-C-O 122.927 1.346 . . . . 0.0 112.265 -179.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 13.9 mmm -117.13 -177.6 3.25 Favored 'General case' 0 N--CA 1.499 1.987 0 CA-C-N 112.132 -2.304 . . . . 0.0 106.022 179.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 75.9 p -109.42 17.47 21.41 Favored 'General case' 0 N--CA 1.506 2.372 0 C-N-CA 119.87 -0.732 . . . . 0.0 110.491 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 10.3 t70 76.6 -66.2 0.27 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 124.983 1.427 . . . . 0.0 109.609 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 77.0 tttt -49.18 -53.87 19.08 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 123.714 0.634 . . . . 0.0 109.69 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 58.2 mm-40 -52.57 -59.32 4.59 Favored 'General case' 0 N--CA 1.494 1.763 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.926 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 8.5 t -46.3 -46.97 18.41 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 124.165 0.916 . . . . 0.0 110.557 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -54.06 -52.51 60.67 Favored 'General case' 0 N--CA 1.496 1.832 0 CA-C-O 120.889 0.376 . . . . 0.0 110.96 179.721 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -51.87 -14.38 0.37 Allowed 'General case' 0 N--CA 1.499 2.017 0 CA-C-N 115.073 -0.967 . . . . 0.0 112.721 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -104.03 -47.38 4.19 Favored 'General case' 0 N--CA 1.498 1.957 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.933 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 52.5 t -101.43 -45.28 5.36 Favored 'General case' 0 N--CA 1.505 2.292 0 N-CA-C 114.708 1.373 . . . . 0.0 114.708 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 39.2 m170 -94.29 36.9 1.12 Allowed 'General case' 0 N--CA 1.503 2.179 0 CA-C-O 121.796 0.808 . . . . 0.0 109.603 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -120.32 43.1 2.8 Favored 'General case' 0 N--CA 1.496 1.828 0 CA-C-N 114.19 -1.368 . . . . 0.0 107.821 179.756 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -123.67 41.55 3.45 Favored 'General case' 0 N--CA 1.496 1.846 0 N-CA-C 105.992 -1.855 . . . . 0.0 105.992 179.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 37.6 t -125.53 174.05 10.26 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 CA-C-N 113.005 -1.907 . . . . 0.0 107.459 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 18.2 tt . . . . . 0 N--CA 1.496 1.835 0 CA-C-O 121.967 0.889 . . . . 0.0 111.574 -179.72 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 67.6 m . . . . . 0 N--CA 1.493 1.708 0 CA-C-O 120.632 0.253 . . . . 0.0 110.631 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.3 t -120.08 111.0 17.32 Favored 'General case' 0 N--CA 1.497 1.889 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.079 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 78.4 m -110.65 34.81 3.76 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 106.768 -1.567 . . . . 0.0 106.768 179.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.38 124.35 11.7 Favored 'General case' 0 N--CA 1.496 1.85 0 CA-C-N 114.8 -1.091 . . . . 0.0 110.433 179.784 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.8 t70 45.12 45.42 9.17 Favored 'General case' 0 N--CA 1.497 1.894 0 CA-C-N 114.09 -1.413 . . . . 0.0 110.984 -179.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 1.1 mmm -126.34 -177.3 3.93 Favored 'General case' 0 N--CA 1.496 1.829 0 CA-C-N 113.67 -1.604 . . . . 0.0 107.58 179.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.8 t -111.99 -154.4 0.54 Allowed 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 106.646 -1.613 . . . . 0.0 106.646 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -98.42 -75.27 0.56 Allowed 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 -179.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -40.73 -51.89 3.02 Favored 'General case' 0 N--CA 1.504 2.266 0 CA-C-O 121.568 0.699 . . . . 0.0 111.343 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 76.7 tt0 -53.36 -62.44 1.65 Allowed 'General case' 0 N--CA 1.492 1.627 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.49 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 25.6 t -49.1 -46.12 44.31 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 123.862 0.726 . . . . 0.0 112.44 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 1.1 mt -48.93 -48.52 42.74 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 123.79 0.681 . . . . 0.0 111.404 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 40.7 t80 -49.29 -22.7 1.13 Allowed 'General case' 0 N--CA 1.5 2.069 0 CA-C-N 115.552 -0.749 . . . . 0.0 112.532 179.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -104.5 -20.89 13.55 Favored 'General case' 0 N--CA 1.501 2.125 0 O-C-N 123.646 0.591 . . . . 0.0 111.257 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 37.4 t -108.91 -58.02 2.07 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 123.884 0.74 . . . . 0.0 111.874 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 11.1 m170 -72.25 -36.06 68.96 Favored 'General case' 0 N--CA 1.498 1.97 0 N-CA-C 112.332 0.494 . . . . 0.0 112.332 179.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -112.32 54.26 0.71 Allowed 'General case' 0 N--CA 1.495 1.794 0 CA-C-O 122.829 1.299 . . . . 0.0 107.736 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -100.72 -45.28 5.54 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 112.923 -1.944 . . . . 0.0 111.053 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 28.8 m -94.9 163.43 2.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 123.818 0.699 . . . . 0.0 109.848 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 55.1 mt . . . . . 0 N--CA 1.495 1.805 0 O-C-N 124.622 1.201 . . . . 0.0 110.468 -179.72 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.469 ' SG ' ' CD2' ' A' ' 16' ' ' HIS . 63.6 m . . . . . 0 N--CA 1.493 1.696 0 CA-C-O 121.531 0.682 . . . . 0.0 111.42 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 71.0 p -128.12 126.22 40.7 Favored 'General case' 0 N--CA 1.492 1.65 0 CA-C-N 114.062 -1.426 . . . . 0.0 110.207 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 14.6 m -120.6 80.94 1.69 Allowed 'General case' 0 N--CA 1.496 1.865 0 N-CA-C 105.812 -1.922 . . . . 0.0 105.812 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 80.9 tttt -110.99 97.16 6.61 Favored 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 113.779 1.029 . . . . 0.0 113.779 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.3 t70 100.8 21.64 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.5 0 C-N-CA 127.762 2.425 . . . . 0.0 106.445 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -130.63 -170.95 2.44 Favored 'General case' 0 N--CA 1.494 1.74 0 CA-C-N 114.151 -1.386 . . . . 0.0 110.375 -179.842 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 55.2 p -110.72 -145.4 0.4 Allowed 'General case' 0 N--CA 1.499 1.986 0 N-CA-C 106.505 -1.665 . . . . 0.0 106.505 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -112.91 -60.27 1.9 Allowed 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 105.805 -1.924 . . . . 0.0 105.805 179.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.22 -51.88 10.14 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 124.134 0.896 . . . . 0.0 109.241 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -65.47 -55.7 16.47 Favored 'General case' 0 N--CA 1.496 1.842 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.216 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 49.0 t -40.08 -51.42 2.6 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 124.644 1.215 . . . . 0.0 110.892 179.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.434 ' C ' ' H ' ' A' ' 14' ' ' PHE . 0.7 OUTLIER -56.9 -44.59 82.5 Favored 'General case' 0 N--CA 1.495 1.794 0 CA-C-N 114.784 -1.098 . . . . 0.0 110.785 179.697 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 11.7 t80 -58.13 -3.91 0.29 Allowed 'General case' 0 N--CA 1.493 1.711 0 CA-C-N 115.054 -0.975 . . . . 0.0 111.4 179.593 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.434 ' H ' ' C ' ' A' ' 12' ' ' LEU . 2.6 m-85 -116.66 -46.0 2.77 Favored 'General case' 0 N--CA 1.504 2.236 0 C-N-CA 123.219 0.608 . . . . 0.0 110.775 -179.8 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 21.2 t -98.97 -37.04 9.54 Favored 'General case' 0 N--CA 1.5 2.071 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.469 ' CD2' ' SG ' ' A' ' 1' ' ' CYS . 30.6 m170 -102.74 40.08 1.43 Allowed 'General case' 0 N--CA 1.502 2.171 0 CA-C-O 121.515 0.674 . . . . 0.0 109.897 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -112.72 45.07 1.37 Allowed 'General case' 0 N--CA 1.497 1.921 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 179.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -107.02 70.22 0.79 Allowed 'General case' 0 N--CA 1.489 1.525 0 CA-C-N 113.035 -1.893 . . . . 0.0 109.658 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 34.0 m -102.84 133.04 47.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 CA-C-N 112.746 -2.024 . . . . 0.0 109.406 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 19.2 tt -126.37 54.53 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 CA-C-O 123.357 1.551 . . . . 0.0 108.175 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . 0.449 ' CE3' ' N ' ' A' ' 21' ' ' TRP . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.748 0 CA-C-N 112.61 -2.086 . . . . 0.0 112.159 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 60.3 m . . . . . 0 N--CA 1.489 1.507 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.6 p 14.97 83.75 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.547 0 N-CA-C 115.165 1.543 . . . . 0.0 115.165 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 66.2 m -94.99 65.81 2.95 Favored 'General case' 0 N--CA 1.494 1.747 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.041 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -104.05 137.92 41.32 Favored 'General case' 0 N--CA 1.496 1.865 0 CA-C-N 113.933 -1.485 . . . . 0.0 108.283 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.7 t70 52.91 31.97 11.74 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 114.213 -1.358 . . . . 0.0 110.302 -179.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 4.1 mtp -133.86 173.75 11.2 Favored 'General case' 0 N--CA 1.503 2.207 0 CA-C-N 114.452 -1.249 . . . . 0.0 108.756 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 61.9 p -112.52 163.9 13.94 Favored 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 106.364 -1.717 . . . . 0.0 106.364 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 28.1 m-20 -47.61 -67.63 0.26 Allowed 'General case' 0 N--CA 1.497 1.908 0 O-C-N 123.906 0.754 . . . . 0.0 111.947 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 23.1 ttmm -47.28 -53.2 14.08 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 123.988 0.805 . . . . 0.0 111.839 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -49.8 -60.47 2.87 Favored 'General case' 0 N--CA 1.498 1.955 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.367 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 6.6 t -49.48 -49.82 43.96 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 124.381 1.05 . . . . 0.0 110.494 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.417 HD11 ' CE1' ' A' ' 16' ' ' HIS . 1.3 mt -49.85 -52.99 28.37 Favored 'General case' 0 N--CA 1.498 1.931 0 CA-C-O 121.716 0.77 . . . . 0.0 111.522 179.76 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -48.18 -21.64 0.52 Allowed 'General case' 0 N--CA 1.498 1.929 0 CA-C-N 114.684 -1.144 . . . . 0.0 113.201 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -102.7 -39.65 6.95 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 123.743 0.652 . . . . 0.0 109.543 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 16.1 t -89.99 -68.09 0.8 Allowed 'General case' 0 N--CA 1.498 1.933 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.899 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.417 ' CE1' HD11 ' A' ' 12' ' ' LEU . 3.7 m170 -47.26 -42.73 21.19 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 123.652 0.595 . . . . 0.0 110.633 179.659 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 36.7 tt0 69.92 67.92 0.23 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 125.646 1.841 . . . . 0.0 106.608 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -106.14 73.25 0.97 Allowed 'General case' 0 N--CA 1.492 1.665 0 CA-C-N 112.836 -1.984 . . . . 0.0 108.973 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 26.8 m -106.25 168.69 2.81 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 CA-C-N 112.568 -2.105 . . . . 0.0 107.41 179.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 18.3 tt -124.99 117.91 51.52 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.022 0 CA-C-O 121.383 0.611 . . . . 0.0 111.66 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 50.5 m95 . . . . . 0 N--CA 1.496 1.828 0 CA-C-N 114.573 -1.194 . . . . 0.0 108.61 179.684 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 83.7 m . . . . . 0 N--CA 1.493 1.701 0 CA-C-O 121.319 0.581 . . . . 0.0 111.462 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.2 t -132.69 159.56 39.27 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-N 113.867 -1.515 . . . . 0.0 108.716 179.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 68.1 m -126.39 24.43 6.75 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 124.289 0.993 . . . . 0.0 109.636 179.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.4 tppt? -24.5 126.16 0.04 OUTLIER 'General case' 0 N--CA 1.512 2.651 0 O-C-N 124.563 1.165 . . . . 0.0 111.863 179.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.3 p30 33.69 35.0 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.362 0 N-CA-C 116.364 1.987 . . . . 0.0 116.364 -179.457 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 23.8 mtm -122.6 -170.04 2.02 Favored 'General case' 0 N--CA 1.505 2.29 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 179.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.7 t -110.61 -159.14 0.67 Allowed 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 106.333 -1.728 . . . . 0.0 106.333 179.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -103.2 -61.46 1.41 Allowed 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -37.25 -36.46 0.14 Allowed 'General case' 0 N--CA 1.501 2.082 0 O-C-N 124.943 1.402 . . . . 0.0 112.987 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -87.62 -54.72 4.12 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-N 114.731 -1.122 . . . . 0.0 108.942 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 20.8 t -41.14 -44.06 2.43 Favored 'General case' 0 N--CA 1.505 2.276 0 CA-C-O 122.019 0.914 . . . . 0.0 110.556 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.433 HD11 ' ND1' ' A' ' 16' ' ' HIS . 0.8 OUTLIER -52.37 -56.38 15.32 Favored 'General case' 0 N--CA 1.489 1.525 0 CA-C-N 114.323 -1.308 . . . . 0.0 111.243 179.739 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 47.0 t80 -47.05 -26.92 1.17 Allowed 'General case' 0 N--CA 1.498 1.967 0 CA-C-N 114.476 -1.238 . . . . 0.0 112.72 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -89.84 -43.31 10.72 Favored 'General case' 0 N--CA 1.498 1.959 0 CA-C-N 114.428 -1.26 . . . . 0.0 110.728 -179.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 49.4 t -99.91 -63.05 1.16 Allowed 'General case' 0 N--CA 1.5 2.074 0 O-C-N 123.724 0.64 . . . . 0.0 111.886 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.433 ' ND1' HD11 ' A' ' 12' ' ' LEU . 11.7 m170 -50.71 -40.06 53.22 Favored 'General case' 0 N--CA 1.504 2.26 0 CA-C-O 121.19 0.519 . . . . 0.0 111.609 179.818 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -118.59 51.22 1.11 Allowed 'General case' 0 N--CA 1.493 1.688 0 CA-C-N 114.074 -1.421 . . . . 0.0 108.68 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 59.3 t0 -69.38 -48.84 59.98 Favored 'General case' 0 N--CA 1.493 1.718 0 CA-C-N 113.471 -1.695 . . . . 0.0 106.716 179.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.9 p -120.16 168.18 12.78 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.908 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 179.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 42.1 mm -123.34 141.12 44.8 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 124.579 1.174 . . . . 0.0 111.304 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 49.4 m95 . . . . . 0 N--CA 1.494 1.754 0 CA-C-O 116.791 -1.576 . . . . 0.0 110.294 179.763 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 39.1 m . . . . . 0 N--CA 1.492 1.64 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.1 m -120.85 151.17 39.97 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.782 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 67.9 m -125.51 73.9 1.36 Allowed 'General case' 0 N--CA 1.497 1.922 0 N-CA-C 106.296 -1.742 . . . . 0.0 106.296 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -108.73 103.21 12.25 Favored 'General case' 0 N--CA 1.495 1.822 0 CA-C-N 113.949 -1.478 . . . . 0.0 111.505 -179.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.3 t70 90.34 37.53 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.121 0 O-C-N 125.871 1.982 . . . . 0.0 107.644 179.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -136.05 -177.2 4.59 Favored 'General case' 0 N--CA 1.493 1.702 0 CA-C-N 112.956 -1.929 . . . . 0.0 109.619 179.815 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 40.7 p -107.5 -114.86 0.27 Allowed 'General case' 0 N--CA 1.496 1.848 0 N-CA-C 104.984 -2.228 . . . . 0.0 104.984 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -130.18 -64.83 0.84 Allowed 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 106.618 -1.623 . . . . 0.0 106.618 179.601 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.6 ttmt -52.17 -49.32 64.04 Favored 'General case' 0 N--CA 1.493 1.689 0 CA-C-N 113.77 -1.559 . . . . 0.0 112.547 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -59.02 -55.63 32.68 Favored 'General case' 0 N--CA 1.498 1.966 0 C-N-CA 119.796 -0.762 . . . . 0.0 109.431 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 27.2 t -44.57 -51.26 9.14 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 124.258 0.974 . . . . 0.0 109.64 179.698 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.429 HD21 ' CD2' ' A' ' 16' ' ' HIS . 0.6 OUTLIER -52.86 -53.93 41.85 Favored 'General case' 0 N--CA 1.496 1.871 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.161 179.565 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 40.9 t80 -45.77 -18.7 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.104 0 CA-C-N 115.073 -0.967 . . . . 0.0 113.139 179.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.404 ' CD1' ' N ' ' A' ' 14' ' ' PHE . 1.7 m-85 -103.03 -41.17 6.19 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 124.186 0.929 . . . . 0.0 111.831 -179.798 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 42.2 t -97.42 -51.01 4.31 Favored 'General case' 0 N--CA 1.503 2.176 0 N-CA-C 114.277 1.214 . . . . 0.0 114.277 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.429 ' CD2' HD21 ' A' ' 12' ' ' LEU . 42.1 m-70 -79.45 -22.97 43.46 Favored 'General case' 0 N--CA 1.496 1.84 0 N-CA-C 114.855 1.428 . . . . 0.0 114.855 -179.698 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -118.17 40.48 3.16 Favored 'General case' 0 N--CA 1.5 2.074 0 N-CA-C 114.803 1.408 . . . . 0.0 114.803 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -125.26 -73.51 0.63 Allowed 'General case' 0 N--CA 1.504 2.246 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.377 179.558 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 19.7 m -120.42 146.12 25.77 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.358 0 O-C-N 124.57 1.169 . . . . 0.0 109.969 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 19.2 tt -128.48 53.35 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 CA-C-O 124.064 1.888 . . . . 0.0 106.834 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . 0.467 ' CE3' ' N ' ' A' ' 21' ' ' TRP . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.493 0 CA-C-N 111.723 -2.489 . . . . 0.0 112.469 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 87.1 m . . . . . 0 N--CA 1.493 1.69 0 CA-C-O 121.14 0.495 . . . . 0.0 111.57 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 53.1 m -116.2 89.09 3.03 Favored 'General case' 0 N--CA 1.496 1.827 0 CA-C-N 114.62 -1.173 . . . . 0.0 108.702 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 46.9 m -104.08 58.96 0.72 Allowed 'General case' 0 N--CA 1.499 2.006 0 CA-C-N 114.671 -1.15 . . . . 0.0 110.075 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -67.99 115.6 7.69 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-N 114.357 -1.292 . . . . 0.0 110.411 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.3 t70 59.18 39.74 22.52 Favored 'General case' 0 N--CA 1.498 1.952 0 CA-C-N 114.049 -1.432 . . . . 0.0 110.293 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 4.9 mtp -131.12 -178.59 4.9 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-N 113.906 -1.497 . . . . 0.0 108.532 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 60.3 p -108.89 -157.07 0.6 Allowed 'General case' 0 N--CA 1.501 2.101 0 N-CA-C 105.851 -1.907 . . . . 0.0 105.851 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -105.47 -67.74 0.9 Allowed 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 104.357 -2.46 . . . . 0.0 104.357 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.4 tpmt? -34.51 -46.98 0.3 Allowed 'General case' 0 N--CA 1.501 2.085 0 O-C-N 124.731 1.269 . . . . 0.0 113.326 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -80.28 -54.68 5.51 Favored 'General case' 0 N--CA 1.492 1.65 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.542 -179.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 48.0 t -44.32 -43.34 7.4 Favored 'General case' 0 N--CA 1.503 2.215 0 CA-C-O 121.615 0.722 . . . . 0.0 111.321 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.42 HD21 ' CD2' ' A' ' 16' ' ' HIS . 0.6 OUTLIER -53.35 -44.06 68.23 Favored 'General case' 0 N--CA 1.494 1.728 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.727 179.7 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 44.5 t80 -51.5 -17.67 0.87 Allowed 'General case' 0 N--CA 1.5 2.066 0 CA-C-N 115.245 -0.889 . . . . 0.0 111.535 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -106.27 -49.54 3.34 Favored 'General case' 0 N--CA 1.494 1.741 0 CA-C-N 114.92 -1.037 . . . . 