data_1mx7_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 1mx7 _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 . . . . . 0 CA--C 1.534 0.341 0 N-CA-C 113.569 0.952 . . . . 10.0 113.569 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 26.5 m-85 -40.14 -22.56 0.01 OUTLIER 'General case' 0 C--O 1.245 0.819 0 N-CA-C 117.844 2.535 . . . . 10.0 117.844 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -49.05 104.77 0.07 Allowed 'General case' 0 N--CA 1.475 0.775 0 O-C-N 125.738 1.899 . . . . 10.0 111.248 179.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -152.21 -163.44 11.57 Favored Glycine 0 N--CA 1.449 -0.458 0 N-CA-C 118.194 2.038 . . . . 10.0 118.194 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -135.31 110.85 9.17 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 100.843 -3.762 . . . . 10.0 100.843 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.515 ' CZ2' HD23 ' A' ' 115' ' ' LEU . 46.5 m0 -112.63 116.43 30.17 Favored 'General case' 0 CA--C 1.506 -0.747 0 O-C-N 124.095 0.872 . . . . 10.0 112.373 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.78 148.63 22.42 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 117.658 -1.163 . . . . 10.0 107.946 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 2.6 mtt -86.03 128.66 34.9 Favored 'General case' 0 C--N 1.314 -0.942 0 O-C-N 126.671 2.482 . . . . 10.0 111.411 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -104.5 -53.12 2.77 Favored 'General case' 0 C--N 1.317 -0.813 0 O-C-N 124.914 1.384 . . . . 10.0 108.053 179.809 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -118.09 -172.36 2.24 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 113.53 0.937 . . . . 10.0 113.53 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 177.43 104.97 0.02 OUTLIER 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 106.655 -1.609 . . . . 10.0 106.655 179.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -107.2 151.13 25.83 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 116.551 2.056 . . . . 10.0 116.551 -179.793 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 34.03 34.33 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 116.647 2.091 . . . . 10.0 116.647 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -71.04 -29.99 66.05 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 115.554 1.687 . . . . 10.0 115.554 -179.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -75.38 -36.38 60.91 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 121.197 -0.939 . . . . 10.0 111.641 179.721 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -74.49 -23.45 58.86 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 107.785 -1.191 . . . . 10.0 107.785 -179.693 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -69.36 -34.81 75.13 Favored 'General case' 0 CA--C 1.552 1.054 0 N-CA-C 108.492 -0.929 . . . . 10.0 108.492 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 34.6 mt -79.0 -28.84 43.44 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 108.821 -0.807 . . . . 10.0 108.821 179.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.6 ttt180 -73.83 -35.96 64.87 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 114.312 -1.313 . . . . 10.0 108.65 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.29 -33.65 71.81 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 126.695 2.497 . . . . 10.0 110.879 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.7 mt -91.32 5.38 49.46 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 115.179 -0.919 . . . . 10.0 109.124 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 52.72 38.09 25.4 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 116.707 2.114 . . . . 10.0 116.707 -179.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 1.4 m -79.79 179.11 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 N-CA-C 106.036 -1.839 . . . . 10.0 106.036 179.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -72.35 159.49 33.94 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 117.462 2.393 . . . . 10.0 117.462 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.0 m -72.64 -35.46 50.61 Favored 'Isoleucine or valine' 0 C--O 1.242 0.668 0 C-N-CA 125.735 1.614 . . . . 10.0 112.836 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.72 -28.19 64.55 Favored 'General case' 0 N--CA 1.445 -0.724 0 O-C-N 120.286 -1.509 . . . . 10.0 111.558 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 22.9 tp -69.32 -45.23 70.02 Favored 'General case' 0 C--O 1.216 -0.705 0 CA-C-N 114.477 -1.238 . . . . 10.0 110.392 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.17 -20.44 61.59 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-N 113.107 -1.86 . . . . 10.0 112.333 179.854 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.75 -47.4 47.14 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 118.894 -2.379 . . . . 