0.0 112.489 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 42.1 t -104.77 16.78 25.35 Favored 'General case' 0 N--CA 1.505 2.317 0 N-CA-C 118.048 2.611 . . . . 0.0 118.048 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.42 ' CD2' HD21 ' A' ' 12' ' ' LEU . 1.1 m-70 -133.95 -47.22 0.79 Allowed 'General case' 0 N--CA 1.501 2.107 0 CA-C-O 120.809 0.338 . . . . 0.0 110.365 179.706 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 27.4 tt0 45.73 44.78 10.9 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 125.025 1.453 . . . . 0.0 109.047 -179.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -47.04 -50.88 18.71 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-N 113.69 -1.595 . . . . 0.0 110.233 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 12.2 p -124.22 158.54 30.73 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.759 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.032 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 18.6 tt -156.62 152.47 7.96 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 CA-C-N 112.875 -1.966 . . . . 0.0 108.895 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 63.0 m95 . . . . . 0 N--CA 1.494 1.752 0 CA-C-O 116.659 -1.639 . . . . 0.0 109.529 179.709 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.41 ' SG ' ' CD2' ' A' ' 16' ' ' HIS . 80.6 m . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.583 0.706 . . . . 0.0 112.393 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.7 t -132.5 125.6 31.0 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 106.788 -1.56 . . . . 0.0 106.788 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 93.2 m -123.24 74.79 1.26 Allowed 'General case' 0 N--CA 1.497 1.894 0 N-CA-C 114.249 1.203 . . . . 0.0 114.249 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.478 ' O ' ' SD ' ' A' ' 6' ' ' MET . 91.7 mttt -96.04 168.11 10.81 Favored 'General case' 0 N--CA 1.498 1.953 0 N-CA-C 106.51 -1.663 . . . . 0.0 106.51 179.617 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.1 p30 29.44 35.18 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.438 0 N-CA-C 115.501 1.667 . . . . 0.0 115.501 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' MET . . . . . 0.478 ' SD ' ' O ' ' A' ' 4' ' ' LYS . 0.6 OUTLIER -142.13 -173.18 3.75 Favored 'General case' 0 N--CA 1.495 1.812 0 CA-C-N 113.479 -1.691 . . . . 0.0 108.196 179.77 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.8 t -112.83 -136.87 0.37 Allowed 'General case' 0 N--CA 1.495 1.776 0 N-CA-C 103.837 -2.653 . . . . 0.0 103.837 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -112.62 -68.14 0.95 Allowed 'General case' 0 N--CA 1.497 1.918 0 CA-C-N 119.051 0.841 . . . . 0.0 112.977 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.4 tmtt? -45.85 -62.17 1.42 Allowed 'General case' 0 N--CA 1.498 1.946 0 O-C-N 123.44 0.462 . . . . 0.0 110.408 -179.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -47.16 -60.98 2.11 Favored 'General case' 0 N--CA 1.5 2.029 0 C-N-CA 120.467 -0.493 . . . . 0.0 111.55 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 53.2 t -41.74 -52.32 3.94 Favored 'General case' 0 N--CA 1.505 2.31 0 CA-C-O 121.443 0.639 . . . . 0.0 111.107 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -54.7 -56.14 22.34 Favored 'General case' 0 N--CA 1.492 1.66 0 CA-C-N 115.168 -0.924 . . . . 0.0 109.555 179.715 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 36.0 t80 -37.12 -27.54 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.943 0 O-C-N 124.756 1.285 . . . . 0.0 113.01 179.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -97.06 -49.81 4.85 Favored 'General case' 0 N--CA 1.503 2.224 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 -179.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 47.6 t -91.08 -41.16 11.21 Favored 'General case' 0 N--CA 1.504 2.272 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -179.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.41 ' CD2' ' SG ' ' A' ' 1' ' ' CYS . 33.9 m-70 -89.58 -17.14 29.09 Favored 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -125.85 41.47 3.51 Favored 'General case' 0 N--CA 1.501 2.104 0 N-CA-C 116.975 2.213 . . . . 0.0 116.975 -179.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 43.3 m-20 -119.78 -82.1 0.64 Allowed 'General case' 0 N--CA 1.507 2.402 0 N-CA-C 114.168 1.173 . . . . 0.0 114.168 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.7 t -119.92 156.35 22.62 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.245 0 CA-C-N 118.757 0.708 . . . . 0.0 109.986 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 61.3 mt -126.88 121.84 59.12 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 CA-C-N 114.112 -1.404 . . . . 0.0 108.155 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . 0.467 ' CE3' ' N ' ' A' ' 21' ' ' TRP . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.816 0 CA-C-N 114.103 -1.408 . . . . 0.0 112.052 -179.772 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.3 m . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.008 0.432 . . . . 0.0 110.382 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 29.0 t -123.98 -174.76 3.06 Favored 'General case' 0 N--CA 1.499 2.008 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 91.2 m -130.92 -48.42 1.03 Allowed 'General case' 0 N--CA 1.495 1.776 0 CA-C-N 115.177 -0.919 . . . . 0.0 109.553 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 34.7 ttmt 9.61 58.11 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.533 0 O-C-N 126.916 2.635 . . . . 0.0 113.119 -179.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.6 t70 166.54 -44.49 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.89 0 CA-C-N 112.752 -2.022 . . . . 0.0 106.267 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 3.6 mpp? -98.34 -175.23 3.05 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 124.209 0.943 . . . . 0.0 111.623 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 55.2 p -94.39 -94.2 0.17 Allowed 'General case' 0 N--CA 1.496 1.838 0 CA-C-N 114.939 -1.028 . . . . 0.0 110.926 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -145.02 -60.05 0.35 Allowed 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 24.5 tptt -46.74 -53.46 11.77 Favored 'General case' 0 N--CA 1.503 2.184 0 CA-C-O 122.135 0.969 . . . . 0.0 109.425 -179.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -53.63 -64.86 0.69 Allowed 'General case' 0 N--CA 1.495 1.779 0 CA-C-N 113.316 -1.765 . . . . 0.0 107.399 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 9.3 m -32.26 -56.54 0.33 Allowed 'General case' 0 N--CA 1.501 2.083 0 CA-C-N 113.896 -1.502 . . . . 0.0 111.17 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.424 HD21 ' CD2' ' A' ' 16' ' ' HIS . 3.0 mt -52.95 -56.2 17.72 Favored 'General case' 0 N--CA 1.49 1.569 0 CA-C-N 113.832 -1.531 . . . . 0.0 112.62 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 35.1 t80 -38.71 -34.76 0.16 Allowed 'General case' 0 N--CA 1.499 1.977 0 CA-C-N 114.808 -1.087 . . . . 0.0 112.689 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -90.08 -51.89 5.23 Favored 'General case' 0 N--CA 1.498 1.971 0 CA-C-N 113.809 -1.541 . . . . 0.0 111.033 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 48.3 t -78.7 -64.48 1.17 Allowed 'General case' 0 N--CA 1.497 1.915 0 O-C-N 123.645 0.591 . . . . 0.0 112.169 -179.74 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.424 ' CD2' HD21 ' A' ' 12' ' ' LEU . 1.5 m-70 -45.68 -55.39 6.49 Favored 'General case' 0 N--CA 1.503 2.216 0 CA-C-O 121.831 0.824 . . . . 0.0 111.994 179.842 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 54.53 66.65 1.18 Allowed 'General case' 0 N--CA 1.488 1.446 0 CA-C-N 112.153 -2.294 . . . . 0.0 108.451 -179.66 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -90.62 -44.9 9.23 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-N 113.39 -1.732 . . . . 0.0 111.388 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.424 ' HB ' ' NE1' ' A' ' 21' ' ' TRP . 35.9 m -114.65 140.75 34.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 123.883 0.739 . . . . 0.0 110.721 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 14.2 tt -121.54 89.03 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 CA-C-N 114.083 -1.417 . . . . 0.0 108.625 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . 0.424 ' NE1' ' HB ' ' A' ' 19' ' ' VAL . 22.9 m95 . . . . . 0 N--CA 1.497 1.915 0 CA-C-O 116.084 -1.912 . . . . 0.0 108.896 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 84.3 m . . . . . 0 N--CA 1.49 1.567 0 CA-C-O 121.752 0.787 . . . . 0.0 111.849 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 43.5 t -120.42 79.42 1.47 Allowed 'General case' 0 N--CA 1.488 1.445 0 CA-C-N 113.638 -1.619 . . . . 0.0 107.518 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.2 m -75.63 -44.63 41.76 Favored 'General case' 0 N--CA 1.497 1.91 0 CA-C-N 114.744 -1.116 . . . . 0.0 108.166 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 19.1 tptm 54.4 82.8 0.09 Allowed 'General case' 0 N--CA 1.498 1.972 0 CA-C-N 115.001 -0.999 . . . . 0.0 112.495 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 65.42 44.01 3.26 Favored 'General case' 0 N--CA 1.504 2.237 0 N-CA-C 117.402 2.371 . . . . 0.0 117.402 179.875 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 38.1 mtm -130.54 -165.04 1.49 Allowed 'General case' 0 N--CA 1.5 2.064 0 N-CA-C 106.38 -1.711 . . . . 0.0 106.38 179.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 44.8 p -100.65 -153.18 0.44 Allowed 'General case' 0 N--CA 1.503 2.179 0 N-CA-C 107.029 -1.471 . . . . 0.0 107.029 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -108.57 -61.96 1.53 Allowed 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 106.292 -1.744 . . . . 0.0 106.292 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 35.7 ttmt -43.24 -45.41 5.74 Favored 'General case' 0 N--CA 1.5 2.062 0 CA-C-O 121.388 0.613 . . . . 0.0 112.022 179.725 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -69.13 -59.77 2.8 Favored 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 42.6 t -36.64 -49.29 0.75 Allowed 'General case' 0 N--CA 1.503 2.198 0 O-C-N 124.9 1.375 . . . . 0.0 111.721 179.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -53.65 -57.79 9.52 Favored 'General case' 0 N--CA 1.486 1.344 0 CA-C-N 114.637 -1.165 . . . . 0.0 110.784 179.831 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 36.5 t80 -43.11 -23.04 0.04 OUTLIER 'General case' 0 N--CA 1.503 2.204 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.437 ' N ' ' CD1' ' A' ' 14' ' ' PHE . 1.3 m-85 -96.05 -47.29 6.15 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 124.072 0.857 . . . . 0.0 110.384 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 51.6 t -95.01 -50.0 5.29 Favored 'General case' 0 N--CA 1.502 2.163 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 34.7 m170 -90.4 -66.05 0.96 Allowed 'General case' 0 N--CA 1.507 2.379 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 64.5 47.6 2.92 Favored 'General case' 0 N--CA 1.499 2.008 0 N-CA-C 113.31 0.856 . . . . 0.0 113.31 179.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -25.35 -67.0 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.201 0 N-CA-C 114.341 1.238 . . . . 0.0 114.341 179.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 3.5 p -120.97 149.23 23.89 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 CA-C-N 114.466 -1.243 . . . . 0.0 110.226 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 15.8 tt -147.03 71.01 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 CA-C-N 112.404 -2.18 . . . . 0.0 108.291 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . 0.446 ' CE3' ' N ' ' A' ' 21' ' ' TRP . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.687 0 CA-C-N 112.411 -2.177 . . . . 0.0 113.743 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 34.2 m . . . . . 0 N--CA 1.493 1.706 0 CA-C-O 121.297 0.57 . . . . 0.0 110.481 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.9 m -114.23 126.2 54.77 Favored 'General case' 0 N--CA 1.5 2.026 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.775 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 78.1 m -114.28 69.56 0.71 Allowed 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.83 112.54 24.25 Favored 'General case' 0 N--CA 1.499 2.007 0 N-CA-C 105.045 -2.205 . . . . 0.0 105.045 -179.83 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 44.7 62.77 1.93 Allowed 'General case' 0 N--CA 1.497 1.917 0 CA-C-O 122.927 1.346 . . . . 0.0 112.265 -179.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 13.9 mmm -117.13 -177.6 3.25 Favored 'General case' 0 N--CA 1.499 1.987 0 CA-C-N 112.132 -2.304 . . . . 0.0 106.022 179.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 75.9 p -109.42 17.47 21.41 Favored 'General case' 0 N--CA 1.506 2.372 0 C-N-CA 119.87 -0.732 . . . . 0.0 110.491 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 10.3 t70 76.6 -66.2 0.27 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 124.983 1.427 . . . . 0.0 109.609 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 77.0 tttt -49.18 -53.87 19.08 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 123.714 0.634 . . . . 0.0 109.69 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 58.2 mm-40 -52.57 -59.32 4.59 Favored 'General case' 0 N--CA 1.494 1.763 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.926 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 8.5 t -46.3 -46.97 18.41 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 124.165 0.916 . . . . 0.0 110.557 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -54.06 -52.51 60.67 Favored 'General case' 0 N--CA 1.496 1.832 0 CA-C-O 120.889 0.376 . . . . 0.0 110.96 179.721 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -51.87 -14.38 0.37 Allowed 'General case' 0 N--CA 1.499 2.017 0 CA-C-N 115.073 -0.967 . . . . 0.0 112.721 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -104.03 -47.38 4.19 Favored 'General case' 0 N--CA 1.498 1.957 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.933 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 52.5 t -101.43 -45.28 5.36 Favored 'General case' 0 N--CA 1.505 2.292 0 N-CA-C 114.708 1.373 . . . . 0.0 114.708 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 39.2 m170 -94.29 36.9 1.12 Allowed 'General case' 0 N--CA 1.503 2.179 0 CA-C-O 121.796 0.808 . . . . 0.0 109.603 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -120.32 43.1 2.8 Favored 'General case' 0 N--CA 1.496 1.828 0 CA-C-N 114.19 -1.368 . . . . 0.0 107.821 179.756 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -123.67 41.55 3.45 Favored 'General case' 0 N--CA 1.496 1.846 0 N-CA-C 105.992 -1.855 . . . . 0.0 105.992 179.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 37.6 t -125.53 174.05 10.26 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 CA-C-N 113.005 -1.907 . . . . 0.0 107.459 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 18.2 tt -99.57 80.16 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 CA-C-O 121.967 0.889 . . . . 0.0 111.574 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 42.9 m95 . . . . . 0 N--CA 1.5 2.055 0 CA-C-N 114.722 -1.126 . . . . 0.0 108.667 179.814 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 67.6 m . . . . . 0 N--CA 1.493 1.708 0 CA-C-O 120.632 0.253 . . . . 0.0 110.631 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.3 t -120.08 111.0 17.32 Favored 'General case' 0 N--CA 1.497 1.889 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.079 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 78.4 m -110.65 34.81 3.76 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 106.768 -1.567 . . . . 0.0 106.768 179.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.38 124.35 11.7 Favored 'General case' 0 N--CA 1.496 1.85 0 CA-C-N 114.8 -1.091 . . . . 0.0 110.433 179.784 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.8 t70 45.12 45.42 9.17 Favored 'General case' 0 N--CA 1.497 1.894 0 CA-C-N 114.09 -1.413 . . . . 0.0 110.984 -179.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 1.1 mmm -126.34 -177.3 3.93 Favored 'General case' 0 N--CA 1.496 1.829 0 CA-C-N 113.67 -1.604 . . . . 0.0 107.58 179.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.8 t -111.99 -154.4 0.54 Allowed 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 106.646 -1.613 . . . . 0.0 106.646 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -98.42 -75.27 0.56 Allowed 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 -179.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -40.73 -51.89 3.02 Favored 'General case' 0 N--CA 1.504 2.266 0 CA-C-O 121.568 0.699 . . . . 0.0 111.343 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 76.7 tt0 -53.36 -62.44 1.65 Allowed 'General case' 0 N--CA 1.492 1.627 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.49 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 25.6 t -49.1 -46.12 44.31 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 123.862 0.726 . . . . 0.0 112.44 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 1.1 mt -48.93 -48.52 42.74 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 123.79 0.681 . . . . 0.0 111.404 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 40.7 t80 -49.29 -22.7 1.13 Allowed 'General case' 0 N--CA 1.5 2.069 0 CA-C-N 115.552 -0.749 . . . . 0.0 112.532 179.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -104.5 -20.89 13.55 Favored 'General case' 0 N--CA 1.501 2.125 0 O-C-N 123.646 0.591 . . . . 0.0 111.257 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 37.4 t -108.91 -58.02 2.07 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 123.884 0.74 . . . . 0.0 111.874 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 11.1 m170 -72.25 -36.06 68.96 Favored 'General case' 0 N--CA 1.498 1.97 0 N-CA-C 112.332 0.494 . . . . 0.0 112.332 179.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -112.32 54.26 0.71 Allowed 'General case' 0 N--CA 1.495 1.794 0 CA-C-O 122.829 1.299 . . . . 0.0 107.736 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -100.72 -45.28 5.54 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 112.923 -1.944 . . . . 0.0 111.053 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 28.8 m -94.9 163.43 2.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 123.818 0.699 . . . . 0.0 109.848 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 55.1 mt -124.59 76.34 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.805 0 O-C-N 124.622 1.201 . . . . 0.0 110.468 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 10.6 m95 . . . . . 0 N--CA 1.504 2.25 0 CA-C-O 117.518 -1.23 . . . . 0.0 110.243 179.785 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.469 ' SG ' ' CD2' ' A' ' 16' ' ' HIS . 63.6 m . . . . . 0 N--CA 1.493 1.696 0 CA-C-O 121.531 0.682 . . . . 0.0 111.42 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 71.0 p -128.12 126.22 40.7 Favored 'General case' 0 N--CA 1.492 1.65 0 CA-C-N 114.062 -1.426 . . . . 0.0 110.207 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 14.6 m -120.6 80.94 1.69 Allowed 'General case' 0 N--CA 1.496 1.865 0 N-CA-C 105.812 -1.922 . . . . 0.0 105.812 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 80.9 tttt -110.99 97.16 6.61 Favored 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 113.779 1.029 . . . . 0.0 113.779 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.3 t70 100.8 21.64 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.5 0 C-N-CA 127.762 2.425 . . . . 0.0 106.445 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -130.63 -170.95 2.44 Favored 'General case' 0 N--CA 1.494 1.74 0 CA-C-N 114.151 -1.386 . . . . 0.0 110.375 -179.842 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 55.2 p -110.72 -145.4 0.4 Allowed 'General case' 0 N--CA 1.499 1.986 0 N-CA-C 106.505 -1.665 . . . . 0.0 106.505 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -112.91 -60.27 1.9 Allowed 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 105.805 -1.924 . . . . 0.0 105.805 179.701 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.414 ' HE2' ' C ' ' A' ' 9' ' ' LYS . 0.0 OUTLIER -45.22 -51.88 10.14 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 124.134 0.896 . . . . 0.0 109.241 179.889 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -65.47 -55.7 16.47 Favored 'General case' 0 N--CA 1.496 1.842 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.216 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 49.0 t -40.08 -51.42 2.6 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 124.644 1.215 . . . . 0.0 110.892 179.691 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.416 ' C ' ' H ' ' A' ' 14' ' ' PHE . 0.7 OUTLIER -56.9 -44.59 82.5 Favored 'General case' 0 N--CA 1.495 1.794 0 CA-C-N 114.784 -1.098 . . . . 0.0 110.785 179.697 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 11.7 t80 -58.13 -3.91 0.29 Allowed 'General case' 0 N--CA 1.493 1.711 0 CA-C-N 115.054 -0.975 . . . . 0.0 111.4 179.593 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.416 ' H ' ' C ' ' A' ' 12' ' ' LEU . 2.6 m-85 -116.66 -46.0 2.77 Favored 'General case' 0 N--CA 1.504 2.236 0 C-N-CA 123.219 0.608 . . . . 0.0 110.775 -179.8 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 21.2 t -98.97 -37.04 9.54 Favored 'General case' 0 N--CA 1.5 2.071 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.469 ' CD2' ' SG ' ' A' ' 1' ' ' CYS . 30.6 m170 -102.74 40.08 1.43 Allowed 'General case' 0 N--CA 1.502 2.171 0 CA-C-O 121.515 0.674 . . . . 0.0 109.897 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -112.72 45.07 1.37 Allowed 'General case' 0 N--CA 1.497 1.921 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 179.551 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -107.02 70.22 0.79 Allowed 'General case' 0 N--CA 1.489 1.525 0 CA-C-N 113.035 -1.893 . . . . 0.0 109.658 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 34.0 m -102.84 133.04 47.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 CA-C-N 112.746 -2.024 . . . . 0.0 109.406 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 19.2 tt . . . . . 0 N--CA 1.498 1.953 0 CA-C-O 123.357 1.551 . . . . 0.0 108.175 -179.95 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 60.3 m . . . . . 0 N--CA 1.489 1.507 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.6 p 14.97 83.75 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.547 0 N-CA-C 115.165 1.543 . . . . 0.0 115.165 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 66.2 m -94.99 65.81 2.95 Favored 'General case' 0 N--CA 1.494 1.747 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.041 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -104.05 137.92 41.32 Favored 'General case' 0 N--CA 1.496 1.865 0 CA-C-N 113.933 -1.485 . . . . 