10.0 109.534 -179.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.1 mm -78.95 -44.7 24.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 O-C-N 126.803 2.564 . . . . 10.0 111.21 -179.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -55.88 -35.16 66.21 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 116.486 2.032 . . . . 10.0 116.486 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -67.51 -55.4 13.68 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 121.845 2.111 . . . . 10.0 115.668 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -54.57 -21.11 9.35 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-O 117.329 -1.319 . . . . 10.0 112.872 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 25.2 mt -90.55 161.32 15.52 Favored 'General case' 0 CA--C 1.503 -0.861 0 CA-C-O 123.204 1.478 . . . . 10.0 114.841 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.1 mttp -154.29 109.79 2.43 Favored Pre-proline 0 N--CA 1.472 0.646 0 N-CA-C 104.408 -2.441 . . . . 10.0 104.408 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -81.29 136.92 10.29 Favored 'Trans proline' 0 CA--C 1.535 0.568 0 C-N-CA 123.044 2.496 . . . . 10.0 116.802 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -91.01 121.79 33.12 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 118.019 -1.472 . . . . 10.0 107.701 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.1 ttpt -84.44 158.78 20.95 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-O 118.654 -0.689 . . . . 10.0 110.399 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -153.87 125.2 7.47 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 105.586 -2.005 . . . . 10.0 105.586 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.409 ' CD1' ' CH2' ' A' ' 8' ' ' TRP . 7.9 mt -103.88 143.52 15.6 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.013 0 CA-C-N 120.076 1.307 . . . . 10.0 114.099 -179.761 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 35.7 t -136.97 138.16 46.17 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 N-CA-C 104.672 -2.344 . . . . 10.0 104.672 179.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -152.85 117.3 4.97 Favored 'General case' 0 C--N 1.312 -1.052 0 C-N-CA 124.784 1.234 . . . . 10.0 110.13 -179.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.58 -41.56 26.89 Favored 'General case' 0 C--N 1.321 -0.661 0 O-C-N 119.691 -1.881 . . . . 10.0 108.199 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -174.66 -92.11 0.08 OUTLIER Glycine 0 C--O 1.24 0.522 0 N-CA-C 106.76 -2.536 . . . . 10.0 106.76 -179.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -98.33 17.95 17.56 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 119.299 1.549 . . . . 10.0 109.935 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . 0.401 ' CE1' ' CG1' ' A' ' 50' ' ' ILE . 0.7 OUTLIER -129.15 121.73 28.34 Favored 'General case' 0 C--O 1.214 -0.766 0 N-CA-C 105.439 -2.06 . . . . 10.0 105.439 179.721 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 7.2 ttp -121.03 133.44 55.25 Favored 'General case' 0 N--CA 1.443 -0.8 0 O-C-N 126.033 2.083 . . . . 10.0 112.759 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.401 ' CG1' ' CE1' ' A' ' 48' ' ' HIS . 19.3 mt -116.3 120.41 64.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 107.661 -1.237 . . . . 10.0 107.661 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -98.28 109.49 23.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 104.75 -2.315 . . . . 10.0 104.75 179.726 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 4.2 mtt180 -106.54 128.95 54.52 Favored 'General case' 0 N--CA 1.434 -1.265 0 C-N-CA 123.397 0.679 . . . . 10.0 112.112 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -125.39 137.91 54.02 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 100.563 -3.865 . . . . 10.0 100.563 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.3 mp -125.92 92.64 3.63 Favored 'General case' 0 N--CA 1.449 -0.482 1 N-CA-C 123.409 4.596 . . . . 10.0 123.409 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 3.4 p -123.19 144.02 49.64 Favored 'General case' 0 C--N 1.315 -0.931 0 O-C-N 125.958 2.036 . . . . 10.0 105.531 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -69.35 -16.48 63.54 Favored 'General case' 0 C--O 1.22 -0.48 0 CA-C-O 123.209 1.48 . . . . 10.0 107.571 179.742 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -93.36 108.79 20.38 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 107.255 -1.387 . . . . 10.0 107.255 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 15.4 tpp180 36.64 91.87 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 O-C-N 126.074 2.109 . . . . 10.0 114.742 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -48.79 122.12 5.35 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-O 123.64 1.686 . . . . 10.0 110.631 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -102.01 78.13 1.76 Allowed 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 112.87 -1.968 . . . . 10.0 107.959 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 1.4 mm -106.77 133.5 51.15 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 C-N-CA 120.424 -0.51 . . . . 10.0 109.993 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -129.99 151.46 50.52 Favored 'General case' 0 C--N 1.317 -0.834 0 C-N-CA 125.742 1.617 . . . . 10.0 108.378 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -127.33 152.81 46.97 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 101.363 -3.569 . . . . 10.0 101.363 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 4.9 m-30 -146.39 167.89 22.49 Favored 'General case' 0 C--O 1.246 0.911 0 N-CA-C 116.062 1.875 . . . . 10.0 116.062 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 40.2 mm-40 -137.01 117.14 13.39 Favored 'General case' 0 N--CA 1.437 -1.118 0 N-CA-C 104.412 -2.44 . . . . 10.0 104.412 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 47.1 t -73.73 132.25 33.68 Favored 'Isoleucine or valine' 0 C--O 1.241 0.639 0 CA-C-N 115.133 -0.939 . . . . 10.0 112.021 -179.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 77.86 -10.42 25.74 Favored Glycine 0 N--CA 1.437 -1.263 0 C-N-CA 125.299 1.428 . . . . 10.0 116.032 -179.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.6 tmtt? -113.25 126.48 55.45 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 114.514 -0.843 . . . . 10.0 112.218 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -41.82 141.15 0.87 Allowed 'General case' 0 C--N 1.32 -0.681 0 O-C-N 127.604 3.065 . . . . 10.0 112.789 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -124.15 151.34 44.1 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 113.912 -1.494 . . . . 10.0 113.248 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -126.49 151.81 47.31 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 105.994 -1.854 . . . . 10.0 105.994 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -143.32 145.5 32.75 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 117.201 2.297 . . . . 10.0 117.201 -179.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -129.81 124.05 32.4 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 121.487 0.661 . . . . 10.0 109.372 -179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 80.5 mt -121.52 139.86 52.95 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 123.906 0.882 . . . . 10.0 111.751 -179.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.91 4.46 4.16 Favored 'General case' 0 N--CA 1.443 -0.8 0 O-C-N 120.649 -1.282 . . . . 10.0 109.631 -179.762 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -121.48 -21.23 3.07 Favored Glycine 0 CA--C 1.53 0.986 0 CA-C-O 117.892 -1.504 . . . . 10.0 110.858 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.44 ' N ' ' CD1' ' A' ' 77' ' ' ILE . 0.0 OUTLIER -124.43 120.17 58.37 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.687 0 CA-C-O 116.4 -1.762 . . . . 10.0 108.011 -179.868 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 3.4 p30 28.5 34.34 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.86 0 O-C-N 126.646 2.466 . . . . 10.0 114.027 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -4.56 81.13 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 127.68 2.392 . . . . 10.0 116.367 -179.592 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.9 158.23 44.91 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 113.095 -1.866 . . . . 10.0 110.265 -179.688 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -120.18 137.59 54.09 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 103.815 -2.661 . . . . 10.0 103.815 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 7.2 p -140.57 166.71 24.0 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.408 -1.269 . . . . 10.0 109.656 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -110.38 116.42 31.4 Favored 'General case' 0 N--CA 1.439 -0.995 1 N-CA-C 99.047 -4.427 . . . . 10.0 99.047 179.878 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 31.9 m -117.49 138.28 51.98 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 123.266 1.508 . . . . 10.0 114.329 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 20.7 m -127.51 123.49 36.01 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 106.238 -1.764 . . . . 10.0 106.238 -179.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 2.6 m -104.63 123.36 58.55 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.661 0 N-CA-C 102.647 -3.094 . . . . 10.0 102.647 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -137.97 178.37 7.17 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 122.724 1.25 . . . . 