0.0 108.283 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.7 t70 52.91 31.97 11.74 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 114.213 -1.358 . . . . 0.0 110.302 -179.804 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 4.1 mtp -133.86 173.75 11.2 Favored 'General case' 0 N--CA 1.503 2.207 0 CA-C-N 114.452 -1.249 . . . . 0.0 108.756 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 61.9 p -112.52 163.9 13.94 Favored 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 106.364 -1.717 . . . . 0.0 106.364 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 28.1 m-20 -47.61 -67.63 0.26 Allowed 'General case' 0 N--CA 1.497 1.908 0 O-C-N 123.906 0.754 . . . . 0.0 111.947 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 23.1 ttmm -47.28 -53.2 14.08 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 123.988 0.805 . . . . 0.0 111.839 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -49.8 -60.47 2.87 Favored 'General case' 0 N--CA 1.498 1.955 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.367 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 6.6 t -49.48 -49.82 43.96 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 124.381 1.05 . . . . 0.0 110.494 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.45 HD13 ' CE1' ' A' ' 16' ' ' HIS . 1.3 mt -49.85 -52.99 28.37 Favored 'General case' 0 N--CA 1.498 1.931 0 CA-C-O 121.716 0.77 . . . . 0.0 111.522 179.76 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -48.18 -21.64 0.52 Allowed 'General case' 0 N--CA 1.498 1.929 0 CA-C-N 114.684 -1.144 . . . . 0.0 113.201 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -102.7 -39.65 6.95 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 123.743 0.652 . . . . 0.0 109.543 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 16.1 t -89.99 -68.09 0.8 Allowed 'General case' 0 N--CA 1.498 1.933 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.899 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.45 ' CE1' HD13 ' A' ' 12' ' ' LEU . 3.7 m170 -47.26 -42.73 21.19 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 123.652 0.595 . . . . 0.0 110.633 179.659 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 36.7 tt0 69.92 67.92 0.23 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 125.646 1.841 . . . . 0.0 106.608 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -106.14 73.25 0.97 Allowed 'General case' 0 N--CA 1.492 1.665 0 CA-C-N 112.836 -1.984 . . . . 0.0 108.973 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 26.8 m -106.25 168.69 2.81 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 CA-C-N 112.568 -2.105 . . . . 0.0 107.41 179.701 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 18.3 tt . . . . . 0 N--CA 1.499 2.022 0 CA-C-O 121.383 0.611 . . . . 0.0 111.66 -179.909 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 83.7 m . . . . . 0 N--CA 1.493 1.701 0 CA-C-O 121.319 0.581 . . . . 0.0 111.462 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.2 t -132.69 159.56 39.27 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-N 113.867 -1.515 . . . . 0.0 108.716 179.822 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 68.1 m -126.39 24.43 6.75 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 124.289 0.993 . . . . 0.0 109.636 179.646 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.4 tppt? -24.5 126.16 0.04 OUTLIER 'General case' 0 N--CA 1.512 2.651 0 O-C-N 124.563 1.165 . . . . 0.0 111.863 179.471 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.3 p30 33.69 35.0 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.362 0 N-CA-C 116.364 1.987 . . . . 0.0 116.364 -179.457 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 23.8 mtm -122.6 -170.04 2.02 Favored 'General case' 0 N--CA 1.505 2.29 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 179.47 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.7 t -110.61 -159.14 0.67 Allowed 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 106.333 -1.728 . . . . 0.0 106.333 179.805 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -103.2 -61.46 1.41 Allowed 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -37.25 -36.46 0.14 Allowed 'General case' 0 N--CA 1.501 2.082 0 O-C-N 124.943 1.402 . . . . 0.0 112.987 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -87.62 -54.72 4.12 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-N 114.731 -1.122 . . . . 0.0 108.942 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 20.8 t -41.14 -44.06 2.43 Favored 'General case' 0 N--CA 1.505 2.276 0 CA-C-O 122.019 0.914 . . . . 0.0 110.556 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.457 HD13 ' ND1' ' A' ' 16' ' ' HIS . 0.8 OUTLIER -52.37 -56.38 15.32 Favored 'General case' 0 N--CA 1.489 1.525 0 CA-C-N 114.323 -1.308 . . . . 0.0 111.243 179.739 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 47.0 t80 -47.05 -26.92 1.17 Allowed 'General case' 0 N--CA 1.498 1.967 0 CA-C-N 114.476 -1.238 . . . . 0.0 112.72 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -89.84 -43.31 10.72 Favored 'General case' 0 N--CA 1.498 1.959 0 CA-C-N 114.428 -1.26 . . . . 0.0 110.728 -179.777 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 49.4 t -99.91 -63.05 1.16 Allowed 'General case' 0 N--CA 1.5 2.074 0 O-C-N 123.724 0.64 . . . . 0.0 111.886 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.457 ' ND1' HD13 ' A' ' 12' ' ' LEU . 11.7 m170 -50.71 -40.06 53.22 Favored 'General case' 0 N--CA 1.504 2.26 0 CA-C-O 121.19 0.519 . . . . 0.0 111.609 179.818 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -118.59 51.22 1.11 Allowed 'General case' 0 N--CA 1.493 1.688 0 CA-C-N 114.074 -1.421 . . . . 0.0 108.68 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 59.3 t0 -69.38 -48.84 59.98 Favored 'General case' 0 N--CA 1.493 1.718 0 CA-C-N 113.471 -1.695 . . . . 0.0 106.716 179.627 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.435 HG22 ' N ' ' A' ' 20' ' ' ILE . 7.9 p -120.16 168.18 12.78 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.908 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 179.643 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.435 ' N ' HG22 ' A' ' 19' ' ' VAL . 42.1 mm . . . . . 0 N--CA 1.497 1.891 0 O-C-N 124.579 1.174 . . . . 0.0 111.304 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 39.1 m . . . . . 0 N--CA 1.492 1.64 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.1 m -120.85 151.17 39.97 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.782 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 67.9 m -125.51 73.9 1.36 Allowed 'General case' 0 N--CA 1.497 1.922 0 N-CA-C 106.296 -1.742 . . . . 0.0 106.296 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -108.73 103.21 12.25 Favored 'General case' 0 N--CA 1.495 1.822 0 CA-C-N 113.949 -1.478 . . . . 0.0 111.505 -179.688 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.3 t70 90.34 37.53 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.121 0 O-C-N 125.871 1.982 . . . . 0.0 107.644 179.755 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -136.05 -177.2 4.59 Favored 'General case' 0 N--CA 1.493 1.702 0 CA-C-N 112.956 -1.929 . . . . 0.0 109.619 179.815 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 40.7 p -107.5 -114.86 0.27 Allowed 'General case' 0 N--CA 1.496 1.848 0 N-CA-C 104.984 -2.228 . . . . 0.0 104.984 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -130.18 -64.83 0.84 Allowed 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 106.618 -1.623 . . . . 0.0 106.618 179.601 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.6 ttmt -52.17 -49.32 64.04 Favored 'General case' 0 N--CA 1.493 1.689 0 CA-C-N 113.77 -1.559 . . . . 0.0 112.547 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -59.02 -55.63 32.68 Favored 'General case' 0 N--CA 1.498 1.966 0 C-N-CA 119.796 -0.762 . . . . 0.0 109.431 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 27.2 t -44.57 -51.26 9.14 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 124.258 0.974 . . . . 0.0 109.64 179.698 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -52.86 -53.93 41.85 Favored 'General case' 0 N--CA 1.496 1.871 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.161 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.519 ' HA ' ' HB2' ' A' ' 17' ' ' GLN . 40.9 t80 -45.77 -18.7 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.104 0 CA-C-N 115.073 -0.967 . . . . 0.0 113.139 179.659 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.404 ' CD1' ' N ' ' A' ' 14' ' ' PHE . 1.7 m-85 -103.03 -41.17 6.19 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 124.186 0.929 . . . . 0.0 111.831 -179.798 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 42.2 t -97.42 -51.01 4.31 Favored 'General case' 0 N--CA 1.503 2.176 0 N-CA-C 114.277 1.214 . . . . 0.0 114.277 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 57.4 m80 -79.45 -22.97 43.46 Favored 'General case' 0 N--CA 1.496 1.84 0 N-CA-C 114.855 1.428 . . . . 0.0 114.855 -179.698 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.519 ' HB2' ' HA ' ' A' ' 13' ' ' TYR . 37.4 mt-30 -118.17 40.48 3.16 Favored 'General case' 0 N--CA 1.5 2.074 0 N-CA-C 114.803 1.408 . . . . 0.0 114.803 -179.901 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -125.26 -73.51 0.63 Allowed 'General case' 0 N--CA 1.504 2.246 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.377 179.558 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 19.7 m -120.42 146.12 25.77 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.358 0 O-C-N 124.57 1.169 . . . . 0.0 109.969 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 19.2 tt . . . . . 0 N--CA 1.497 1.891 0 CA-C-O 124.064 1.888 . . . . 0.0 106.834 179.789 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 87.1 m . . . . . 0 N--CA 1.493 1.69 0 CA-C-O 121.14 0.495 . . . . 0.0 111.57 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 53.1 m -116.2 89.09 3.03 Favored 'General case' 0 N--CA 1.496 1.827 0 CA-C-N 114.62 -1.173 . . . . 0.0 108.702 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 46.9 m -104.08 58.96 0.72 Allowed 'General case' 0 N--CA 1.499 2.006 0 CA-C-N 114.671 -1.15 . . . . 0.0 110.075 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -67.99 115.6 7.69 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-N 114.357 -1.292 . . . . 0.0 110.411 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.3 t70 59.18 39.74 22.52 Favored 'General case' 0 N--CA 1.498 1.952 0 CA-C-N 114.049 -1.432 . . . . 0.0 110.293 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 4.9 mtp -131.12 -178.59 4.9 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-N 113.906 -1.497 . . . . 0.0 108.532 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 60.3 p -108.89 -157.07 0.6 Allowed 'General case' 0 N--CA 1.501 2.101 0 N-CA-C 105.851 -1.907 . . . . 0.0 105.851 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -105.47 -67.74 0.9 Allowed 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 104.357 -2.46 . . . . 0.0 104.357 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.4 tpmt? -34.51 -46.98 0.3 Allowed 'General case' 0 N--CA 1.501 2.085 0 O-C-N 124.731 1.269 . . . . 0.0 113.326 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -80.28 -54.68 5.51 Favored 'General case' 0 N--CA 1.492 1.65 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.542 -179.656 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 48.0 t -44.32 -43.34 7.4 Favored 'General case' 0 N--CA 1.503 2.215 0 CA-C-O 121.615 0.722 . . . . 0.0 111.321 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -53.35 -44.06 68.23 Favored 'General case' 0 N--CA 1.494 1.728 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.727 179.7 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 44.5 t80 -51.5 -17.67 0.87 Allowed 'General case' 0 N--CA 1.5 2.066 0 CA-C-N 115.245 -0.889 . . . . 0.0 111.535 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -106.27 -49.54 3.34 Favored 'General case' 0 N--CA 1.494 1.741 0 CA-C-N 114.92 -1.037 . . . . 0.0 112.489 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 42.1 t -104.77 16.78 25.35 Favored 'General case' 0 N--CA 1.505 2.317 0 N-CA-C 118.048 2.611 . . . . 0.0 118.048 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 1.5 m80 -133.95 -47.22 0.79 Allowed 'General case' 0 N--CA 1.501 2.107 0 CA-C-O 120.809 0.338 . . . . 0.0 110.365 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 27.4 tt0 45.73 44.78 10.9 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 125.025 1.453 . . . . 0.0 109.047 -179.672 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -47.04 -50.88 18.71 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-N 113.69 -1.595 . . . . 0.0 110.233 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 12.2 p -124.22 158.54 30.73 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.759 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.032 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 18.6 tt . . . . . 0 N--CA 1.495 1.794 0 CA-C-N 112.875 -1.966 . . . . 0.0 108.895 179.897 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 80.6 m . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.583 0.706 . . . . 0.0 112.393 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.7 t -132.5 125.6 31.0 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 106.788 -1.56 . . . . 0.0 106.788 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 93.2 m -123.24 74.79 1.26 Allowed 'General case' 0 N--CA 1.497 1.894 0 N-CA-C 114.249 1.203 . . . . 0.0 114.249 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.478 ' O ' ' SD ' ' A' ' 6' ' ' MET . 91.7 mttt -96.04 168.11 10.81 Favored 'General case' 0 N--CA 1.498 1.953 0 N-CA-C 106.51 -1.663 . . . . 0.0 106.51 179.617 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.1 p30 29.44 35.18 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.438 0 N-CA-C 115.501 1.667 . . . . 0.0 115.501 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' MET . . . . . 0.478 ' SD ' ' O ' ' A' ' 4' ' ' LYS . 0.6 OUTLIER -142.13 -173.18 3.75 Favored 'General case' 0 N--CA 1.495 1.812 0 CA-C-N 113.479 -1.691 . . . . 0.0 108.196 179.77 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.8 t -112.83 -136.87 0.37 Allowed 'General case' 0 N--CA 1.495 1.776 0 N-CA-C 103.837 -2.653 . . . . 0.0 103.837 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -112.62 -68.14 0.95 Allowed 'General case' 0 N--CA 1.497 1.918 0 CA-C-N 119.051 0.841 . . . . 0.0 112.977 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.4 tmtt? -45.85 -62.17 1.42 Allowed 'General case' 0 N--CA 1.498 1.946 0 O-C-N 123.44 0.462 . . . . 0.0 110.408 -179.765 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -47.16 -60.98 2.11 Favored 'General case' 0 N--CA 1.5 2.029 0 C-N-CA 120.467 -0.493 . . . . 0.0 111.55 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 53.2 t -41.74 -52.32 3.94 Favored 'General case' 0 N--CA 1.505 2.31 0 CA-C-O 121.443 0.639 . . . . 0.0 111.107 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -54.7 -56.14 22.34 Favored 'General case' 0 N--CA 1.492 1.66 0 CA-C-N 115.168 -0.924 . . . . 0.0 109.555 179.715 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.428 ' HA ' ' HB3' ' A' ' 17' ' ' GLN . 36.0 t80 -37.12 -27.54 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.943 0 O-C-N 124.756 1.285 . . . . 0.0 113.01 179.692 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -97.06 -49.81 4.85 Favored 'General case' 0 N--CA 1.503 2.224 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 -179.815 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 47.6 t -91.08 -41.16 11.21 Favored 'General case' 0 N--CA 1.504 2.272 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -179.562 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 16.9 m80 -89.58 -17.14 29.09 Favored 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.428 ' HB3' ' HA ' ' A' ' 13' ' ' TYR . 10.3 tt0 -125.85 41.47 3.51 Favored 'General case' 0 N--CA 1.501 2.104 0 N-CA-C 116.975 2.213 . . . . 0.0 116.975 -179.646 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 43.3 m-20 -119.78 -82.1 0.64 Allowed 'General case' 0 N--CA 1.507 2.402 0 N-CA-C 114.168 1.173 . . . . 0.0 114.168 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.7 t -119.92 156.35 22.62 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.245 0 CA-C-N 118.757 0.708 . . . . 0.0 109.986 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 61.3 mt . . . . . 0 N--CA 1.495 1.818 0 CA-C-N 114.112 -1.404 . . . . 0.0 108.155 179.962 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.3 m . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.008 0.432 . . . . 0.0 110.382 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 29.0 t -123.98 -174.76 3.06 Favored 'General case' 0 N--CA 1.499 2.008 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 91.2 m -130.92 -48.42 1.03 Allowed 'General case' 0 N--CA 1.495 1.776 0 CA-C-N 115.177 -0.919 . . . . 0.0 109.553 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 34.7 ttmt 9.61 58.11 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.533 0 O-C-N 126.916 2.635 . . . . 0.0 113.119 -179.406 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.419 ' HB3' ' SD ' ' A' ' 6' ' ' MET . 2.6 t70 166.54 -44.49 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.89 0 CA-C-N 112.752 -2.022 . . . . 0.0 106.267 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' MET . . . . . 0.419 ' SD ' ' HB3' ' A' ' 5' ' ' ASP . 3.6 mpp? -98.34 -175.23 3.05 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 124.209 0.943 . . . . 0.0 111.623 -179.918 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 55.2 p -94.39 -94.2 0.17 Allowed 'General case' 0 N--CA 1.496 1.838 0 CA-C-N 114.939 -1.028 . . . . 0.0 110.926 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -145.02 -60.05 0.35 Allowed 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 24.5 tptt -46.74 -53.46 11.77 Favored 'General case' 0 N--CA 1.503 2.184 0 CA-C-O 122.135 0.969 . . . . 0.0 109.425 -179.89 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -53.63 -64.86 0.69 Allowed 'General case' 0 N--CA 1.495 1.779 0 CA-C-N 113.316 -1.765 . . . . 0.0 107.399 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 9.3 m -32.26 -56.54 0.33 Allowed 'General case' 0 N--CA 1.501 2.083 0 CA-C-N 113.896 -1.502 . . . . 0.0 111.17 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.446 HD22 ' CD2' ' A' ' 16' ' ' HIS . 3.0 mt -52.95 -56.2 17.72 Favored 'General case' 0 N--CA 1.49 1.569 0 CA-C-N 113.832 -1.531 . . . . 0.0 112.62 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 35.1 t80 -38.71 -34.76 0.16 Allowed 'General case' 0 N--CA 1.499 1.977 0 CA-C-N 114.808 -1.087 . . . . 0.0 112.689 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -90.08 -51.89 5.23 Favored 'General case' 0 N--CA 1.498 1.971 0 CA-C-N 113.809 -1.541 . . . . 0.0 111.033 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 48.3 t -78.7 -64.48 1.17 Allowed 'General case' 0 N--CA 1.497 1.915 0 O-C-N 123.645 0.591 . . . . 0.0 112.169 -179.74 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.446 ' CD2' HD22 ' A' ' 12' ' ' LEU . 1.5 m-70 -45.68 -55.39 6.49 Favored 'General case' 0 N--CA 1.503 2.216 0 CA-C-O 121.831 0.824 . . . . 0.0 111.994 179.842 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 54.53 66.65 1.18 Allowed 'General case' 0 N--CA 1.488 1.446 0 CA-C-N 112.153 -2.294 . . . . 0.0 108.451 -179.66 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -90.62 -44.9 9.23 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-N 113.39 -1.732 . . . . 0.0 111.388 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 35.9 m -114.65 140.75 34.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 123.883 0.739 . . . . 0.0 110.721 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 14.2 tt . . . . . 0 N--CA 1.493 1.693 0 CA-C-N 114.083 -1.417 . . . . 0.0 108.625 179.999 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 84.3 m . . . . . 0 N--CA 1.49 1.567 0 CA-C-O 121.752 0.787 . . . . 0.0 111.849 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 43.5 t -120.42 79.42 1.47 Allowed 'General case' 0 N--CA 1.488 1.445 0 CA-C-N 113.638 -1.619 . . . . 0.0 107.518 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.2 m -75.63 -44.63 41.76 Favored 'General case' 0 N--CA 1.497 1.91 0 CA-C-N 114.744 -1.116 . . . . 0.0 108.166 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 19.1 tptm 54.4 82.8 0.09 Allowed 'General case' 0 N--CA 1.498 1.972 0 CA-C-N 115.001 -0.999 . . . . 0.0 112.495 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 65.42 44.01 3.26 Favored 'General case' 0 N--CA 1.504 2.237 0 N-CA-C 117.402 2.371 . . . . 0.0 117.402 179.875 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 38.1 mtm -130.54 -165.04 1.49 Allowed 'General case' 0 N--CA 1.5 2.064 0 N-CA-C 106.38 -1.711 . . . . 0.0 106.38 179.267 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 44.8 p -100.65 -153.18 0.44 Allowed 'General case' 0 N--CA 1.503 2.179 0 N-CA-C 107.029 -1.471 . . . . 0.0 107.029 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -108.57 -61.96 1.53 Allowed 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 106.292 -1.744 . . . . 0.0 106.292 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 35.7 ttmt -43.24 -45.41 5.74 Favored 'General case' 0 N--CA 1.5 2.062 0 CA-C-O 121.388 0.613 . . . . 0.0 112.022 179.725 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -69.13 -59.77 2.8 Favored 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 42.6 t -36.64 -49.29 0.75 Allowed 'General case' 0 N--CA 1.503 2.198 0 O-C-N 124.9 1.375 . . . . 0.0 111.721 179.708 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -53.65 -57.79 9.52 Favored 'General case' 0 N--CA 1.486 1.344 0 CA-C-N 114.637 -1.165 . . . . 0.0 110.784 179.831 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 36.5 t80 -43.11 -23.04 0.04 OUTLIER 'General case' 0 N--CA 1.503 2.204 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.437 ' N ' ' CD1' ' A' ' 14' ' ' PHE . 1.3 m-85 -96.05 -47.29 6.15 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 124.072 0.857 . . . . 0.0 110.384 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 51.6 t -95.01 -50.0 5.29 Favored 'General case' 0 N--CA 1.502 2.163 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 34.7 m170 -90.4 -66.05 0.96 Allowed 'General case' 0 N--CA 1.507 2.379 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.855 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 64.5 47.6 2.92 Favored 'General case' 0 N--CA 1.499 2.008 0 N-CA-C 113.31 0.856 . . . . 0.0 113.31 179.601 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -25.35 -67.0 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.201 0 N-CA-C 114.341 1.238 . . . . 0.0 114.341 179.745 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 3.5 p -120.97 149.23 23.89 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 CA-C-N 114.466 -1.243 . . . . 0.0 110.226 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 15.8 tt . . . . . 0 N--CA 1.49 1.533 0 CA-C-N 112.404 -2.18 . . . . 0.0 108.291 179.938 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 34.2 m . . . . . 0 N--CA 1.493 1.706 0 CA-C-O 121.297 0.57 . . . . 0.0 110.481 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.9 m -114.23 126.2 54.77 Favored 'General case' 0 N--CA 1.5 2.026 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.775 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 78.1 m -114.28 69.56 0.71 Allowed 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.83 112.54 24.25 Favored 'General case' 0 N--CA 1.499 2.007 0 N-CA-C 105.045 -2.205 . . . . 0.0 105.045 -179.83 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 44.7 62.77 1.93 Allowed 'General case' 0 N--CA 1.497 1.917 0 CA-C-O 122.927 1.346 . . . . 0.0 112.265 -179.508 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 13.9 mmm -117.13 -177.6 3.25 Favored 'General case' 0 N--CA 1.499 1.987 0 CA-C-N 112.132 -2.304 . . . . 0.0 106.022 179.682 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 75.9 p -109.42 17.47 21.41 Favored 'General case' 0 N--CA 1.506 2.372 0 C-N-CA 119.87 -0.732 . . . . 0.0 110.491 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 10.3 t70 76.6 -66.2 0.27 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 124.983 1.427 . . . . 0.0 109.609 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 77.0 tttt -49.18 -53.87 19.08 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 123.714 0.634 . . . . 0.0 109.69 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 58.2 mm-40 -52.57 -59.32 4.59 Favored 'General case' 0 N--CA 1.494 1.763 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.926 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 8.5 t -46.3 -46.97 18.41 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 124.165 0.916 . . . . 0.0 110.557 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.416 ' N ' HD23 ' A' ' 12' ' ' LEU . 0.8 OUTLIER -54.06 -52.51 60.67 Favored 'General case' 0 N--CA 1.496 1.832 0 CA-C-O 120.889 0.376 . . . . 0.0 110.96 179.721 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -51.87 -14.38 0.37 Allowed 'General case' 0 N--CA 1.499 2.017 0 CA-C-N 115.073 -0.967 . . . . 0.0 112.721 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -104.03 -47.38 4.19 Favored 'General case' 0 N--CA 1.498 1.957 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.933 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 52.5 t -101.43 -45.28 5.36 Favored 'General case' 0 N--CA 1.505 2.292 0 N-CA-C 114.708 1.373 . . . . 0.0 114.708 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 39.2 m170 -94.29 36.9 1.12 Allowed 'General case' 0 N--CA 1.503 2.179 0 CA-C-O 121.796 0.808 . . . . 0.0 109.603 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -120.32 43.1 2.8 Favored 'General case' 0 N--CA 1.496 1.828 0 CA-C-N 114.19 -1.368 . . . . 0.0 107.821 179.756 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -123.67 41.55 3.45 Favored 'General case' 0 N--CA 1.496 1.846 0 N-CA-C 105.992 -1.855 . . . . 0.0 105.992 179.79 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.406 HG12 ' N ' ' A' ' 20' ' ' ILE . 37.6 t -125.53 174.05 10.26 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 CA-C-N 113.005 -1.907 . . . . 0.0 107.459 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.406 ' N ' HG12 ' A' ' 19' ' ' VAL . 18.2 tt . . . . . 0 N--CA 1.496 1.835 0 CA-C-O 121.967 0.889 . . . . 0.0 111.574 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 67.6 m . . . . . 0 N--CA 1.493 1.708 0 CA-C-O 120.632 0.253 . . . . 0.0 110.631 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.3 t -120.08 111.0 17.32 Favored 'General case' 0 N--CA 1.497 1.889 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.079 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 78.4 m -110.65 34.81 3.76 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 106.768 -1.567 . . . . 0.0 106.768 179.644 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.38 124.35 11.7 Favored 'General case' 0 N--CA 1.496 1.85 0 CA-C-N 114.8 -1.091 . . . . 0.0 110.433 179.784 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.8 t70 45.12 45.42 9.17 Favored 'General case' 0 N--CA 1.497 1.894 0 CA-C-N 114.09 -1.413 . . . . 0.0 110.984 -179.77 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 1.1 mmm -126.34 -177.3 3.93 Favored 'General case' 0 N--CA 1.496 1.829 0 CA-C-N 113.67 -1.604 . . . . 0.0 107.58 179.617 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.8 t -111.99 -154.4 0.54 Allowed 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 106.646 -1.613 . . . . 0.0 106.646 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -98.42 -75.27 0.56 Allowed 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 -179.805 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -40.73 -51.89 3.02 Favored 'General case' 0 N--CA 1.504 2.266 0 CA-C-O 121.568 0.699 . . . . 0.0 111.343 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 76.7 tt0 -53.36 -62.44 1.65 Allowed 'General case' 0 N--CA 1.492 1.627 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.49 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 25.6 t -49.1 -46.12 44.31 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 123.862 0.726 . . . . 0.0 112.44 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 1.1 mt -48.93 -48.52 42.74 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 123.79 0.681 . . . . 0.0 111.404 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 40.7 t80 -49.29 -22.7 1.13 Allowed 'General case' 0 N--CA 1.5 2.069 0 CA-C-N 115.552 -0.749 . . . . 0.0 112.532 179.706 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -104.5 -20.89 13.55 Favored 'General case' 0 N--CA 1.501 2.125 0 O-C-N 123.646 0.591 . . . . 0.0 111.257 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 37.4 t -108.91 -58.02 2.07 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 123.884 0.74 . . . . 0.0 111.874 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 11.1 m170 -72.25 -36.06 68.96 Favored 'General case' 0 N--CA 1.498 1.97 0 N-CA-C 112.332 0.494 . . . . 0.0 112.332 179.8 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -112.32 54.26 0.71 Allowed 'General case' 0 N--CA 1.495 1.794 0 CA-C-O 122.829 1.299 . . . . 0.0 107.736 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -100.72 -45.28 5.54 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 112.923 -1.944 . . . . 0.0 111.053 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 28.8 m -94.9 163.43 2.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 123.818 0.699 . . . . 0.0 109.848 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 55.1 mt . . . . . 0 N--CA 1.495 1.805 0 O-C-N 124.622 1.201 . . . . 0.0 110.468 -179.72 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.469 ' SG ' ' CD2' ' A' ' 16' ' ' HIS . 63.6 m . . . . . 0 N--CA 1.493 1.696 0 CA-C-O 121.531 0.682 . . . . 0.0 111.42 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 71.0 p -128.12 126.22 40.7 Favored 'General case' 0 N--CA 1.492 1.65 0 CA-C-N 114.062 -1.426 . . . . 0.0 110.207 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 14.6 m -120.6 80.94 1.69 Allowed 'General case' 0 N--CA 1.496 1.865 0 N-CA-C 105.812 -1.922 . . . . 0.0 105.812 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 80.9 tttt -110.99 97.16 6.61 Favored 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 113.779 1.029 . . . . 0.0 113.779 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.3 t70 100.8 21.64 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.5 0 C-N-CA 127.762 2.425 . . . . 0.0 106.445 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -130.63 -170.95 2.44 Favored 'General case' 0 N--CA 1.494 1.74 0 CA-C-N 114.151 -1.386 . . . . 0.0 110.375 -179.842 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 55.2 p -110.72 -145.4 0.4 Allowed 'General case' 0 N--CA 1.499 1.986 0 N-CA-C 106.505 -1.665 . . . . 0.0 106.505 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -112.91 -60.27 1.9 Allowed 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 105.805 -1.924 . . . . 0.0 105.805 179.701 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.414 ' HE2' ' C ' ' A' ' 9' ' ' LYS . 0.0 OUTLIER -45.22 -51.88 10.14 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 124.134 0.896 . . . . 0.0 109.241 179.889 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -65.47 -55.7 16.47 Favored 'General case' 0 N--CA 1.496 1.842 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.216 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 49.0 t -40.08 -51.42 2.6 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 124.644 1.215 . . . . 0.0 110.892 179.691 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.416 ' C ' ' H ' ' A' ' 14' ' ' PHE . 0.7 OUTLIER -56.9 -44.59 82.5 Favored 'General case' 0 N--CA 1.495 1.794 0 CA-C-N 114.784 -1.098 . . . . 0.0 110.785 179.697 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 11.7 t80 -58.13 -3.91 0.29 Allowed 'General case' 0 N--CA 1.493 1.711 0 CA-C-N 115.054 -0.975 . . . . 0.0 111.4 179.593 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.416 ' H ' ' C ' ' A' ' 12' ' ' LEU . 2.6 m-85 -116.66 -46.0 2.77 Favored 'General case' 0 N--CA 1.504 2.236 0 C-N-CA 123.219 0.608 . . . . 0.0 110.775 -179.8 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 21.2 t -98.97 -37.04 9.54 Favored 'General case' 0 N--CA 1.5 2.071 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.469 ' CD2' ' SG ' ' A' ' 1' ' ' CYS . 30.6 m170 -102.74 40.08 1.43 Allowed 'General case' 0 N--CA 1.502 2.171 0 CA-C-O 121.515 0.674 . . . . 0.0 109.897 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -112.72 45.07 1.37 Allowed 'General case' 0 N--CA 1.497 1.921 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 179.551 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -107.02 70.22 0.79 Allowed 'General case' 0 N--CA 1.489 1.525 0 CA-C-N 113.035 -1.893 . . . . 0.0 109.658 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 34.0 m -102.84 133.04 47.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 CA-C-N 112.746 -2.024 . . . . 0.0 109.406 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 19.2 tt -126.37 54.53 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 CA-C-O 123.357 1.551 . . . . 0.0 108.175 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' TRP . . . . . 0.449 ' CE3' ' N ' ' A' ' 21' ' ' TRP . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.748 0 CA-C-N 112.61 -2.086 . . . . 0.0 112.159 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 60.3 m . . . . . 0 N--CA 1.489 1.507 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.6 p 14.97 83.75 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.547 0 N-CA-C 115.165 1.543 . . . . 0.0 115.165 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 66.2 m -94.99 65.81 2.95 Favored 'General case' 0 N--CA 1.494 1.747 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.041 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -104.05 137.92 41.32 Favored 'General case' 0 N--CA 1.496 1.865 0 CA-C-N 113.933 -1.485 . . . . 0.0 108.283 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.7 t70 52.91 31.97 11.74 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 114.213 -1.358 . . . . 0.0 110.302 -179.804 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 4.1 mtp -133.86 173.75 11.2 Favored 'General case' 0 N--CA 1.503 2.207 0 CA-C-N 114.452 -1.249 . . . . 0.0 108.756 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 61.9 p -112.52 163.9 13.94 Favored 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 106.364 -1.717 . . . . 0.0 106.364 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 28.1 m-20 -47.61 -67.63 0.26 Allowed 'General case' 0 N--CA 1.497 1.908 0 O-C-N 123.906 0.754 . . . . 0.0 111.947 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 23.1 ttmm -47.28 -53.2 14.08 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 123.988 0.805 . . . . 0.0 111.839 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -49.8 -60.47 2.87 Favored 'General case' 0 N--CA 1.498 1.955 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.367 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 6.6 t -49.48 -49.82 43.96 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 124.381 1.05 . . . . 0.0 110.494 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.45 HD13 ' CE1' ' A' ' 16' ' ' HIS . 1.3 mt -49.85 -52.99 28.37 Favored 'General case' 0 N--CA 1.498 1.931 0 CA-C-O 121.716 0.77 . . . . 0.0 111.522 179.76 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -48.18 -21.64 0.52 Allowed 'General case' 0 N--CA 1.498 1.929 0 CA-C-N 114.684 -1.144 . . . . 0.0 113.201 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -102.7 -39.65 6.95 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 123.743 0.652 . . . . 0.0 109.543 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 16.1 t -89.99 -68.09 0.8 Allowed 'General case' 0 N--CA 1.498 1.933 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.899 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.45 ' CE1' HD13 ' A' ' 12' ' ' LEU . 3.7 m170 -47.26 -42.73 21.19 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 123.652 0.595 . . . . 0.0 110.633 179.659 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 36.7 tt0 69.92 67.92 0.23 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 125.646 1.841 . . . . 0.0 106.608 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -106.14 73.25 0.97 Allowed 'General case' 0 N--CA 1.492 1.665 0 CA-C-N 112.836 -1.984 . . . . 0.0 108.973 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 26.8 m -106.25 168.69 2.81 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 CA-C-N 112.568 -2.105 . . . . 0.0 107.41 179.701 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 18.3 tt -124.99 117.91 51.52 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.022 0 CA-C-O 121.383 0.611 . . . . 0.0 111.66 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 50.5 m95 . . . . . 0 N--CA 1.496 1.828 0 CA-C-N 114.573 -1.194 . . . . 0.0 108.61 179.684 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 83.7 m . . . . . 0 N--CA 1.493 1.701 0 CA-C-O 121.319 0.581 . . . . 0.0 111.462 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.2 t -132.69 159.56 39.27 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-N 113.867 -1.515 . . . . 0.0 108.716 179.822 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 68.1 m -126.39 24.43 6.75 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 124.289 0.993 . . . . 0.0 109.636 179.646 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.4 tppt? -24.5 126.16 0.04 OUTLIER 'General case' 0 N--CA 1.512 2.651 0 O-C-N 124.563 1.165 . . . . 0.0 111.863 179.471 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.3 p30 33.69 35.0 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.362 0 N-CA-C 116.364 1.987 . . . . 0.0 116.364 -179.457 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 23.8 mtm -122.6 -170.04 2.02 Favored 'General case' 0 N--CA 1.505 2.29 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 179.47 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.7 t -110.61 -159.14 0.67 Allowed 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 106.333 -1.728 . . . . 0.0 106.333 179.805 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -103.2 -61.46 1.41 Allowed 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -37.25 -36.46 0.14 Allowed 'General case' 0 N--CA 1.501 2.082 0 O-C-N 124.943 1.402 . . . . 0.0 112.987 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -87.62 -54.72 4.12 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-N 114.731 -1.122 . . . . 0.0 108.942 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 20.8 t -41.14 -44.06 2.43 Favored 'General case' 0 N--CA 1.505 2.276 0 CA-C-O 122.019 0.914 . . . . 0.0 110.556 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.457 HD13 ' ND1' ' A' ' 16' ' ' HIS . 0.8 OUTLIER -52.37 -56.38 15.32 Favored 'General case' 0 N--CA 1.489 1.525 0 CA-C-N 114.323 -1.308 . . . . 0.0 111.243 179.739 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 47.0 t80 -47.05 -26.92 1.17 Allowed 'General case' 0 N--CA 1.498 1.967 0 CA-C-N 114.476 -1.238 . . . . 0.0 112.72 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -89.84 -43.31 10.72 Favored 'General case' 0 N--CA 1.498 1.959 0 CA-C-N 114.428 -1.26 . . . . 0.0 110.728 -179.777 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 49.4 t -99.91 -63.05 1.16 Allowed 'General case' 0 N--CA 1.5 2.074 0 O-C-N 123.724 0.64 . . . . 0.0 111.886 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.457 ' ND1' HD13 ' A' ' 12' ' ' LEU . 11.7 m170 -50.71 -40.06 53.22 Favored 'General case' 0 N--CA 1.504 2.26 0 CA-C-O 121.19 0.519 . . . . 0.0 111.609 179.818 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -118.59 51.22 1.11 Allowed 'General case' 0 N--CA 1.493 1.688 0 CA-C-N 114.074 -1.421 . . . . 0.0 108.68 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 59.3 t0 -69.38 -48.84 59.98 Favored 'General case' 0 N--CA 1.493 1.718 0 CA-C-N 113.471 -1.695 . . . . 0.0 106.716 179.627 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.435 HG22 ' N ' ' A' ' 20' ' ' ILE . 7.9 p -120.16 168.18 12.78 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.908 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 179.643 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.435 ' N ' HG22 ' A' ' 19' ' ' VAL . 42.1 mm -123.34 141.12 44.8 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 124.579 1.174 . . . . 0.0 111.304 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 49.4 m95 . . . . . 0 N--CA 1.494 1.754 0 CA-C-O 116.791 -1.576 . . . . 0.0 110.294 179.763 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 39.1 m . . . . . 0 N--CA 1.492 1.64 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.1 m -120.85 151.17 39.97 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.782 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 67.9 m -125.51 73.9 1.36 Allowed 'General case' 0 N--CA 1.497 1.922 0 N-CA-C 106.296 -1.742 . . . . 0.0 106.296 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -108.73 103.21 12.25 Favored 'General case' 0 N--CA 1.495 1.822 0 CA-C-N 113.949 -1.478 . . . . 0.0 111.505 -179.688 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.3 t70 90.34 37.53 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.121 0 O-C-N 125.871 1.982 . . . . 0.0 107.644 179.755 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -136.05 -177.2 4.59 Favored 'General case' 0 N--CA 1.493 1.702 0 CA-C-N 112.956 -1.929 . . . . 0.0 109.619 179.815 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 40.7 p -107.5 -114.86 0.27 Allowed 'General case' 0 N--CA 1.496 1.848 0 N-CA-C 104.984 -2.228 . . . . 0.0 104.984 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -130.18 -64.83 0.84 Allowed 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 106.618 -1.623 . . . . 0.0 106.618 179.601 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.6 ttmt -52.17 -49.32 64.04 Favored 'General case' 0 N--CA 1.493 1.689 0 CA-C-N 113.77 -1.559 . . . . 0.0 112.547 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -59.02 -55.63 32.68 Favored 'General case' 0 N--CA 1.498 1.966 0 C-N-CA 119.796 -0.762 . . . . 0.0 109.431 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 27.2 t -44.57 -51.26 9.14 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 124.258 0.974 . . . . 0.0 109.64 179.698 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -52.86 -53.93 41.85 Favored 'General case' 0 N--CA 1.496 1.871 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.161 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.519 ' HA ' ' HB2' ' A' ' 17' ' ' GLN . 40.9 t80 -45.77 -18.7 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.104 0 CA-C-N 115.073 -0.967 . . . . 0.0 113.139 179.659 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.404 ' CD1' ' N ' ' A' ' 14' ' ' PHE . 1.7 m-85 -103.03 -41.17 6.19 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 124.186 0.929 . . . . 0.0 111.831 -179.798 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 42.2 t -97.42 -51.01 4.31 Favored 'General case' 0 N--CA 1.503 2.176 0 N-CA-C 114.277 1.214 . . . . 0.0 114.277 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 57.4 m80 -79.45 -22.97 43.46 Favored 'General case' 0 N--CA 1.496 1.84 0 N-CA-C 114.855 1.428 . . . . 0.0 114.855 -179.698 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.519 ' HB2' ' HA ' ' A' ' 13' ' ' TYR . 37.4 mt-30 -118.17 40.48 3.16 Favored 'General case' 0 N--CA 1.5 2.074 0 N-CA-C 114.803 1.408 . . . . 0.0 114.803 -179.901 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -125.26 -73.51 0.63 Allowed 'General case' 0 N--CA 1.504 2.246 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.377 179.558 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 19.7 m -120.42 146.12 25.77 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.358 0 O-C-N 124.57 1.169 . . . . 0.0 109.969 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 19.2 tt -128.48 53.35 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 CA-C-O 124.064 1.888 . . . . 0.0 106.834 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' TRP . . . . . 0.467 ' CE3' ' N ' ' A' ' 21' ' ' TRP . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.493 0 CA-C-N 111.723 -2.489 . . . . 0.0 112.469 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 87.1 m . . . . . 0 N--CA 1.493 1.69 0 CA-C-O 121.14 0.495 . . . . 0.0 111.57 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 53.1 m -116.2 89.09 3.03 Favored 'General case' 0 N--CA 1.496 1.827 0 CA-C-N 114.62 -1.173 . . . . 0.0 108.702 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 46.9 m -104.08 58.96 0.72 Allowed 'General case' 0 N--CA 1.499 2.006 0 CA-C-N 114.671 -1.15 . . . . 0.0 110.075 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -67.99 115.6 7.69 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-N 114.357 -1.292 . . . . 0.0 110.411 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.3 t70 59.18 39.74 22.52 Favored 'General case' 0 N--CA 1.498 1.952 0 CA-C-N 114.049 -1.432 . . . . 