10.0 110.603 -179.834 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 4.0 p-90 -123.45 109.33 13.71 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 104.288 -2.486 . . . . 10.0 104.288 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -72.55 -55.09 7.47 Favored 'General case' 0 C--N 1.314 -0.974 1 N-CA-C 99.014 -4.439 . . . . 10.0 99.014 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -149.13 -117.57 0.89 Allowed Glycine 0 C--O 1.246 0.849 0 N-CA-C 105.505 -3.038 . . . . 10.0 105.505 -179.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -97.99 49.77 1.02 Allowed 'General case' 0 N--CA 1.461 0.115 0 C-N-CA 118.447 -1.301 . . . . 10.0 111.374 179.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.3 mtmm -147.14 -168.95 3.18 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 124.436 1.094 . . . . 10.0 109.181 -179.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -142.58 151.3 41.4 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 105.819 -1.919 . . . . 10.0 105.819 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 17.5 mt-30 -147.23 150.2 34.39 Favored 'General case' 0 C--O 1.215 -0.743 0 C-N-CA 124.595 1.158 . . . . 10.0 112.256 179.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -138.85 127.95 23.97 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-N 114.517 -1.22 . . . . 10.0 112.882 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 9.1 p -110.11 97.66 6.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 C-N-CA 123.992 0.917 . . . . 10.0 108.955 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -73.89 81.99 1.67 Allowed 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 105.675 -1.972 . . . . 10.0 105.675 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -71.64 97.45 1.73 Allowed 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 114.3 1.222 . . . . 10.0 114.3 -179.601 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -162.16 -155.26 7.89 Favored Glycine 0 C--N 1.315 -0.604 0 O-C-N 126.104 2.128 . . . . 10.0 110.621 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -64.96 -171.68 0.07 Allowed 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 120.639 0.256 . . . . 10.0 111.657 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 15.2 mmtm 74.97 162.49 0.25 Allowed 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 114.774 1.398 . . . . 10.0 114.774 -179.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -93.41 -32.84 14.08 Favored 'General case' 0 C--O 1.213 -0.824 0 CA-C-O 122.95 1.357 . . . . 10.0 112.446 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -130.78 80.86 0.34 Allowed Glycine 0 C--O 1.221 -0.719 0 C-N-CA 125.391 1.472 . . . . 10.0 115.392 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.49 126.11 46.13 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-O 123.571 1.653 . . . . 10.0 108.681 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 145.0 154.97 6.29 Favored Glycine 0 C--N 1.336 0.528 0 CA-C-O 117.834 -1.537 . . . . 10.0 109.709 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' TRP . . . . . 0.503 ' CD1' ' HG2' ' A' ' 119' ' ' MET . 2.9 m0 -115.81 161.19 19.11 Favored 'General case' 0 C--N 1.314 -0.968 0 O-C-N 127.118 2.305 . . . . 10.0 108.952 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 51.1 m -133.54 130.5 38.54 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 104.974 -2.232 . . . . 10.0 104.974 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -118.09 162.48 18.13 Favored 'General case' 0 C--N 1.318 -0.784 0 O-C-N 127.257 2.848 . . . . 10.0 111.6 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' TRP . . . . . 0.46 ' CD1' ' C ' ' A' ' 109' ' ' TRP . 0.0 OUTLIER 176.99 157.53 0.31 Allowed 'General case' 0 CA--C 1.5 -0.947 0 CA-C-N 114.354 -1.294 . . . . 10.0 107.613 -179.995 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 66.8 mt -121.62 130.88 74.21 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 CA-C-N 115.857 -0.61 . . . . 10.0 111.429 -179.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -111.12 58.99 0.61 Allowed 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 124.136 1.922 . . . . 10.0 107.93 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 77.22 -94.45 1.13 Allowed Glycine 0 CA--C 1.504 -0.634 0 O-C-N 120.478 -1.389 . . . . 10.0 110.739 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -102.93 4.75 37.89 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 114.271 1.211 . . . . 10.0 114.271 -179.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -142.45 139.83 31.73 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 124.013 1.863 . . . . 10.0 115.041 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.515 HD23 ' CZ2' ' A' ' 8' ' ' TRP . 4.3 mm? -83.32 144.51 29.64 Favored 'General case' 0 N--CA 1.441 -0.905 0 CA-C-N 112.718 -2.037 . . . . 