0.0 110.293 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 4.9 mtp -131.12 -178.59 4.9 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-N 113.906 -1.497 . . . . 0.0 108.532 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 60.3 p -108.89 -157.07 0.6 Allowed 'General case' 0 N--CA 1.501 2.101 0 N-CA-C 105.851 -1.907 . . . . 0.0 105.851 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -105.47 -67.74 0.9 Allowed 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 104.357 -2.46 . . . . 0.0 104.357 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.4 tpmt? -34.51 -46.98 0.3 Allowed 'General case' 0 N--CA 1.501 2.085 0 O-C-N 124.731 1.269 . . . . 0.0 113.326 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -80.28 -54.68 5.51 Favored 'General case' 0 N--CA 1.492 1.65 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.542 -179.656 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 48.0 t -44.32 -43.34 7.4 Favored 'General case' 0 N--CA 1.503 2.215 0 CA-C-O 121.615 0.722 . . . . 0.0 111.321 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -53.35 -44.06 68.23 Favored 'General case' 0 N--CA 1.494 1.728 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.727 179.7 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 44.5 t80 -51.5 -17.67 0.87 Allowed 'General case' 0 N--CA 1.5 2.066 0 CA-C-N 115.245 -0.889 . . . . 0.0 111.535 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -106.27 -49.54 3.34 Favored 'General case' 0 N--CA 1.494 1.741 0 CA-C-N 114.92 -1.037 . . . . 0.0 112.489 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 42.1 t -104.77 16.78 25.35 Favored 'General case' 0 N--CA 1.505 2.317 0 N-CA-C 118.048 2.611 . . . . 0.0 118.048 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 1.5 m80 -133.95 -47.22 0.79 Allowed 'General case' 0 N--CA 1.501 2.107 0 CA-C-O 120.809 0.338 . . . . 0.0 110.365 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 27.4 tt0 45.73 44.78 10.9 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 125.025 1.453 . . . . 0.0 109.047 -179.672 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -47.04 -50.88 18.71 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-N 113.69 -1.595 . . . . 0.0 110.233 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 12.2 p -124.22 158.54 30.73 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.759 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.032 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 18.6 tt -156.62 152.47 7.96 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 CA-C-N 112.875 -1.966 . . . . 0.0 108.895 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 63.0 m95 . . . . . 0 N--CA 1.494 1.752 0 CA-C-O 116.659 -1.639 . . . . 0.0 109.529 179.709 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 80.6 m . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.583 0.706 . . . . 0.0 112.393 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.7 t -132.5 125.6 31.0 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 106.788 -1.56 . . . . 0.0 106.788 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 93.2 m -123.24 74.79 1.26 Allowed 'General case' 0 N--CA 1.497 1.894 0 N-CA-C 114.249 1.203 . . . . 0.0 114.249 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.478 ' O ' ' SD ' ' A' ' 6' ' ' MET . 91.7 mttt -96.04 168.11 10.81 Favored 'General case' 0 N--CA 1.498 1.953 0 N-CA-C 106.51 -1.663 . . . . 0.0 106.51 179.617 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.1 p30 29.44 35.18 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.438 0 N-CA-C 115.501 1.667 . . . . 0.0 115.501 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' MET . . . . . 0.478 ' SD ' ' O ' ' A' ' 4' ' ' LYS . 0.6 OUTLIER -142.13 -173.18 3.75 Favored 'General case' 0 N--CA 1.495 1.812 0 CA-C-N 113.479 -1.691 . . . . 0.0 108.196 179.77 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.8 t -112.83 -136.87 0.37 Allowed 'General case' 0 N--CA 1.495 1.776 0 N-CA-C 103.837 -2.653 . . . . 0.0 103.837 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -112.62 -68.14 0.95 Allowed 'General case' 0 N--CA 1.497 1.918 0 CA-C-N 119.051 0.841 . . . . 0.0 112.977 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.4 tmtt? -45.85 -62.17 1.42 Allowed 'General case' 0 N--CA 1.498 1.946 0 O-C-N 123.44 0.462 . . . . 0.0 110.408 -179.765 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -47.16 -60.98 2.11 Favored 'General case' 0 N--CA 1.5 2.029 0 C-N-CA 120.467 -0.493 . . . . 0.0 111.55 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 53.2 t -41.74 -52.32 3.94 Favored 'General case' 0 N--CA 1.505 2.31 0 CA-C-O 121.443 0.639 . . . . 0.0 111.107 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -54.7 -56.14 22.34 Favored 'General case' 0 N--CA 1.492 1.66 0 CA-C-N 115.168 -0.924 . . . . 0.0 109.555 179.715 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.428 ' HA ' ' HB3' ' A' ' 17' ' ' GLN . 36.0 t80 -37.12 -27.54 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.943 0 O-C-N 124.756 1.285 . . . . 0.0 113.01 179.692 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -97.06 -49.81 4.85 Favored 'General case' 0 N--CA 1.503 2.224 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 -179.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 47.6 t -91.08 -41.16 11.21 Favored 'General case' 0 N--CA 1.504 2.272 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -179.562 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 16.9 m80 -89.58 -17.14 29.09 Favored 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.428 ' HB3' ' HA ' ' A' ' 13' ' ' TYR . 10.3 tt0 -125.85 41.47 3.51 Favored 'General case' 0 N--CA 1.501 2.104 0 N-CA-C 116.975 2.213 . . . . 0.0 116.975 -179.646 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 43.3 m-20 -119.78 -82.1 0.64 Allowed 'General case' 0 N--CA 1.507 2.402 0 N-CA-C 114.168 1.173 . . . . 0.0 114.168 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.7 t -119.92 156.35 22.62 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.245 0 CA-C-N 118.757 0.708 . . . . 0.0 109.986 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 61.3 mt -126.88 121.84 59.12 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 CA-C-N 114.112 -1.404 . . . . 0.0 108.155 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' TRP . . . . . 0.467 ' CE3' ' N ' ' A' ' 21' ' ' TRP . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.816 0 CA-C-N 114.103 -1.408 . . . . 0.0 112.052 -179.772 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.3 m . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.008 0.432 . . . . 0.0 110.382 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 29.0 t -123.98 -174.76 3.06 Favored 'General case' 0 N--CA 1.499 2.008 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 91.2 m -130.92 -48.42 1.03 Allowed 'General case' 0 N--CA 1.495 1.776 0 CA-C-N 115.177 -0.919 . . . . 0.0 109.553 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 34.7 ttmt 9.61 58.11 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.533 0 O-C-N 126.916 2.635 . . . . 0.0 113.119 -179.406 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.419 ' HB3' ' SD ' ' A' ' 6' ' ' MET . 2.6 t70 166.54 -44.49 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.89 0 CA-C-N 112.752 -2.022 . . . . 0.0 106.267 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' MET . . . . . 0.419 ' SD ' ' HB3' ' A' ' 5' ' ' ASP . 3.6 mpp? -98.34 -175.23 3.05 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 124.209 0.943 . . . . 0.0 111.623 -179.918 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 55.2 p -94.39 -94.2 0.17 Allowed 'General case' 0 N--CA 1.496 1.838 0 CA-C-N 114.939 -1.028 . . . . 0.0 110.926 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -145.02 -60.05 0.35 Allowed 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 24.5 tptt -46.74 -53.46 11.77 Favored 'General case' 0 N--CA 1.503 2.184 0 CA-C-O 122.135 0.969 . . . . 0.0 109.425 -179.89 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -53.63 -64.86 0.69 Allowed 'General case' 0 N--CA 1.495 1.779 0 CA-C-N 113.316 -1.765 . . . . 0.0 107.399 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 9.3 m -32.26 -56.54 0.33 Allowed 'General case' 0 N--CA 1.501 2.083 0 CA-C-N 113.896 -1.502 . . . . 0.0 111.17 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.446 HD22 ' CD2' ' A' ' 16' ' ' HIS . 3.0 mt -52.95 -56.2 17.72 Favored 'General case' 0 N--CA 1.49 1.569 0 CA-C-N 113.832 -1.531 . . . . 0.0 112.62 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 35.1 t80 -38.71 -34.76 0.16 Allowed 'General case' 0 N--CA 1.499 1.977 0 CA-C-N 114.808 -1.087 . . . . 0.0 112.689 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -90.08 -51.89 5.23 Favored 'General case' 0 N--CA 1.498 1.971 0 CA-C-N 113.809 -1.541 . . . . 0.0 111.033 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 48.3 t -78.7 -64.48 1.17 Allowed 'General case' 0 N--CA 1.497 1.915 0 O-C-N 123.645 0.591 . . . . 0.0 112.169 -179.74 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.446 ' CD2' HD22 ' A' ' 12' ' ' LEU . 1.5 m-70 -45.68 -55.39 6.49 Favored 'General case' 0 N--CA 1.503 2.216 0 CA-C-O 121.831 0.824 . . . . 0.0 111.994 179.842 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 54.53 66.65 1.18 Allowed 'General case' 0 N--CA 1.488 1.446 0 CA-C-N 112.153 -2.294 . . . . 0.0 108.451 -179.66 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -90.62 -44.9 9.23 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-N 113.39 -1.732 . . . . 0.0 111.388 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.461 ' HB ' ' NE1' ' A' ' 21' ' ' TRP . 35.9 m -114.65 140.75 34.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 123.883 0.739 . . . . 0.0 110.721 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 14.2 tt -121.54 89.03 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 CA-C-N 114.083 -1.417 . . . . 0.0 108.625 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' TRP . . . . . 0.461 ' NE1' ' HB ' ' A' ' 19' ' ' VAL . 22.9 m95 . . . . . 0 N--CA 1.497 1.915 0 CA-C-O 116.084 -1.912 . . . . 0.0 108.896 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 84.3 m . . . . . 0 N--CA 1.49 1.567 0 CA-C-O 121.752 0.787 . . . . 0.0 111.849 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 43.5 t -120.42 79.42 1.47 Allowed 'General case' 0 N--CA 1.488 1.445 0 CA-C-N 113.638 -1.619 . . . . 0.0 107.518 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.2 m -75.63 -44.63 41.76 Favored 'General case' 0 N--CA 1.497 1.91 0 CA-C-N 114.744 -1.116 . . . . 0.0 108.166 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 19.1 tptm 54.4 82.8 0.09 Allowed 'General case' 0 N--CA 1.498 1.972 0 CA-C-N 115.001 -0.999 . . . . 0.0 112.495 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 65.42 44.01 3.26 Favored 'General case' 0 N--CA 1.504 2.237 0 N-CA-C 117.402 2.371 . . . . 0.0 117.402 179.875 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 38.1 mtm -130.54 -165.04 1.49 Allowed 'General case' 0 N--CA 1.5 2.064 0 N-CA-C 106.38 -1.711 . . . . 0.0 106.38 179.267 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 44.8 p -100.65 -153.18 0.44 Allowed 'General case' 0 N--CA 1.503 2.179 0 N-CA-C 107.029 -1.471 . . . . 0.0 107.029 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -108.57 -61.96 1.53 Allowed 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 106.292 -1.744 . . . . 0.0 106.292 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 35.7 ttmt -43.24 -45.41 5.74 Favored 'General case' 0 N--CA 1.5 2.062 0 CA-C-O 121.388 0.613 . . . . 0.0 112.022 179.725 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -69.13 -59.77 2.8 Favored 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 42.6 t -36.64 -49.29 0.75 Allowed 'General case' 0 N--CA 1.503 2.198 0 O-C-N 124.9 1.375 . . . . 0.0 111.721 179.708 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -53.65 -57.79 9.52 Favored 'General case' 0 N--CA 1.486 1.344 0 CA-C-N 114.637 -1.165 . . . . 0.0 110.784 179.831 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 36.5 t80 -43.11 -23.04 0.04 OUTLIER 'General case' 0 N--CA 1.503 2.204 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.437 ' N ' ' CD1' ' A' ' 14' ' ' PHE . 1.3 m-85 -96.05 -47.29 6.15 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 124.072 0.857 . . . . 0.0 110.384 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 51.6 t -95.01 -50.0 5.29 Favored 'General case' 0 N--CA 1.502 2.163 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 34.7 m170 -90.4 -66.05 0.96 Allowed 'General case' 0 N--CA 1.507 2.379 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.855 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 64.5 47.6 2.92 Favored 'General case' 0 N--CA 1.499 2.008 0 N-CA-C 113.31 0.856 . . . . 0.0 113.31 179.601 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -25.35 -67.0 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.201 0 N-CA-C 114.341 1.238 . . . . 0.0 114.341 179.745 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 3.5 p -120.97 149.23 23.89 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 CA-C-N 114.466 -1.243 . . . . 0.0 110.226 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 15.8 tt -147.03 71.01 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 CA-C-N 112.404 -2.18 . . . . 0.0 108.291 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' TRP . . . . . 0.446 ' CE3' ' N ' ' A' ' 21' ' ' TRP . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.687 0 CA-C-N 112.411 -2.177 . . . . 0.0 113.743 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 34.2 m . . . . . 0 N--CA 1.493 1.706 0 CA-C-O 121.297 0.57 . . . . 0.0 110.481 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.9 m -114.23 126.2 54.77 Favored 'General case' 0 N--CA 1.5 2.026 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.775 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 78.1 m -114.28 69.56 0.71 Allowed 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.83 112.54 24.25 Favored 'General case' 0 N--CA 1.499 2.007 0 N-CA-C 105.045 -2.205 . . . . 0.0 105.045 -179.83 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 44.7 62.77 1.93 Allowed 'General case' 0 N--CA 1.497 1.917 0 CA-C-O 122.927 1.346 . . . . 0.0 112.265 -179.508 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 13.9 mmm -117.13 -177.6 3.25 Favored 'General case' 0 N--CA 1.499 1.987 0 CA-C-N 112.132 -2.304 . . . . 0.0 106.022 179.682 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 75.9 p -109.42 17.47 21.41 Favored 'General case' 0 N--CA 1.506 2.372 0 C-N-CA 119.87 -0.732 . . . . 0.0 110.491 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 10.3 t70 76.6 -66.2 0.27 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 124.983 1.427 . . . . 0.0 109.609 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 77.0 tttt -49.18 -53.87 19.08 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 123.714 0.634 . . . . 0.0 109.69 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 58.2 mm-40 -52.57 -59.32 4.59 Favored 'General case' 0 N--CA 1.494 1.763 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.926 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 8.5 t -46.3 -46.97 18.41 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 124.165 0.916 . . . . 0.0 110.557 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.416 ' N ' HD23 ' A' ' 12' ' ' LEU . 0.8 OUTLIER -54.06 -52.51 60.67 Favored 'General case' 0 N--CA 1.496 1.832 0 CA-C-O 120.889 0.376 . . . . 0.0 110.96 179.721 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -51.87 -14.38 0.37 Allowed 'General case' 0 N--CA 1.499 2.017 0 CA-C-N 115.073 -0.967 . . . . 0.0 112.721 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -104.03 -47.38 4.19 Favored 'General case' 0 N--CA 1.498 1.957 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.933 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 52.5 t -101.43 -45.28 5.36 Favored 'General case' 0 N--CA 1.505 2.292 0 N-CA-C 114.708 1.373 . . . . 0.0 114.708 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 39.2 m170 -94.29 36.9 1.12 Allowed 'General case' 0 N--CA 1.503 2.179 0 CA-C-O 121.796 0.808 . . . . 0.0 109.603 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -120.32 43.1 2.8 Favored 'General case' 0 N--CA 1.496 1.828 0 CA-C-N 114.19 -1.368 . . . . 0.0 107.821 179.756 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -123.67 41.55 3.45 Favored 'General case' 0 N--CA 1.496 1.846 0 N-CA-C 105.992 -1.855 . . . . 0.0 105.992 179.79 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.406 HG12 ' N ' ' A' ' 20' ' ' ILE . 37.6 t -125.53 174.05 10.26 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 CA-C-N 113.005 -1.907 . . . . 0.0 107.459 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.406 ' N ' HG12 ' A' ' 19' ' ' VAL . 18.2 tt -99.57 80.16 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 CA-C-O 121.967 0.889 . . . . 0.0 111.574 -179.72 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 42.9 m95 . . . . . 0 N--CA 1.5 2.055 0 CA-C-N 114.722 -1.126 . . . . 0.0 108.667 179.814 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 67.6 m . . . . . 0 N--CA 1.493 1.708 0 CA-C-O 120.632 0.253 . . . . 0.0 110.631 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.3 t -120.08 111.0 17.32 Favored 'General case' 0 N--CA 1.497 1.889 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.079 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 78.4 m -110.65 34.81 3.76 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 106.768 -1.567 . . . . 0.0 106.768 179.644 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.38 124.35 11.7 Favored 'General case' 0 N--CA 1.496 1.85 0 CA-C-N 114.8 -1.091 . . . . 0.0 110.433 179.784 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.8 t70 45.12 45.42 9.17 Favored 'General case' 0 N--CA 1.497 1.894 0 CA-C-N 114.09 -1.413 . . . . 0.0 110.984 -179.77 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 1.1 mmm -126.34 -177.3 3.93 Favored 'General case' 0 N--CA 1.496 1.829 0 CA-C-N 113.67 -1.604 . . . . 0.0 107.58 179.617 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.8 t -111.99 -154.4 0.54 Allowed 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 106.646 -1.613 . . . . 0.0 106.646 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -98.42 -75.27 0.56 Allowed 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 -179.805 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -40.73 -51.89 3.02 Favored 'General case' 0 N--CA 1.504 2.266 0 CA-C-O 121.568 0.699 . . . . 0.0 111.343 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 76.7 tt0 -53.36 -62.44 1.65 Allowed 'General case' 0 N--CA 1.492 1.627 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.49 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 25.6 t -49.1 -46.12 44.31 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 123.862 0.726 . . . . 0.0 112.44 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 1.1 mt -48.93 -48.52 42.74 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 123.79 0.681 . . . . 0.0 111.404 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 40.7 t80 -49.29 -22.7 1.13 Allowed 'General case' 0 N--CA 1.5 2.069 0 CA-C-N 115.552 -0.749 . . . . 0.0 112.532 179.706 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -104.5 -20.89 13.55 Favored 'General case' 0 N--CA 1.501 2.125 0 O-C-N 123.646 0.591 . . . . 0.0 111.257 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 37.4 t -108.91 -58.02 2.07 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 123.884 0.74 . . . . 0.0 111.874 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 11.1 m170 -72.25 -36.06 68.96 Favored 'General case' 0 N--CA 1.498 1.97 0 N-CA-C 112.332 0.494 . . . . 0.0 112.332 179.8 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -112.32 54.26 0.71 Allowed 'General case' 0 N--CA 1.495 1.794 0 CA-C-O 122.829 1.299 . . . . 0.0 107.736 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -100.72 -45.28 5.54 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 112.923 -1.944 . . . . 0.0 111.053 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 28.8 m -94.9 163.43 2.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 123.818 0.699 . . . . 0.0 109.848 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 55.1 mt -124.59 76.34 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.805 0 O-C-N 124.622 1.201 . . . . 0.0 110.468 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 10.6 m95 . . . . . 0 N--CA 1.504 2.25 0 CA-C-O 117.518 -1.23 . . . . 0.0 110.243 179.785 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.469 ' SG ' ' CD2' ' A' ' 16' ' ' HIS . 63.6 m . . . . . 0 N--CA 1.493 1.696 0 CA-C-O 121.531 0.682 . . . . 0.0 111.42 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 71.0 p -128.12 126.22 40.7 Favored 'General case' 0 N--CA 1.492 1.65 0 CA-C-N 114.062 -1.426 . . . . 0.0 110.207 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 14.6 m -120.6 80.94 1.69 Allowed 'General case' 0 N--CA 1.496 1.865 0 N-CA-C 105.812 -1.922 . . . . 0.0 105.812 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 80.9 tttt -110.99 97.16 6.61 Favored 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 113.779 1.029 . . . . 0.0 113.779 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.3 t70 100.8 21.64 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.5 0 C-N-CA 127.762 2.425 . . . . 0.0 106.445 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -130.63 -170.95 2.44 Favored 'General case' 0 N--CA 1.494 1.74 0 CA-C-N 114.151 -1.386 . . . . 0.0 110.375 -179.842 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 55.2 p -110.72 -145.4 0.4 Allowed 'General case' 0 N--CA 1.499 1.986 0 N-CA-C 106.505 -1.665 . . . . 0.0 106.505 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -112.91 -60.27 1.9 Allowed 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 105.805 -1.924 . . . . 0.0 105.805 179.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.414 ' HE2' ' C ' ' A' ' 9' ' ' LYS . 0.0 OUTLIER -45.22 -51.88 10.14 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 124.134 0.896 . . . . 0.0 109.241 179.889 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -65.47 -55.7 16.47 Favored 'General case' 0 N--CA 1.496 1.842 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.216 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 49.0 t -40.08 -51.42 2.6 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 124.644 1.215 . . . . 0.0 110.892 179.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.416 ' C ' ' H ' ' A' ' 14' ' ' PHE . 0.7 OUTLIER -56.9 -44.59 82.5 Favored 'General case' 0 N--CA 1.495 1.794 0 CA-C-N 114.784 -1.098 . . . . 0.0 110.785 179.697 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 11.7 t80 -58.13 -3.91 0.29 Allowed 'General case' 0 N--CA 1.493 1.711 0 CA-C-N 115.054 -0.975 . . . . 0.0 111.4 179.593 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.416 ' H ' ' C ' ' A' ' 12' ' ' LEU . 2.6 m-85 -116.66 -46.0 2.77 Favored 'General case' 0 N--CA 1.504 2.236 0 C-N-CA 123.219 0.608 . . . . 0.0 110.775 -179.8 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 21.2 t -98.97 -37.04 9.54 Favored 'General case' 0 N--CA 1.5 2.071 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.469 ' CD2' ' SG ' ' A' ' 1' ' ' CYS . 30.6 m170 -102.74 40.08 1.43 Allowed 'General case' 0 N--CA 1.502 2.171 0 CA-C-O 121.515 0.674 . . . . 0.0 109.897 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -112.72 45.07 1.37 Allowed 'General case' 0 N--CA 1.497 1.921 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 179.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -107.02 70.22 0.79 Allowed 'General case' 0 N--CA 1.489 1.525 0 CA-C-N 113.035 -1.893 . . . . 0.0 109.658 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 34.0 m -102.84 133.04 47.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 CA-C-N 112.746 -2.024 . . . . 0.0 109.406 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 19.2 tt . . . . . 0 N--CA 1.498 1.953 0 CA-C-O 123.357 1.551 . . . . 0.0 108.175 -179.95 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 60.3 m . . . . . 0 N--CA 1.489 1.507 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.6 p 14.97 83.75 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.547 0 N-CA-C 115.165 1.543 . . . . 0.0 115.165 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 66.2 m -94.99 65.81 2.95 Favored 'General case' 0 N--CA 1.494 1.747 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.041 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -104.05 137.92 41.32 Favored 'General case' 0 N--CA 1.496 1.865 0 CA-C-N 113.933 -1.485 . . . . 0.0 108.283 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.7 t70 52.91 31.97 11.74 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 114.213 -1.358 . . . . 0.0 110.302 -179.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 4.1 mtp -133.86 173.75 11.2 Favored 'General case' 0 N--CA 1.503 2.207 0 CA-C-N 114.452 -1.249 . . . . 0.0 108.756 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 61.9 p -112.52 163.9 13.94 Favored 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 106.364 -1.717 . . . . 0.0 106.364 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 28.1 m-20 -47.61 -67.63 0.26 Allowed 'General case' 0 N--CA 1.497 1.908 0 O-C-N 123.906 0.754 . . . . 0.0 111.947 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 23.1 ttmm -47.28 -53.2 14.08 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 123.988 0.805 . . . . 0.0 111.839 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -49.8 -60.47 2.87 Favored 'General case' 0 N--CA 1.498 1.955 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.367 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 6.6 t -49.48 -49.82 43.96 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 124.381 1.05 . . . . 0.0 110.494 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.45 HD13 ' CE1' ' A' ' 16' ' ' HIS . 1.3 mt -49.85 -52.99 28.37 Favored 'General case' 0 N--CA 1.498 1.931 0 CA-C-O 121.716 0.77 . . . . 0.0 111.522 179.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -48.18 -21.64 0.52 Allowed 'General case' 0 N--CA 1.498 1.929 0 CA-C-N 114.684 -1.144 . . . . 0.0 113.201 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -102.7 -39.65 6.95 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 123.743 0.652 . . . . 0.0 109.543 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 16.1 t -89.99 -68.09 0.8 Allowed 'General case' 0 N--CA 1.498 1.933 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.899 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.45 ' CE1' HD13 ' A' ' 12' ' ' LEU . 3.7 m170 -47.26 -42.73 21.19 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 123.652 0.595 . . . . 0.0 110.633 179.659 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 36.7 tt0 69.92 67.92 0.23 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 125.646 1.841 . . . . 0.0 106.608 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -106.14 73.25 0.97 Allowed 'General case' 0 N--CA 1.492 1.665 0 CA-C-N 112.836 -1.984 . . . . 0.0 108.973 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 26.8 m -106.25 168.69 2.81 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 CA-C-N 112.568 -2.105 . . . . 0.0 107.41 179.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 18.3 tt . . . . . 0 N--CA 1.499 2.022 0 CA-C-O 121.383 0.611 . . . . 0.0 111.66 -179.909 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 83.7 m . . . . . 0 N--CA 1.493 1.701 0 CA-C-O 121.319 0.581 . . . . 0.0 111.462 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.2 t -132.69 159.56 39.27 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-N 113.867 -1.515 . . . . 0.0 108.716 179.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 68.1 m -126.39 24.43 6.75 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 124.289 0.993 . . . . 0.0 109.636 179.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.4 tppt? -24.5 126.16 0.04 OUTLIER 'General case' 0 N--CA 1.512 2.651 0 O-C-N 124.563 1.165 . . . . 0.0 111.863 179.471 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.3 p30 33.69 35.0 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.362 0 N-CA-C 116.364 1.987 . . . . 0.0 116.364 -179.457 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 23.8 mtm -122.6 -170.04 2.02 Favored 'General case' 0 N--CA 1.505 2.29 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 179.47 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.7 t -110.61 -159.14 0.67 Allowed 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 106.333 -1.728 . . . . 0.0 106.333 179.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -103.2 -61.46 1.41 Allowed 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -37.25 -36.46 0.14 Allowed 'General case' 0 N--CA 1.501 2.082 0 O-C-N 124.943 1.402 . . . . 0.0 112.987 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -87.62 -54.72 4.12 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-N 114.731 -1.122 . . . . 0.0 108.942 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 20.8 t -41.14 -44.06 2.43 Favored 'General case' 0 N--CA 1.505 2.276 0 CA-C-O 122.019 0.914 . . . . 0.0 110.556 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.457 HD13 ' ND1' ' A' ' 16' ' ' HIS . 0.8 OUTLIER -52.37 -56.38 15.32 Favored 'General case' 0 N--CA 1.489 1.525 0 CA-C-N 114.323 -1.308 . . . . 0.0 111.243 179.739 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 47.0 t80 -47.05 -26.92 1.17 Allowed 'General case' 0 N--CA 1.498 1.967 0 CA-C-N 114.476 -1.238 . . . . 0.0 112.72 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -89.84 -43.31 10.72 Favored 'General case' 0 N--CA 1.498 1.959 0 CA-C-N 114.428 -1.26 . . . . 0.0 110.728 -179.777 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 49.4 t -99.91 -63.05 1.16 Allowed 'General case' 0 N--CA 1.5 2.074 0 O-C-N 123.724 0.64 . . . . 0.0 111.886 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.457 ' ND1' HD13 ' A' ' 12' ' ' LEU . 11.7 m170 -50.71 -40.06 53.22 Favored 'General case' 0 N--CA 1.504 2.26 0 CA-C-O 121.19 0.519 . . . . 0.0 111.609 179.818 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -118.59 51.22 1.11 Allowed 'General case' 0 N--CA 1.493 1.688 0 CA-C-N 114.074 -1.421 . . . . 0.0 108.68 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 59.3 t0 -69.38 -48.84 59.98 Favored 'General case' 0 N--CA 1.493 1.718 0 CA-C-N 113.471 -1.695 . . . . 0.0 106.716 179.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.435 HG22 ' N ' ' A' ' 20' ' ' ILE . 7.9 p -120.16 168.18 12.78 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.908 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 179.643 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.435 ' N ' HG22 ' A' ' 19' ' ' VAL . 42.1 mm . . . . . 0 N--CA 1.497 1.891 0 O-C-N 124.579 1.174 . . . . 0.0 111.304 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 39.1 m . . . . . 0 N--CA 1.492 1.64 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.1 m -120.85 151.17 39.97 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.782 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 67.9 m -125.51 73.9 1.36 Allowed 'General case' 0 N--CA 1.497 1.922 0 N-CA-C 106.296 -1.742 . . . . 0.0 106.296 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -108.73 103.21 12.25 Favored 'General case' 0 N--CA 1.495 1.822 0 CA-C-N 113.949 -1.478 . . . . 0.0 111.505 -179.688 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.3 t70 90.34 37.53 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.121 0 O-C-N 125.871 1.982 . . . . 0.0 107.644 179.755 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -136.05 -177.2 4.59 Favored 'General case' 0 N--CA 1.493 1.702 0 CA-C-N 112.956 -1.929 . . . . 0.0 109.619 179.815 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 40.7 p -107.5 -114.86 0.27 Allowed 'General case' 0 N--CA 1.496 1.848 0 N-CA-C 104.984 -2.228 . . . . 0.0 104.984 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -130.18 -64.83 0.84 Allowed 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 106.618 -1.623 . . . . 0.0 106.618 179.601 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.6 ttmt -52.17 -49.32 64.04 Favored 'General case' 0 N--CA 1.493 1.689 0 CA-C-N 113.77 -1.559 . . . . 0.0 112.547 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -59.02 -55.63 32.68 Favored 'General case' 0 N--CA 1.498 1.966 0 C-N-CA 119.796 -0.762 . . . . 0.0 109.431 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 27.2 t -44.57 -51.26 9.14 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 124.258 0.974 . . . . 0.0 109.64 179.698 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.441 HD22 ' CD2' ' A' ' 16' ' ' HIS . 0.6 OUTLIER -52.86 -53.93 41.85 Favored 'General case' 0 N--CA 1.496 1.871 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.161 179.565 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.519 ' HA ' ' HB2' ' A' ' 17' ' ' GLN . 40.9 t80 -45.77 -18.7 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.104 0 CA-C-N 115.073 -0.967 . . . . 0.0 113.139 179.659 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.404 ' CD1' ' N ' ' A' ' 14' ' ' PHE . 1.7 m-85 -103.03 -41.17 6.19 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 124.186 0.929 . . . . 0.0 111.831 -179.798 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 42.2 t -97.42 -51.01 4.31 Favored 'General case' 0 N--CA 1.503 2.176 0 N-CA-C 114.277 1.214 . . . . 0.0 114.277 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.441 ' CD2' HD22 ' A' ' 12' ' ' LEU . 42.1 m-70 -79.45 -22.97 43.46 Favored 'General case' 0 N--CA 1.496 1.84 0 N-CA-C 114.855 1.428 . . . . 0.0 114.855 -179.698 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.519 ' HB2' ' HA ' ' A' ' 13' ' ' TYR . 37.4 mt-30 -118.17 40.48 3.16 Favored 'General case' 0 N--CA 1.5 2.074 0 N-CA-C 114.803 1.408 . . . . 0.0 114.803 -179.901 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -125.26 -73.51 0.63 Allowed 'General case' 0 N--CA 1.504 2.246 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.377 179.558 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 19.7 m -120.42 146.12 25.77 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.358 0 O-C-N 124.57 1.169 . . . . 0.0 109.969 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 19.2 tt . . . . . 0 N--CA 1.497 1.891 0 CA-C-O 124.064 1.888 . . . . 0.0 106.834 179.789 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 87.1 m . . . . . 0 N--CA 1.493 1.69 0 CA-C-O 121.14 0.495 . . . . 0.0 111.57 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 53.1 m -116.2 89.09 3.03 Favored 'General case' 0 N--CA 1.496 1.827 0 CA-C-N 114.62 -1.173 . . . . 0.0 108.702 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 46.9 m -104.08 58.96 0.72 Allowed 'General case' 0 N--CA 1.499 2.006 0 CA-C-N 114.671 -1.15 . . . . 0.0 110.075 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -67.99 115.6 7.69 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-N 114.357 -1.292 . . . . 0.0 110.411 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.3 t70 59.18 39.74 22.52 Favored 'General case' 0 N--CA 1.498 1.952 0 CA-C-N 114.049 -1.432 . . . . 0.0 110.293 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 4.9 mtp -131.12 -178.59 4.9 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-N 113.906 -1.497 . . . . 0.0 108.532 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 60.3 p -108.89 -157.07 0.6 Allowed 'General case' 0 N--CA 1.501 2.101 0 N-CA-C 105.851 -1.907 . . . . 0.0 105.851 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -105.47 -67.74 0.9 Allowed 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 104.357 -2.46 . . . . 0.0 104.357 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.4 tpmt? -34.51 -46.98 0.3 Allowed 'General case' 0 N--CA 1.501 2.085 0 O-C-N 124.731 1.269 . . . . 0.0 113.326 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -80.28 -54.68 5.51 Favored 'General case' 0 N--CA 1.492 1.65 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.542 -179.656 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 48.0 t -44.32 -43.34 7.4 Favored 'General case' 0 N--CA 1.503 2.215 0 CA-C-O 121.615 0.722 . . . . 0.0 111.321 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.443 HD22 ' CD2' ' A' ' 16' ' ' HIS . 0.6 OUTLIER -53.35 -44.06 68.23 Favored 'General case' 0 N--CA 1.494 1.728 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.727 179.7 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 44.5 t80 -51.5 -17.67 0.87 Allowed 'General case' 0 N--CA 1.5 2.066 0 CA-C-N 115.245 -0.889 . . . . 0.0 111.535 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -106.27 -49.54 3.34 Favored 'General case' 0 N--CA 1.494 1.741 0 CA-C-N 114.92 -1.037 . . . . 0.0 112.489 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 42.1 t -104.77 16.78 25.35 Favored 'General case' 0 N--CA 1.505 2.317 0 N-CA-C 118.048 2.611 . . . . 0.0 118.048 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.443 ' CD2' HD22 ' A' ' 12' ' ' LEU . 1.1 m-70 -133.95 -47.22 0.79 Allowed 'General case' 0 N--CA 1.501 2.107 0 CA-C-O 120.809 0.338 . . . . 0.0 110.365 179.706 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 27.4 tt0 45.73 44.78 10.9 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 125.025 1.453 . . . . 0.0 109.047 -179.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -47.04 -50.88 18.71 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-N 113.69 -1.595 . . . . 0.0 110.233 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 12.2 p -124.22 158.54 30.73 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.759 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.032 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 18.6 tt . . . . . 0 N--CA 1.495 1.794 0 CA-C-N 112.875 -1.966 . . . . 0.0 108.895 179.897 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.41 ' SG ' ' CD2' ' A' ' 16' ' ' HIS . 80.6 m . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.583 0.706 . . . . 0.0 112.393 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.7 t -132.5 125.6 31.0 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 106.788 -1.56 . . . . 0.0 106.788 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 93.2 m -123.24 74.79 1.26 Allowed 'General case' 0 N--CA 1.497 1.894 0 N-CA-C 114.249 1.203 . . . . 0.0 114.249 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.478 ' O ' ' SD ' ' A' ' 6' ' ' MET . 91.7 mttt -96.04 168.11 10.81 Favored 'General case' 0 N--CA 1.498 1.953 0 N-CA-C 106.51 -1.663 . . . . 0.0 106.51 179.617 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.1 p30 29.44 35.18 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.438 0 N-CA-C 115.501 1.667 . . . . 0.0 115.501 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . 0.478 ' SD ' ' O ' ' A' ' 4' ' ' LYS . 0.6 OUTLIER -142.13 -173.18 3.75 Favored 'General case' 0 N--CA 1.495 1.812 0 CA-C-N 113.479 -1.691 . . . . 0.0 108.196 179.77 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.8 t -112.83 -136.87 0.37 Allowed 'General case' 0 N--CA 1.495 1.776 0 N-CA-C 103.837 -2.653 . . . . 0.0 103.837 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -112.62 -68.14 0.95 Allowed 'General case' 0 N--CA 1.497 1.918 0 CA-C-N 119.051 0.841 . . . . 0.0 112.977 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.4 tmtt? -45.85 -62.17 1.42 Allowed 'General case' 0 N--CA 1.498 1.946 0 O-C-N 123.44 0.462 . . . . 0.0 110.408 -179.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -47.16 -60.98 2.11 Favored 'General case' 0 N--CA 1.5 2.029 0 C-N-CA 120.467 -0.493 . . . . 0.0 111.55 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 53.2 t -41.74 -52.32 3.94 Favored 'General case' 0 N--CA 1.505 2.31 0 CA-C-O 121.443 0.639 . . . . 0.0 111.107 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -54.7 -56.14 22.34 Favored 'General case' 0 N--CA 1.492 1.66 0 CA-C-N 115.168 -0.924 . . . . 0.0 109.555 179.715 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.428 ' HA ' ' HB3' ' A' ' 17' ' ' GLN . 36.0 t80 -37.12 -27.54 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.943 0 O-C-N 124.756 1.285 . . . . 0.0 113.01 179.692 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -97.06 -49.81 4.85 Favored 'General case' 0 N--CA 1.503 2.224 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 -179.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 47.6 t -91.08 -41.16 11.21 Favored 'General case' 0 N--CA 1.504 2.272 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -179.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.41 ' CD2' ' SG ' ' A' ' 1' ' ' CYS . 33.9 m-70 -89.58 -17.14 29.09 Favored 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.428 ' HB3' ' HA ' ' A' ' 13' ' ' TYR . 10.3 tt0 -125.85 41.47 3.51 Favored 'General case' 0 N--CA 1.501 2.104 0 N-CA-C 116.975 2.213 . . . . 0.0 116.975 -179.646 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 43.3 m-20 -119.78 -82.1 0.64 Allowed 'General case' 0 N--CA 1.507 2.402 0 N-CA-C 114.168 1.173 . . . . 0.0 114.168 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.7 t -119.92 156.35 22.62 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.245 0 CA-C-N 118.757 0.708 . . . . 0.0 109.986 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 61.3 mt . . . . . 0 N--CA 1.495 1.818 0 CA-C-N 114.112 -1.404 . . . . 0.0 108.155 179.962 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.3 m . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.008 0.432 . . . . 0.0 110.382 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 29.0 t -123.98 -174.76 3.06 Favored 'General case' 0 N--CA 1.499 2.008 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 91.2 m -130.92 -48.42 1.03 Allowed 'General case' 0 N--CA 1.495 1.776 0 CA-C-N 115.177 -0.919 . . . . 0.0 109.553 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 34.7 ttmt 9.61 58.11 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.533 0 O-C-N 126.916 2.635 . . . . 0.0 113.119 -179.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.419 ' HB3' ' SD ' ' A' ' 6' ' ' MET . 2.6 t70 166.54 -44.49 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.89 0 CA-C-N 112.752 -2.022 . . . . 0.0 106.267 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . 0.419 ' SD ' ' HB3' ' A' ' 5' ' ' ASP . 3.6 mpp? -98.34 -175.23 3.05 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 124.209 0.943 . . . . 0.0 111.623 -179.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 55.2 p -94.39 -94.2 0.17 Allowed 'General case' 0 N--CA 1.496 1.838 0 CA-C-N 114.939 -1.028 . . . . 0.0 110.926 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -145.02 -60.05 0.35 Allowed 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 24.5 tptt -46.74 -53.46 11.77 Favored 'General case' 0 N--CA 1.503 2.184 0 CA-C-O 122.135 0.969 . . . . 0.0 109.425 -179.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -53.63 -64.86 0.69 Allowed 'General case' 0 N--CA 1.495 1.779 0 CA-C-N 113.316 -1.765 . . . . 0.0 107.399 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 9.3 m -32.26 -56.54 0.33 Allowed 'General case' 0 N--CA 1.501 2.083 0 CA-C-N 113.896 -1.502 . . . . 0.0 111.17 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.446 HD22 ' CD2' ' A' ' 16' ' ' HIS . 3.0 mt -52.95 -56.2 17.72 Favored 'General case' 0 N--CA 1.49 1.569 0 CA-C-N 113.832 -1.531 . . . . 0.0 112.62 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 35.1 t80 -38.71 -34.76 0.16 Allowed 'General case' 0 N--CA 1.499 1.977 0 CA-C-N 114.808 -1.087 . . . . 0.0 112.689 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -90.08 -51.89 5.23 Favored 'General case' 0 N--CA 1.498 1.971 0 CA-C-N 113.809 -1.541 . . . . 0.0 111.033 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 48.3 t -78.7 -64.48 1.17 Allowed 'General case' 0 N--CA 1.497 1.915 0 O-C-N 123.645 0.591 . . . . 0.0 112.169 -179.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.446 ' CD2' HD22 ' A' ' 12' ' ' LEU . 1.5 m-70 -45.68 -55.39 6.49 Favored 'General case' 0 N--CA 1.503 2.216 0 CA-C-O 121.831 0.824 . . . . 0.0 111.994 179.842 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 54.53 66.65 1.18 Allowed 'General case' 0 N--CA 1.488 1.446 0 CA-C-N 112.153 -2.294 . . . . 0.0 108.451 -179.66 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -90.62 -44.9 9.23 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-N 113.39 -1.732 . . . . 0.0 111.388 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 35.9 m -114.65 140.75 34.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 123.883 0.739 . . . . 0.0 110.721 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 14.2 tt . . . . . 0 N--CA 1.493 1.693 0 CA-C-N 114.083 -1.417 . . . . 0.0 108.625 179.999 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 84.3 m . . . . . 0 N--CA 1.49 1.567 0 CA-C-O 121.752 0.787 . . . . 0.0 111.849 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 43.5 t -120.42 79.42 1.47 Allowed 'General case' 0 N--CA 1.488 1.445 0 CA-C-N 113.638 -1.619 . . . . 0.0 107.518 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.2 m -75.63 -44.63 41.76 Favored 'General case' 0 N--CA 1.497 1.91 0 CA-C-N 114.744 -1.116 . . . . 