10.0 109.684 -179.751 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 8.4 m-70 -131.67 67.66 1.51 Allowed 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 113.319 -1.764 . . . . 10.0 107.375 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.93 154.07 20.8 Favored 'General case' 0 C--N 1.317 -0.82 0 O-C-N 125.06 1.475 . . . . 10.0 113.441 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -135.99 135.63 39.67 Favored 'General case' 0 CA--C 1.502 -0.896 0 N-CA-C 107.352 -1.351 . . . . 10.0 107.352 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.503 ' HG2' ' CD1' ' A' ' 106' ' ' TRP . 3.6 mtt -125.61 123.11 38.3 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-O 123.391 1.567 . . . . 10.0 111.784 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.09 158.29 23.4 Favored 'General case' 0 N--CA 1.443 -0.791 0 O-C-N 119.958 -1.714 . . . . 10.0 112.834 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -169.34 103.69 0.36 Allowed 'General case' 0 CA--C 1.515 -0.368 0 O-C-N 120.935 -1.103 . . . . 10.0 108.382 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 73.47 13.21 4.57 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.397 1.879 . . . . 10.0 116.029 -179.855 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 107.81 13.75 19.27 Favored Glycine 0 CA--C 1.535 1.301 0 CA-C-O 116.144 -2.476 . . . . 10.0 116.326 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 2.7 m -112.91 93.97 2.85 Favored 'Isoleucine or valine' 0 C--O 1.242 0.679 0 CA-C-N 119.869 1.834 . . . . 10.0 113.554 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -78.91 109.94 13.66 Favored 'General case' 0 C--N 1.317 -0.811 0 O-C-N 125.852 1.97 . . . . 10.0 113.809 -179.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -106.57 151.52 24.91 Favored 'General case' 0 N--CA 1.463 0.202 0 N-CA-C 105.02 -2.215 . . . . 10.0 105.02 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 9.0 mtpp -132.84 150.44 52.16 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 119.111 -1.035 . . . . 10.0 111.949 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -138.61 106.66 5.71 Favored 'General case' 0 C--N 1.316 -0.876 0 O-C-N 121.759 -0.588 . . . . 10.0 110.9 -179.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 1.1 t -89.64 127.54 42.21 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 C-N-CA 118.611 -1.236 . . . . 10.0 109.126 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -108.38 167.06 10.3 Favored 'General case' 0 N--CA 1.445 -0.716 0 C-N-CA 125.309 1.443 . . . . 10.0 110.199 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -127.23 107.56 10.11 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 106.785 -1.561 . . . . 10.0 106.785 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . 0.484 ' HG3' ' CD1' ' A' ' 8' ' ' TRP . 21.3 tttt -56.26 109.88 0.67 Allowed 'General case' 0 C--O 1.221 -0.396 0 CA-C-N 119.726 1.148 . . . . 10.0 108.155 179.811 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 16.1 m -103.42 50.58 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.506 -0.724 0 C-N-CA 124.964 1.306 . . . . 10.0 110.94 179.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 2.1 t60 . . . . . 0 C--N 1.315 -0.922 0 O-C-N 121.569 -0.707 . . . . 10.0 109.767 179.96 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 . . . . . 0 CA--C 1.536 0.441 0 CA-C-O 116.54 -1.695 . . . . 10.0 112.972 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.481 ' CD1' HD13 ' A' ' 110' ' ' ILE . 0.7 OUTLIER -20.52 -52.49 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.779 0 O-C-N 126.313 2.258 . . . . 10.0 116.606 179.681 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -53.12 110.56 0.55 Allowed 'General case' 0 N--CA 1.484 1.25 0 O-C-N 125.2 1.562 . . . . 10.0 112.404 179.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -152.75 171.08 31.87 Favored Glycine 0 N--CA 1.464 0.503 0 C-N-CA 118.507 -1.806 . . . . 10.0 115.748 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -92.65 87.45 5.91 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 101.355 -3.572 . . . . 10.0 101.355 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.507 ' HB3' ' CD1' ' A' ' 130' ' ' PHE . 38.7 m0 -89.55 112.63 23.88 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 123.282 1.515 . . . . 10.0 114.24 179.816 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 18.8 pttp -98.05 138.62 35.08 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 103.908 -2.627 . . . . 10.0 103.908 179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.4 ' HE2' ' HD2' ' A' ' 38' ' ' PRO . 0.0 OUTLIER -89.27 150.23 22.71 Favored 'General case' 0 C--N 1.313 -0.981 0 N-CA-C 114.115 1.154 . . . . 10.0 114.115 -179.941 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.2 tt -113.34 -55.15 2.55 Favored 'General case' 0 C--O 1.242 0.696 0 CA-C-O 118.293 -0.86 . . . . 10.0 109.666 -179.