0.0 108.166 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 19.1 tptm 54.4 82.8 0.09 Allowed 'General case' 0 N--CA 1.498 1.972 0 CA-C-N 115.001 -0.999 . . . . 0.0 112.495 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 65.42 44.01 3.26 Favored 'General case' 0 N--CA 1.504 2.237 0 N-CA-C 117.402 2.371 . . . . 0.0 117.402 179.875 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 38.1 mtm -130.54 -165.04 1.49 Allowed 'General case' 0 N--CA 1.5 2.064 0 N-CA-C 106.38 -1.711 . . . . 0.0 106.38 179.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 44.8 p -100.65 -153.18 0.44 Allowed 'General case' 0 N--CA 1.503 2.179 0 N-CA-C 107.029 -1.471 . . . . 0.0 107.029 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -108.57 -61.96 1.53 Allowed 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 106.292 -1.744 . . . . 0.0 106.292 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 35.7 ttmt -43.24 -45.41 5.74 Favored 'General case' 0 N--CA 1.5 2.062 0 CA-C-O 121.388 0.613 . . . . 0.0 112.022 179.725 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -69.13 -59.77 2.8 Favored 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 42.6 t -36.64 -49.29 0.75 Allowed 'General case' 0 N--CA 1.503 2.198 0 O-C-N 124.9 1.375 . . . . 0.0 111.721 179.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -53.65 -57.79 9.52 Favored 'General case' 0 N--CA 1.486 1.344 0 CA-C-N 114.637 -1.165 . . . . 0.0 110.784 179.831 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 36.5 t80 -43.11 -23.04 0.04 OUTLIER 'General case' 0 N--CA 1.503 2.204 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.437 ' N ' ' CD1' ' A' ' 14' ' ' PHE . 1.3 m-85 -96.05 -47.29 6.15 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 124.072 0.857 . . . . 0.0 110.384 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 51.6 t -95.01 -50.0 5.29 Favored 'General case' 0 N--CA 1.502 2.163 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 34.7 m170 -90.4 -66.05 0.96 Allowed 'General case' 0 N--CA 1.507 2.379 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 64.5 47.6 2.92 Favored 'General case' 0 N--CA 1.499 2.008 0 N-CA-C 113.31 0.856 . . . . 0.0 113.31 179.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -25.35 -67.0 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.201 0 N-CA-C 114.341 1.238 . . . . 0.0 114.341 179.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 3.5 p -120.97 149.23 23.89 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 CA-C-N 114.466 -1.243 . . . . 0.0 110.226 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 15.8 tt . . . . . 0 N--CA 1.49 1.533 0 CA-C-N 112.404 -2.18 . . . . 0.0 108.291 179.938 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 34.2 m . . . . . 0 N--CA 1.493 1.706 0 CA-C-O 121.297 0.57 . . . . 0.0 110.481 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.9 m -114.23 126.2 54.77 Favored 'General case' 0 N--CA 1.5 2.026 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.775 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 78.1 m -114.28 69.56 0.71 Allowed 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.83 112.54 24.25 Favored 'General case' 0 N--CA 1.499 2.007 0 N-CA-C 105.045 -2.205 . . . . 0.0 105.045 -179.83 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 44.7 62.77 1.93 Allowed 'General case' 0 N--CA 1.497 1.917 0 CA-C-O 122.927 1.346 . . . . 0.0 112.265 -179.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 13.9 mmm -117.13 -177.6 3.25 Favored 'General case' 0 N--CA 1.499 1.987 0 CA-C-N 112.132 -2.304 . . . . 0.0 106.022 179.682 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 75.9 p -109.42 17.47 21.41 Favored 'General case' 0 N--CA 1.506 2.372 0 C-N-CA 119.87 -0.732 . . . . 0.0 110.491 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 10.3 t70 76.6 -66.2 0.27 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 124.983 1.427 . . . . 0.0 109.609 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 77.0 tttt -49.18 -53.87 19.08 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 123.714 0.634 . . . . 0.0 109.69 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 58.2 mm-40 -52.57 -59.32 4.59 Favored 'General case' 0 N--CA 1.494 1.763 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.926 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 8.5 t -46.3 -46.97 18.41 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 124.165 0.916 . . . . 0.0 110.557 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.416 ' N ' HD23 ' A' ' 12' ' ' LEU . 0.8 OUTLIER -54.06 -52.51 60.67 Favored 'General case' 0 N--CA 1.496 1.832 0 CA-C-O 120.889 0.376 . . . . 0.0 110.96 179.721 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -51.87 -14.38 0.37 Allowed 'General case' 0 N--CA 1.499 2.017 0 CA-C-N 115.073 -0.967 . . . . 0.0 112.721 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -104.03 -47.38 4.19 Favored 'General case' 0 N--CA 1.498 1.957 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.933 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 52.5 t -101.43 -45.28 5.36 Favored 'General case' 0 N--CA 1.505 2.292 0 N-CA-C 114.708 1.373 . . . . 0.0 114.708 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 39.2 m170 -94.29 36.9 1.12 Allowed 'General case' 0 N--CA 1.503 2.179 0 CA-C-O 121.796 0.808 . . . . 0.0 109.603 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -120.32 43.1 2.8 Favored 'General case' 0 N--CA 1.496 1.828 0 CA-C-N 114.19 -1.368 . . . . 0.0 107.821 179.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -123.67 41.55 3.45 Favored 'General case' 0 N--CA 1.496 1.846 0 N-CA-C 105.992 -1.855 . . . . 0.0 105.992 179.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.406 HG12 ' N ' ' A' ' 20' ' ' ILE . 37.6 t -125.53 174.05 10.26 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 CA-C-N 113.005 -1.907 . . . . 0.0 107.459 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.406 ' N ' HG12 ' A' ' 19' ' ' VAL . 18.2 tt . . . . . 0 N--CA 1.496 1.835 0 CA-C-O 121.967 0.889 . . . . 0.0 111.574 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 67.6 m . . . . . 0 N--CA 1.493 1.708 0 CA-C-O 120.632 0.253 . . . . 0.0 110.631 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.3 t -120.08 111.0 17.32 Favored 'General case' 0 N--CA 1.497 1.889 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.079 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 78.4 m -110.65 34.81 3.76 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 106.768 -1.567 . . . . 0.0 106.768 179.644 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.38 124.35 11.7 Favored 'General case' 0 N--CA 1.496 1.85 0 CA-C-N 114.8 -1.091 . . . . 0.0 110.433 179.784 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.8 t70 45.12 45.42 9.17 Favored 'General case' 0 N--CA 1.497 1.894 0 CA-C-N 114.09 -1.413 . . . . 0.0 110.984 -179.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 1.1 mmm -126.34 -177.3 3.93 Favored 'General case' 0 N--CA 1.496 1.829 0 CA-C-N 113.67 -1.604 . . . . 0.0 107.58 179.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.8 t -111.99 -154.4 0.54 Allowed 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 106.646 -1.613 . . . . 0.0 106.646 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -98.42 -75.27 0.56 Allowed 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 -179.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -40.73 -51.89 3.02 Favored 'General case' 0 N--CA 1.504 2.266 0 CA-C-O 121.568 0.699 . . . . 0.0 111.343 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 76.7 tt0 -53.36 -62.44 1.65 Allowed 'General case' 0 N--CA 1.492 1.627 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.49 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 25.6 t -49.1 -46.12 44.31 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 123.862 0.726 . . . . 0.0 112.44 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 1.1 mt -48.93 -48.52 42.74 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 123.79 0.681 . . . . 0.0 111.404 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 40.7 t80 -49.29 -22.7 1.13 Allowed 'General case' 0 N--CA 1.5 2.069 0 CA-C-N 115.552 -0.749 . . . . 0.0 112.532 179.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -104.5 -20.89 13.55 Favored 'General case' 0 N--CA 1.501 2.125 0 O-C-N 123.646 0.591 . . . . 0.0 111.257 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 37.4 t -108.91 -58.02 2.07 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 123.884 0.74 . . . . 0.0 111.874 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 11.1 m170 -72.25 -36.06 68.96 Favored 'General case' 0 N--CA 1.498 1.97 0 N-CA-C 112.332 0.494 . . . . 0.0 112.332 179.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -112.32 54.26 0.71 Allowed 'General case' 0 N--CA 1.495 1.794 0 CA-C-O 122.829 1.299 . . . . 0.0 107.736 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -100.72 -45.28 5.54 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 112.923 -1.944 . . . . 0.0 111.053 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 28.8 m -94.9 163.43 2.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 123.818 0.699 . . . . 0.0 109.848 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 55.1 mt . . . . . 0 N--CA 1.495 1.805 0 O-C-N 124.622 1.201 . . . . 0.0 110.468 -179.72 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.469 ' SG ' ' CD2' ' A' ' 16' ' ' HIS . 63.6 m . . . . . 0 N--CA 1.493 1.696 0 CA-C-O 121.531 0.682 . . . . 0.0 111.42 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 71.0 p -128.12 126.22 40.7 Favored 'General case' 0 N--CA 1.492 1.65 0 CA-C-N 114.062 -1.426 . . . . 0.0 110.207 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 14.6 m -120.6 80.94 1.69 Allowed 'General case' 0 N--CA 1.496 1.865 0 N-CA-C 105.812 -1.922 . . . . 0.0 105.812 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 80.9 tttt -110.99 97.16 6.61 Favored 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 113.779 1.029 . . . . 0.0 113.779 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.3 t70 100.8 21.64 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.5 0 C-N-CA 127.762 2.425 . . . . 0.0 106.445 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -130.63 -170.95 2.44 Favored 'General case' 0 N--CA 1.494 1.74 0 CA-C-N 114.151 -1.386 . . . . 0.0 110.375 -179.842 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 55.2 p -110.72 -145.4 0.4 Allowed 'General case' 0 N--CA 1.499 1.986 0 N-CA-C 106.505 -1.665 . . . . 0.0 106.505 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -112.91 -60.27 1.9 Allowed 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 105.805 -1.924 . . . . 0.0 105.805 179.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.414 ' HE2' ' C ' ' A' ' 9' ' ' LYS . 0.0 OUTLIER -45.22 -51.88 10.14 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 124.134 0.896 . . . . 0.0 109.241 179.889 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -65.47 -55.7 16.47 Favored 'General case' 0 N--CA 1.496 1.842 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.216 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 49.0 t -40.08 -51.42 2.6 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 124.644 1.215 . . . . 0.0 110.892 179.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.416 ' C ' ' H ' ' A' ' 14' ' ' PHE . 0.7 OUTLIER -56.9 -44.59 82.5 Favored 'General case' 0 N--CA 1.495 1.794 0 CA-C-N 114.784 -1.098 . . . . 0.0 110.785 179.697 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 11.7 t80 -58.13 -3.91 0.29 Allowed 'General case' 0 N--CA 1.493 1.711 0 CA-C-N 115.054 -0.975 . . . . 0.0 111.4 179.593 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.416 ' H ' ' C ' ' A' ' 12' ' ' LEU . 2.6 m-85 -116.66 -46.0 2.77 Favored 'General case' 0 N--CA 1.504 2.236 0 C-N-CA 123.219 0.608 . . . . 0.0 110.775 -179.8 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 21.2 t -98.97 -37.04 9.54 Favored 'General case' 0 N--CA 1.5 2.071 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.469 ' CD2' ' SG ' ' A' ' 1' ' ' CYS . 30.6 m170 -102.74 40.08 1.43 Allowed 'General case' 0 N--CA 1.502 2.171 0 CA-C-O 121.515 0.674 . . . . 0.0 109.897 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -112.72 45.07 1.37 Allowed 'General case' 0 N--CA 1.497 1.921 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 179.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -107.02 70.22 0.79 Allowed 'General case' 0 N--CA 1.489 1.525 0 CA-C-N 113.035 -1.893 . . . . 0.0 109.658 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 34.0 m -102.84 133.04 47.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 CA-C-N 112.746 -2.024 . . . . 0.0 109.406 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 19.2 tt -126.37 54.53 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 CA-C-O 123.357 1.551 . . . . 0.0 108.175 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . 0.449 ' CE3' ' N ' ' A' ' 21' ' ' TRP . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.748 0 CA-C-N 112.61 -2.086 . . . . 0.0 112.159 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 60.3 m . . . . . 0 N--CA 1.489 1.507 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.6 p 14.97 83.75 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.547 0 N-CA-C 115.165 1.543 . . . . 0.0 115.165 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 66.2 m -94.99 65.81 2.95 Favored 'General case' 0 N--CA 1.494 1.747 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.041 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -104.05 137.92 41.32 Favored 'General case' 0 N--CA 1.496 1.865 0 CA-C-N 113.933 -1.485 . . . . 0.0 108.283 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.7 t70 52.91 31.97 11.74 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 114.213 -1.358 . . . . 0.0 110.302 -179.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 4.1 mtp -133.86 173.75 11.2 Favored 'General case' 0 N--CA 1.503 2.207 0 CA-C-N 114.452 -1.249 . . . . 0.0 108.756 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 61.9 p -112.52 163.9 13.94 Favored 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 106.364 -1.717 . . . . 0.0 106.364 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 28.1 m-20 -47.61 -67.63 0.26 Allowed 'General case' 0 N--CA 1.497 1.908 0 O-C-N 123.906 0.754 . . . . 0.0 111.947 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 23.1 ttmm -47.28 -53.2 14.08 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 123.988 0.805 . . . . 0.0 111.839 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -49.8 -60.47 2.87 Favored 'General case' 0 N--CA 1.498 1.955 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.367 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 6.6 t -49.48 -49.82 43.96 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 124.381 1.05 . . . . 0.0 110.494 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.45 HD13 ' CE1' ' A' ' 16' ' ' HIS . 1.3 mt -49.85 -52.99 28.37 Favored 'General case' 0 N--CA 1.498 1.931 0 CA-C-O 121.716 0.77 . . . . 0.0 111.522 179.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -48.18 -21.64 0.52 Allowed 'General case' 0 N--CA 1.498 1.929 0 CA-C-N 114.684 -1.144 . . . . 0.0 113.201 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -102.7 -39.65 6.95 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 123.743 0.652 . . . . 0.0 109.543 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 16.1 t -89.99 -68.09 0.8 Allowed 'General case' 0 N--CA 1.498 1.933 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.899 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.45 ' CE1' HD13 ' A' ' 12' ' ' LEU . 3.7 m170 -47.26 -42.73 21.19 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 123.652 0.595 . . . . 0.0 110.633 179.659 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 36.7 tt0 69.92 67.92 0.23 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 125.646 1.841 . . . . 0.0 106.608 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -106.14 73.25 0.97 Allowed 'General case' 0 N--CA 1.492 1.665 0 CA-C-N 112.836 -1.984 . . . . 0.0 108.973 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 26.8 m -106.25 168.69 2.81 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 CA-C-N 112.568 -2.105 . . . . 0.0 107.41 179.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 18.3 tt -124.99 117.91 51.52 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.022 0 CA-C-O 121.383 0.611 . . . . 0.0 111.66 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 50.5 m95 . . . . . 0 N--CA 1.496 1.828 0 CA-C-N 114.573 -1.194 . . . . 0.0 108.61 179.684 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 83.7 m . . . . . 0 N--CA 1.493 1.701 0 CA-C-O 121.319 0.581 . . . . 0.0 111.462 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.2 t -132.69 159.56 39.27 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-N 113.867 -1.515 . . . . 0.0 108.716 179.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 68.1 m -126.39 24.43 6.75 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 124.289 0.993 . . . . 0.0 109.636 179.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.4 tppt? -24.5 126.16 0.04 OUTLIER 'General case' 0 N--CA 1.512 2.651 0 O-C-N 124.563 1.165 . . . . 0.0 111.863 179.471 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.3 p30 33.69 35.0 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.362 0 N-CA-C 116.364 1.987 . . . . 0.0 116.364 -179.457 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 23.8 mtm -122.6 -170.04 2.02 Favored 'General case' 0 N--CA 1.505 2.29 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 179.47 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.7 t -110.61 -159.14 0.67 Allowed 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 106.333 -1.728 . . . . 0.0 106.333 179.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -103.2 -61.46 1.41 Allowed 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -37.25 -36.46 0.14 Allowed 'General case' 0 N--CA 1.501 2.082 0 O-C-N 124.943 1.402 . . . . 0.0 112.987 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -87.62 -54.72 4.12 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-N 114.731 -1.122 . . . . 0.0 108.942 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 20.8 t -41.14 -44.06 2.43 Favored 'General case' 0 N--CA 1.505 2.276 0 CA-C-O 122.019 0.914 . . . . 0.0 110.556 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.457 HD13 ' ND1' ' A' ' 16' ' ' HIS . 0.8 OUTLIER -52.37 -56.38 15.32 Favored 'General case' 0 N--CA 1.489 1.525 0 CA-C-N 114.323 -1.308 . . . . 0.0 111.243 179.739 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 47.0 t80 -47.05 -26.92 1.17 Allowed 'General case' 0 N--CA 1.498 1.967 0 CA-C-N 114.476 -1.238 . . . . 0.0 112.72 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -89.84 -43.31 10.72 Favored 'General case' 0 N--CA 1.498 1.959 0 CA-C-N 114.428 -1.26 . . . . 0.0 110.728 -179.777 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 49.4 t -99.91 -63.05 1.16 Allowed 'General case' 0 N--CA 1.5 2.074 0 O-C-N 123.724 0.64 . . . . 0.0 111.886 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.457 ' ND1' HD13 ' A' ' 12' ' ' LEU . 11.7 m170 -50.71 -40.06 53.22 Favored 'General case' 0 N--CA 1.504 2.26 0 CA-C-O 121.19 0.519 . . . . 0.0 111.609 179.818 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -118.59 51.22 1.11 Allowed 'General case' 0 N--CA 1.493 1.688 0 CA-C-N 114.074 -1.421 . . . . 0.0 108.68 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 59.3 t0 -69.38 -48.84 59.98 Favored 'General case' 0 N--CA 1.493 1.718 0 CA-C-N 113.471 -1.695 . . . . 0.0 106.716 179.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.435 HG22 ' N ' ' A' ' 20' ' ' ILE . 7.9 p -120.16 168.18 12.78 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.908 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 179.643 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.435 ' N ' HG22 ' A' ' 19' ' ' VAL . 42.1 mm -123.34 141.12 44.8 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 124.579 1.174 . . . . 0.0 111.304 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 49.4 m95 . . . . . 0 N--CA 1.494 1.754 0 CA-C-O 116.791 -1.576 . . . . 0.0 110.294 179.763 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 39.1 m . . . . . 0 N--CA 1.492 1.64 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.1 m -120.85 151.17 39.97 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.782 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 67.9 m -125.51 73.9 1.36 Allowed 'General case' 0 N--CA 1.497 1.922 0 N-CA-C 106.296 -1.742 . . . . 0.0 106.296 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -108.73 103.21 12.25 Favored 'General case' 0 N--CA 1.495 1.822 0 CA-C-N 113.949 -1.478 . . . . 0.0 111.505 -179.688 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.3 t70 90.34 37.53 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.121 0 O-C-N 125.871 1.982 . . . . 0.0 107.644 179.755 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -136.05 -177.2 4.59 Favored 'General case' 0 N--CA 1.493 1.702 0 CA-C-N 112.956 -1.929 . . . . 0.0 109.619 179.815 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 40.7 p -107.5 -114.86 0.27 Allowed 'General case' 0 N--CA 1.496 1.848 0 N-CA-C 104.984 -2.228 . . . . 0.0 104.984 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -130.18 -64.83 0.84 Allowed 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 106.618 -1.623 . . . . 0.0 106.618 179.601 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.6 ttmt -52.17 -49.32 64.04 Favored 'General case' 0 N--CA 1.493 1.689 0 CA-C-N 113.77 -1.559 . . . . 0.0 112.547 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -59.02 -55.63 32.68 Favored 'General case' 0 N--CA 1.498 1.966 0 C-N-CA 119.796 -0.762 . . . . 0.0 109.431 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 27.2 t -44.57 -51.26 9.14 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 124.258 0.974 . . . . 0.0 109.64 179.698 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.441 HD22 ' CD2' ' A' ' 16' ' ' HIS . 0.6 OUTLIER -52.86 -53.93 41.85 Favored 'General case' 0 N--CA 1.496 1.871 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.161 179.565 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.519 ' HA ' ' HB2' ' A' ' 17' ' ' GLN . 40.9 t80 -45.77 -18.7 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.104 0 CA-C-N 115.073 -0.967 . . . . 0.0 113.139 179.659 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.404 ' CD1' ' N ' ' A' ' 14' ' ' PHE . 1.7 m-85 -103.03 -41.17 6.19 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 124.186 0.929 . . . . 