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.4 p -167.99 133.09 1.83 Allowed 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 116.33 1.974 . . . . 10.0 116.33 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -90.4 165.89 13.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 111.173 -2.74 . . . . 10.0 105.715 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -124.13 -57.26 1.61 Allowed 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 120.549 1.522 . . . . 10.0 111.293 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -112.4 51.07 0.83 Allowed 'General case' 0 C--N 1.328 -0.342 0 O-C-N 126.592 2.432 . . . . 10.0 113.148 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 6.4 t80 -76.3 -28.57 57.04 Favored 'General case' 0 CA--C 1.546 0.799 0 O-C-N 118.889 -2.382 . . . . 10.0 110.133 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -79.26 -42.4 25.96 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 125.799 1.937 . . . . 10.0 112.0 179.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -74.79 -20.56 59.74 Favored 'General case' 0 C--O 1.22 -0.478 0 O-C-N 121.418 -0.801 . . . . 10.0 108.85 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 14.2 t80 -67.1 -39.86 86.81 Favored 'General case' 0 CA--C 1.548 0.88 0 CA-C-O 122.583 1.183 . . . . 10.0 110.074 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 34.9 mt -75.33 -40.33 58.49 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 122.385 1.088 . . . . 10.0 109.643 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.4 ttm180 -68.41 -27.2 65.99 Favored 'General case' 0 C--O 1.241 0.657 0 C-N-CA 125.415 1.486 . . . . 10.0 109.231 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.56 -26.36 59.9 Favored 'General case' 0 C--O 1.221 -0.432 0 O-C-N 124.664 1.228 . . . . 10.0 109.239 -179.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 79.0 mt -99.12 -15.26 19.05 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 124.756 1.223 . . . . 10.0 109.514 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 61.67 61.74 1.4 Allowed 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 116.424 2.009 . . . . 10.0 116.424 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -88.33 -150.11 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.245 0.838 0 N-CA-C 104.892 -2.262 . . . . 10.0 104.892 -179.7 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.551 ' ND2' ' N ' ' A' ' 26' ' ' ASN . 0.0 OUTLIER -96.27 162.37 13.54 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 120.639 1.563 . . . . 10.0 113.786 -179.908 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.9 t -70.36 -39.33 76.41 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 O-C-N 125.735 1.897 . . . . 10.0 114.261 -179.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -71.56 -29.99 65.36 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 113.473 0.916 . . . . 10.0 113.473 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.74 -29.25 58.8 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 124.903 1.281 . . . . 10.0 111.455 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.05 -33.42 67.95 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 113.252 0.834 . . . . 10.0 113.252 179.726 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -72.21 -41.42 66.95 Favored 'General case' 0 N--CA 1.451 -0.423 0 O-C-N 125.813 1.946 . . . . 10.0 109.387 -179.402 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.517 HG21 ' CZ ' ' A' ' 57' ' ' PHE . 46.5 mm -73.58 -60.03 2.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 O-C-N 120.879 -1.138 . . . . 10.0 108.175 -179.556 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -46.32 -26.77 0.88 Allowed 'General case' 0 C--N 1.318 -0.771 0 O-C-N 125.026 1.454 . . . . 10.0 114.79 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -81.96 -16.98 48.6 Favored 'General case' 0 C--N 1.327 -0.37 0 O-C-N 124.448 1.092 . . . . 10.0 111.061 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -87.6 -15.83 36.24 Favored 'General case' 0 N--CA 1.441 -0.877 0 O-C-N 121.064 -1.023 . . . . 10.0 110.744 -179.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.67 172.97 8.41 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.518 -0.919 . . . . 10.0 108.518 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.5 ptpt -152.37 135.52 9.43 Favored Pre-proline 0 N--CA 1.474 0.77 0 N-CA-C 106.292 -1.744 . . . . 10.0 106.292 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.4 ' HD2' ' HE2' ' A' ' 10' ' ' MET . 50.6 Cg_endo -74.29 107.28 2.41 Favored 'Trans proline' 0 N--CA 1.448 -1.151 1 C-N-CA 126.532 4.822 . . . . 10.0 119.064 -179.758 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -82.38 149.02 27.92 Favored 'General case' 0 C--O 1.239 0.526 0 N-CA-C 105.778 -1.934 . . . . 10.0 105.778 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 28.6 mttp -121.36 155.91 33.76 Favored 'General case' 0 C--O 1.214 -0.811 0 O-C-N 120.48 -1.388 . . . . 