0.0 111.831 -179.798 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 42.2 t -97.42 -51.01 4.31 Favored 'General case' 0 N--CA 1.503 2.176 0 N-CA-C 114.277 1.214 . . . . 0.0 114.277 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.441 ' CD2' HD22 ' A' ' 12' ' ' LEU . 42.1 m-70 -79.45 -22.97 43.46 Favored 'General case' 0 N--CA 1.496 1.84 0 N-CA-C 114.855 1.428 . . . . 0.0 114.855 -179.698 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.519 ' HB2' ' HA ' ' A' ' 13' ' ' TYR . 37.4 mt-30 -118.17 40.48 3.16 Favored 'General case' 0 N--CA 1.5 2.074 0 N-CA-C 114.803 1.408 . . . . 0.0 114.803 -179.901 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -125.26 -73.51 0.63 Allowed 'General case' 0 N--CA 1.504 2.246 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.377 179.558 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 19.7 m -120.42 146.12 25.77 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.358 0 O-C-N 124.57 1.169 . . . . 0.0 109.969 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 19.2 tt -128.48 53.35 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 CA-C-O 124.064 1.888 . . . . 0.0 106.834 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . 0.467 ' CE3' ' N ' ' A' ' 21' ' ' TRP . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.493 0 CA-C-N 111.723 -2.489 . . . . 0.0 112.469 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 87.1 m . . . . . 0 N--CA 1.493 1.69 0 CA-C-O 121.14 0.495 . . . . 0.0 111.57 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 53.1 m -116.2 89.09 3.03 Favored 'General case' 0 N--CA 1.496 1.827 0 CA-C-N 114.62 -1.173 . . . . 0.0 108.702 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 46.9 m -104.08 58.96 0.72 Allowed 'General case' 0 N--CA 1.499 2.006 0 CA-C-N 114.671 -1.15 . . . . 0.0 110.075 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -67.99 115.6 7.69 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-N 114.357 -1.292 . . . . 0.0 110.411 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.3 t70 59.18 39.74 22.52 Favored 'General case' 0 N--CA 1.498 1.952 0 CA-C-N 114.049 -1.432 . . . . 0.0 110.293 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 4.9 mtp -131.12 -178.59 4.9 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-N 113.906 -1.497 . . . . 0.0 108.532 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 60.3 p -108.89 -157.07 0.6 Allowed 'General case' 0 N--CA 1.501 2.101 0 N-CA-C 105.851 -1.907 . . . . 0.0 105.851 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -105.47 -67.74 0.9 Allowed 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 104.357 -2.46 . . . . 0.0 104.357 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.4 tpmt? -34.51 -46.98 0.3 Allowed 'General case' 0 N--CA 1.501 2.085 0 O-C-N 124.731 1.269 . . . . 0.0 113.326 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -80.28 -54.68 5.51 Favored 'General case' 0 N--CA 1.492 1.65 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.542 -179.656 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 48.0 t -44.32 -43.34 7.4 Favored 'General case' 0 N--CA 1.503 2.215 0 CA-C-O 121.615 0.722 . . . . 0.0 111.321 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.443 HD22 ' CD2' ' A' ' 16' ' ' HIS . 0.6 OUTLIER -53.35 -44.06 68.23 Favored 'General case' 0 N--CA 1.494 1.728 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.727 179.7 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 44.5 t80 -51.5 -17.67 0.87 Allowed 'General case' 0 N--CA 1.5 2.066 0 CA-C-N 115.245 -0.889 . . . . 0.0 111.535 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -106.27 -49.54 3.34 Favored 'General case' 0 N--CA 1.494 1.741 0 CA-C-N 114.92 -1.037 . . . . 0.0 112.489 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 42.1 t -104.77 16.78 25.35 Favored 'General case' 0 N--CA 1.505 2.317 0 N-CA-C 118.048 2.611 . . . . 0.0 118.048 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.443 ' CD2' HD22 ' A' ' 12' ' ' LEU . 1.1 m-70 -133.95 -47.22 0.79 Allowed 'General case' 0 N--CA 1.501 2.107 0 CA-C-O 120.809 0.338 . . . . 0.0 110.365 179.706 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 27.4 tt0 45.73 44.78 10.9 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 125.025 1.453 . . . . 0.0 109.047 -179.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -47.04 -50.88 18.71 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-N 113.69 -1.595 . . . . 0.0 110.233 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 12.2 p -124.22 158.54 30.73 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.759 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.032 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 18.6 tt -156.62 152.47 7.96 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 CA-C-N 112.875 -1.966 . . . . 0.0 108.895 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 63.0 m95 . . . . . 0 N--CA 1.494 1.752 0 CA-C-O 116.659 -1.639 . . . . 0.0 109.529 179.709 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.41 ' SG ' ' CD2' ' A' ' 16' ' ' HIS . 80.6 m . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.583 0.706 . . . . 0.0 112.393 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.7 t -132.5 125.6 31.0 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 106.788 -1.56 . . . . 0.0 106.788 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 93.2 m -123.24 74.79 1.26 Allowed 'General case' 0 N--CA 1.497 1.894 0 N-CA-C 114.249 1.203 . . . . 0.0 114.249 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.478 ' O ' ' SD ' ' A' ' 6' ' ' MET . 91.7 mttt -96.04 168.11 10.81 Favored 'General case' 0 N--CA 1.498 1.953 0 N-CA-C 106.51 -1.663 . . . . 0.0 106.51 179.617 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.1 p30 29.44 35.18 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.438 0 N-CA-C 115.501 1.667 . . . . 0.0 115.501 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . 0.478 ' SD ' ' O ' ' A' ' 4' ' ' LYS . 0.6 OUTLIER -142.13 -173.18 3.75 Favored 'General case' 0 N--CA 1.495 1.812 0 CA-C-N 113.479 -1.691 . . . . 0.0 108.196 179.77 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.8 t -112.83 -136.87 0.37 Allowed 'General case' 0 N--CA 1.495 1.776 0 N-CA-C 103.837 -2.653 . . . . 0.0 103.837 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -112.62 -68.14 0.95 Allowed 'General case' 0 N--CA 1.497 1.918 0 CA-C-N 119.051 0.841 . . . . 0.0 112.977 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.4 tmtt? -45.85 -62.17 1.42 Allowed 'General case' 0 N--CA 1.498 1.946 0 O-C-N 123.44 0.462 . . . . 0.0 110.408 -179.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -47.16 -60.98 2.11 Favored 'General case' 0 N--CA 1.5 2.029 0 C-N-CA 120.467 -0.493 . . . . 0.0 111.55 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 53.2 t -41.74 -52.32 3.94 Favored 'General case' 0 N--CA 1.505 2.31 0 CA-C-O 121.443 0.639 . . . . 0.0 111.107 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -54.7 -56.14 22.34 Favored 'General case' 0 N--CA 1.492 1.66 0 CA-C-N 115.168 -0.924 . . . . 0.0 109.555 179.715 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.428 ' HA ' ' HB3' ' A' ' 17' ' ' GLN . 36.0 t80 -37.12 -27.54 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.943 0 O-C-N 124.756 1.285 . . . . 0.0 113.01 179.692 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -97.06 -49.81 4.85 Favored 'General case' 0 N--CA 1.503 2.224 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 -179.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 47.6 t -91.08 -41.16 11.21 Favored 'General case' 0 N--CA 1.504 2.272 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -179.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.41 ' CD2' ' SG ' ' A' ' 1' ' ' CYS . 33.9 m-70 -89.58 -17.14 29.09 Favored 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.428 ' HB3' ' HA ' ' A' ' 13' ' ' TYR . 10.3 tt0 -125.85 41.47 3.51 Favored 'General case' 0 N--CA 1.501 2.104 0 N-CA-C 116.975 2.213 . . . . 0.0 116.975 -179.646 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 43.3 m-20 -119.78 -82.1 0.64 Allowed 'General case' 0 N--CA 1.507 2.402 0 N-CA-C 114.168 1.173 . . . . 0.0 114.168 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.7 t -119.92 156.35 22.62 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.245 0 CA-C-N 118.757 0.708 . . . . 0.0 109.986 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 61.3 mt -126.88 121.84 59.12 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 CA-C-N 114.112 -1.404 . . . . 0.0 108.155 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . 0.467 ' CE3' ' N ' ' A' ' 21' ' ' TRP . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.816 0 CA-C-N 114.103 -1.408 . . . . 0.0 112.052 -179.772 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.3 m . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.008 0.432 . . . . 0.0 110.382 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 29.0 t -123.98 -174.76 3.06 Favored 'General case' 0 N--CA 1.499 2.008 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 91.2 m -130.92 -48.42 1.03 Allowed 'General case' 0 N--CA 1.495 1.776 0 CA-C-N 115.177 -0.919 . . . . 0.0 109.553 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 34.7 ttmt 9.61 58.11 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.533 0 O-C-N 126.916 2.635 . . . . 0.0 113.119 -179.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.419 ' HB3' ' SD ' ' A' ' 6' ' ' MET . 2.6 t70 166.54 -44.49 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.89 0 CA-C-N 112.752 -2.022 . . . . 0.0 106.267 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . 0.419 ' SD ' ' HB3' ' A' ' 5' ' ' ASP . 3.6 mpp? -98.34 -175.23 3.05 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 124.209 0.943 . . . . 0.0 111.623 -179.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 55.2 p -94.39 -94.2 0.17 Allowed 'General case' 0 N--CA 1.496 1.838 0 CA-C-N 114.939 -1.028 . . . . 0.0 110.926 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -145.02 -60.05 0.35 Allowed 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 24.5 tptt -46.74 -53.46 11.77 Favored 'General case' 0 N--CA 1.503 2.184 0 CA-C-O 122.135 0.969 . . . . 0.0 109.425 -179.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -53.63 -64.86 0.69 Allowed 'General case' 0 N--CA 1.495 1.779 0 CA-C-N 113.316 -1.765 . . . . 0.0 107.399 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 9.3 m -32.26 -56.54 0.33 Allowed 'General case' 0 N--CA 1.501 2.083 0 CA-C-N 113.896 -1.502 . . . . 0.0 111.17 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.446 HD22 ' CD2' ' A' ' 16' ' ' HIS . 3.0 mt -52.95 -56.2 17.72 Favored 'General case' 0 N--CA 1.49 1.569 0 CA-C-N 113.832 -1.531 . . . . 0.0 112.62 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 35.1 t80 -38.71 -34.76 0.16 Allowed 'General case' 0 N--CA 1.499 1.977 0 CA-C-N 114.808 -1.087 . . . . 0.0 112.689 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -90.08 -51.89 5.23 Favored 'General case' 0 N--CA 1.498 1.971 0 CA-C-N 113.809 -1.541 . . . . 0.0 111.033 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 48.3 t -78.7 -64.48 1.17 Allowed 'General case' 0 N--CA 1.497 1.915 0 O-C-N 123.645 0.591 . . . . 0.0 112.169 -179.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.446 ' CD2' HD22 ' A' ' 12' ' ' LEU . 1.5 m-70 -45.68 -55.39 6.49 Favored 'General case' 0 N--CA 1.503 2.216 0 CA-C-O 121.831 0.824 . . . . 0.0 111.994 179.842 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 54.53 66.65 1.18 Allowed 'General case' 0 N--CA 1.488 1.446 0 CA-C-N 112.153 -2.294 . . . . 0.0 108.451 -179.66 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -90.62 -44.9 9.23 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-N 113.39 -1.732 . . . . 0.0 111.388 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.461 ' HB ' ' NE1' ' A' ' 21' ' ' TRP . 35.9 m -114.65 140.75 34.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 123.883 0.739 . . . . 0.0 110.721 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 14.2 tt -121.54 89.03 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 CA-C-N 114.083 -1.417 . . . . 0.0 108.625 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . 0.461 ' NE1' ' HB ' ' A' ' 19' ' ' VAL . 22.9 m95 . . . . . 0 N--CA 1.497 1.915 0 CA-C-O 116.084 -1.912 . . . . 0.0 108.896 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 84.3 m . . . . . 0 N--CA 1.49 1.567 0 CA-C-O 121.752 0.787 . . . . 0.0 111.849 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 43.5 t -120.42 79.42 1.47 Allowed 'General case' 0 N--CA 1.488 1.445 0 CA-C-N 113.638 -1.619 . . . . 0.0 107.518 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.2 m -75.63 -44.63 41.76 Favored 'General case' 0 N--CA 1.497 1.91 0 CA-C-N 114.744 -1.116 . . . . 0.0 108.166 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 19.1 tptm 54.4 82.8 0.09 Allowed 'General case' 0 N--CA 1.498 1.972 0 CA-C-N 115.001 -0.999 . . . . 0.0 112.495 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 65.42 44.01 3.26 Favored 'General case' 0 N--CA 1.504 2.237 0 N-CA-C 117.402 2.371 . . . . 0.0 117.402 179.875 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 38.1 mtm -130.54 -165.04 1.49 Allowed 'General case' 0 N--CA 1.5 2.064 0 N-CA-C 106.38 -1.711 . . . . 0.0 106.38 179.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 44.8 p -100.65 -153.18 0.44 Allowed 'General case' 0 N--CA 1.503 2.179 0 N-CA-C 107.029 -1.471 . . . . 0.0 107.029 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -108.57 -61.96 1.53 Allowed 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 106.292 -1.744 . . . . 0.0 106.292 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 35.7 ttmt -43.24 -45.41 5.74 Favored 'General case' 0 N--CA 1.5 2.062 0 CA-C-O 121.388 0.613 . . . . 0.0 112.022 179.725 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -69.13 -59.77 2.8 Favored 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 42.6 t -36.64 -49.29 0.75 Allowed 'General case' 0 N--CA 1.503 2.198 0 O-C-N 124.9 1.375 . . . . 0.0 111.721 179.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -53.65 -57.79 9.52 Favored 'General case' 0 N--CA 1.486 1.344 0 CA-C-N 114.637 -1.165 . . . . 0.0 110.784 179.831 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 36.5 t80 -43.11 -23.04 0.04 OUTLIER 'General case' 0 N--CA 1.503 2.204 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.437 ' N ' ' CD1' ' A' ' 14' ' ' PHE . 1.3 m-85 -96.05 -47.29 6.15 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 124.072 0.857 . . . . 0.0 110.384 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 51.6 t -95.01 -50.0 5.29 Favored 'General case' 0 N--CA 1.502 2.163 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 34.7 m170 -90.4 -66.05 0.96 Allowed 'General case' 0 N--CA 1.507 2.379 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 64.5 47.6 2.92 Favored 'General case' 0 N--CA 1.499 2.008 0 N-CA-C 113.31 0.856 . . . . 0.0 113.31 179.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -25.35 -67.0 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.201 0 N-CA-C 114.341 1.238 . . . . 0.0 114.341 179.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 3.5 p -120.97 149.23 23.89 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 CA-C-N 114.466 -1.243 . . . . 0.0 110.226 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 15.8 tt -147.03 71.01 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 CA-C-N 112.404 -2.18 . . . . 0.0 108.291 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . 0.446 ' CE3' ' N ' ' A' ' 21' ' ' TRP . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.687 0 CA-C-N 112.411 -2.177 . . . . 0.0 113.743 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 34.2 m . . . . . 0 N--CA 1.493 1.706 0 CA-C-O 121.297 0.57 . . . . 0.0 110.481 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.9 m -114.23 126.2 54.77 Favored 'General case' 0 N--CA 1.5 2.026 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.775 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 78.1 m -114.28 69.56 0.71 Allowed 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.83 112.54 24.25 Favored 'General case' 0 N--CA 1.499 2.007 0 N-CA-C 105.045 -2.205 . . . . 0.0 105.045 -179.83 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 44.7 62.77 1.93 Allowed 'General case' 0 N--CA 1.497 1.917 0 CA-C-O 122.927 1.346 . . . . 0.0 112.265 -179.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 13.9 mmm -117.13 -177.6 3.25 Favored 'General case' 0 N--CA 1.499 1.987 0 CA-C-N 112.132 -2.304 . . . . 0.0 106.022 179.682 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 75.9 p -109.42 17.47 21.41 Favored 'General case' 0 N--CA 1.506 2.372 0 C-N-CA 119.87 -0.732 . . . . 0.0 110.491 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 10.3 t70 76.6 -66.2 0.27 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 124.983 1.427 . . . . 0.0 109.609 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 77.0 tttt -49.18 -53.87 19.08 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 123.714 0.634 . . . . 0.0 109.69 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 58.2 mm-40 -52.57 -59.32 4.59 Favored 'General case' 0 N--CA 1.494 1.763 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.926 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 8.5 t -46.3 -46.97 18.41 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 124.165 0.916 . . . . 0.0 110.557 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.416 ' N ' HD23 ' A' ' 12' ' ' LEU . 0.8 OUTLIER -54.06 -52.51 60.67 Favored 'General case' 0 N--CA 1.496 1.832 0 CA-C-O 120.889 0.376 . . . . 0.0 110.96 179.721 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -51.87 -14.38 0.37 Allowed 'General case' 0 N--CA 1.499 2.017 0 CA-C-N 115.073 -0.967 . . . . 0.0 112.721 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -104.03 -47.38 4.19 Favored 'General case' 0 N--CA 1.498 1.957 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.933 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 52.5 t -101.43 -45.28 5.36 Favored 'General case' 0 N--CA 1.505 2.292 0 N-CA-C 114.708 1.373 . . . . 0.0 114.708 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 39.2 m170 -94.29 36.9 1.12 Allowed 'General case' 0 N--CA 1.503 2.179 0 CA-C-O 121.796 0.808 . . . . 0.0 109.603 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -120.32 43.1 2.8 Favored 'General case' 0 N--CA 1.496 1.828 0 CA-C-N 114.19 -1.368 . . . . 0.0 107.821 179.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -123.67 41.55 3.45 Favored 'General case' 0 N--CA 1.496 1.846 0 N-CA-C 105.992 -1.855 . . . . 0.0 105.992 179.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.406 HG12 ' N ' ' A' ' 20' ' ' ILE . 37.6 t -125.53 174.05 10.26 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 CA-C-N 113.005 -1.907 . . . . 0.0 107.459 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.406 ' N ' HG12 ' A' ' 19' ' ' VAL . 18.2 tt -99.57 80.16 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 CA-C-O 121.967 0.889 . . . . 0.0 111.574 -179.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 42.9 m95 . . . . . 0 N--CA 1.5 2.055 0 CA-C-N 114.722 -1.126 . . . . 0.0 108.667 179.814 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 67.6 m . . . . . 0 N--CA 1.493 1.708 0 CA-C-O 120.632 0.253 . . . . 0.0 110.631 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.3 t -120.08 111.0 17.32 Favored 'General case' 0 N--CA 1.497 1.889 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.079 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 78.4 m -110.65 34.81 3.76 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 106.768 -1.567 . . . . 0.0 106.768 179.644 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.38 124.35 11.7 Favored 'General case' 0 N--CA 1.496 1.85 0 CA-C-N 114.8 -1.091 . . . . 0.0 110.433 179.784 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.8 t70 45.12 45.42 9.17 Favored 'General case' 0 N--CA 1.497 1.894 0 CA-C-N 114.09 -1.413 . . . . 0.0 110.984 -179.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 1.1 mmm -126.34 -177.3 3.93 Favored 'General case' 0 N--CA 1.496 1.829 0 CA-C-N 113.67 -1.604 . . . . 0.0 107.58 179.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.8 t -111.99 -154.4 0.54 Allowed 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 106.646 -1.613 . . . . 0.0 106.646 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -98.42 -75.27 0.56 Allowed 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 -179.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -40.73 -51.89 3.02 Favored 'General case' 0 N--CA 1.504 2.266 0 CA-C-O 121.568 0.699 . . . . 0.0 111.343 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 76.7 tt0 -53.36 -62.44 1.65 Allowed 'General case' 0 N--CA 1.492 1.627 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.49 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 25.6 t -49.1 -46.12 44.31 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 123.862 0.726 . . . . 0.0 112.44 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 1.1 mt -48.93 -48.52 42.74 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 123.79 0.681 . . . . 0.0 111.404 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 40.7 t80 -49.29 -22.7 1.13 Allowed 'General case' 0 N--CA 1.5 2.069 0 CA-C-N 115.552 -0.749 . . . . 0.0 112.532 179.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -104.5 -20.89 13.55 Favored 'General case' 0 N--CA 1.501 2.125 0 O-C-N 123.646 0.591 . . . . 0.0 111.257 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 37.4 t -108.91 -58.02 2.07 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 123.884 0.74 . . . . 0.0 111.874 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 11.1 m170 -72.25 -36.06 68.96 Favored 'General case' 0 N--CA 1.498 1.97 0 N-CA-C 112.332 0.494 . . . . 0.0 112.332 179.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -112.32 54.26 0.71 Allowed 'General case' 0 N--CA 1.495 1.794 0 CA-C-O 122.829 1.299 . . . . 0.0 107.736 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -100.72 -45.28 5.54 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 112.923 -1.944 . . . . 0.0 111.053 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 28.8 m -94.9 163.43 2.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 123.818 0.699 . . . . 0.0 109.848 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 55.1 mt -124.59 76.34 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.805 0 O-C-N 124.622 1.201 . . . . 0.0 110.468 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 10.6 m95 . . . . . 0 N--CA 1.504 2.25 0 CA-C-O 117.518 -1.23 . . . . 0.0 110.243 179.785 . . . . . . . . 0 0 . 1 stop_ save_