10.0 109.671 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -143.37 105.01 4.32 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 102.907 -2.997 . . . . 10.0 102.907 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.3 mt -100.41 149.29 6.13 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.921 0 C-N-CA 117.679 -1.608 . . . . 10.0 111.525 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 45.4 t -138.34 145.42 28.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 113.594 -1.639 . . . . 10.0 107.694 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -139.01 128.08 23.83 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 113.538 -1.664 . . . . 10.0 112.005 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -103.55 -49.8 3.6 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 104.202 -2.518 . . . . 10.0 104.202 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -164.18 -113.15 0.28 Allowed Glycine 0 C--O 1.246 0.893 0 N-CA-C 106.466 -2.653 . . . . 10.0 106.466 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -75.17 -20.22 59.45 Favored 'General case' 0 C--O 1.215 -0.722 0 O-C-N 120.317 -1.696 . . . . 10.0 110.816 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.4 m170 -91.7 130.78 37.43 Favored 'General case' 0 N--CA 1.439 -0.982 0 CA-C-N 114.99 -1.005 . . . . 10.0 110.017 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.455 ' HG2' ' CD1' ' A' ' 51' ' ' ILE . 2.5 ttp -121.42 149.54 42.86 Favored 'General case' 0 N--CA 1.435 -1.181 0 O-C-N 125.761 1.913 . . . . 10.0 111.568 -179.659 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 19.9 mt -130.16 123.64 56.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 105.835 -1.913 . . . . 10.0 105.835 -179.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.455 ' CD1' ' HG2' ' A' ' 49' ' ' MET . 1.6 mp -110.05 128.18 66.4 Favored 'Isoleucine or valine' 0 C--O 1.24 0.578 0 N-CA-C 106.07 -1.826 . . . . 10.0 106.07 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.6 mmm180 -116.32 106.56 13.79 Favored 'General case' 0 N--CA 1.435 -1.221 0 CA-C-O 118.533 -0.746 . . . . 10.0 110.59 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 65.3 m -91.52 129.87 37.43 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 102.126 -3.287 . . . . 10.0 102.126 -179.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 6.0 mp -127.37 86.5 2.5 Favored 'General case' 0 N--CA 1.441 -0.881 0 N-CA-C 119.353 3.094 . . . . 10.0 119.353 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 7.1 m -108.42 132.67 53.53 Favored 'General case' 0 N--CA 1.443 -0.782 0 C-N-CA 125.491 1.517 . . . . 10.0 107.504 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.7 p -56.83 -24.73 53.2 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-O 123.021 1.391 . . . . 10.0 107.753 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.517 ' CZ ' HG21 ' A' ' 32' ' ' ILE . 1.2 t80 -87.0 -135.07 0.08 Allowed 'General case' 0 C--O 1.239 0.545 0 N-CA-C 106.782 -1.562 . . . . 10.0 106.782 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.69 140.21 44.02 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 118.868 -1.133 . . . . 10.0 113.723 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -138.14 144.06 40.62 Favored 'General case' 0 N--CA 1.466 0.367 0 O-C-N 125.851 1.97 . . . . 10.0 111.714 179.719 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 1.5 p90 -129.34 134.57 47.97 Favored 'General case' 0 C--O 1.217 -0.643 0 N-CA-C 105.449 -2.056 . . . . 10.0 105.449 -179.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 1.4 mp -97.28 119.5 45.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 124.327 2.013 . . . . 10.0 109.286 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -118.39 144.4 45.95 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-N 112.497 -2.138 . . . . 10.0 106.654 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -132.11 114.3 14.35 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 100.467 -3.901 . . . . 10.0 100.467 -179.834 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -102.55 177.38 4.88 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 117.429 2.381 . . . . 10.0 117.429 -179.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 15.9 mm-40 -144.1 105.58 4.27 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 103.095 -2.928 . . . . 10.0 103.095 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 47.8 t -62.81 119.43 6.78 Favored 'Isoleucine or valine' 0 C--O 1.243 0.744 0 CA-C-O 122.738 1.256 . . . . 10.0 113.106 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.12 37.28 63.89 Favored Glycine 0 CA--C 1.533 1.188 0 N-CA-C 117.117 1.607 . . . . 10.0 117.117 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.21 13.84 3.54 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 119.426 -0.91 . . . . 10.0 112.473 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 65.85 150.61 0.05 OUTLIER 'General case' 0 C--N 1.32 -0.706 0 O-C-N 125.656 1.847 . . . . 10.0 112.338 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -149.63 114.92 5.48 Favored 'General case' 0 C--O 1.243 0.714 0 CA-C-O 121.18 0.514 . . . . 10.0 111.665 179.76 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -87.07 89.93 8.18 Favored 'General case' 0 C--O 1.217 -0.612 0 N-CA-C 107.688 -1.227 . . . . 10.0 107.688 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -68.52 170.65 8.71 Favored 'General case' 0 C--N 1.319 -0.723 0 O-C-N 126.328 2.267 . . . . 10.0 115.625 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -150.02 62.66 0.98 Allowed 'General case' 0 N--CA 1.441 -0.91 0 N-CA-C 106.475 -1.676 . . . . 10.0 106.475 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.404 HD12 HG21 ' A' ' 77' ' ' ILE . 3.5 mm? -50.0 145.91 5.24 Favored 'General case' 0 N--CA 1.438 -1.034 0 N-CA-C 113.267 0.84 . . . . 10.0 113.267 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 62.2 m -156.1 92.67 1.36 Allowed 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.368 -0.833 . . . . 10.0 109.08 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 144.54 -43.85 0.94 Allowed Glycine 0 N--CA 1.434 -1.47 0 CA-C-O 117.072 -1.96 . . . . 10.0 112.097 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.404 HG21 HD12 ' A' ' 74' ' ' LEU . 0.3 OUTLIER -99.59 66.74 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.467 0 CA-C-N 118.961 1.38 . . . . 10.0 108.66 179.976 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 9.0 t70 83.24 -11.0 0.96 Allowed 'General case' 0 N--CA 1.443 -0.798 0 O-C-N 125.523 1.764 . . . . 10.0 109.744 -179.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 50.45 100.26 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 116.593 2.072 . . . . 10.0 116.593 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.42 124.11 4.01 Favored 'General case' 0 C--N 1.317 -0.818 0 O-C-N 120.688 -1.258 . . . . 10.0 112.178 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 10.3 mttt -63.05 149.21 45.62 Favored 'General case' 0 C--O 1.221 -0.447 0 N-CA-C 105.87 -1.9 . . . . 10.0 105.87 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 1.6 p -158.28 171.06 20.88 Favored 'General case' 0 C--O 1.215 -0.741 0 N-CA-C 105.652 -1.981 . . . . 10.0 105.652 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 30.1 mtp -120.56 96.38 5.11 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 102.664 -3.087 . . . . 10.0 102.664 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 27.7 m -107.24 117.52 34.28 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 116.977 2.214 . . . . 10.0 116.977 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 51.6 m -109.09 118.44 36.78 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 106.004 -1.85 . . . . 10.0 106.004 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 53.4 t -99.77 139.09 22.16 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 N-CA-C 105.714 -1.958 . . . . 10.0 105.714 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -154.41 -174.0 4.8 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 113.867 -1.515 . . . . 10.0 113.188 179.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 64.4 p-90 -133.93 130.48 37.79 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 121.787 0.804 . . . . 10.0 108.835 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 14.8 t0 -149.31 119.35 7.18 Favored 'General case' 0 C--O 1.242 0.666 0 N-CA-C 103.444 -2.798 . . . . 10.0 103.444 179.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 88.08 13.27 64.44 Favored Glycine 0 CA--C 1.503 -0.702 0 N-CA-C 106.979 -2.449 . . . . 10.0 106.979 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 20.9 t0 72.11 5.39 5.3 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 119.269 1.535 . . . . 10.0 111.859 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.44 168.85 9.48 Favored 'General case' 0 CA--C 1.504 -0.79 0 N-CA-C 106.499 -1.667 . . . . 10.0 106.499 179.782 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -112.96 92.22 3.93 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 123.808 1.766 . . . . 10.0 106.425 179.586 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -104.45 155.87 18.42 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 114.72 -1.127 . . . . 10.0 110.446 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -145.3 170.59 16.01 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 117.601 -1.64 . . . . 10.0 108.461 -179.835 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 81.3 t -145.94 128.07 8.63 Favored 'Isoleucine or valine' 0 C--O 1.241 0.639 0 O-C-N 125.291 1.619 . . . . 10.0 107.574 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -110.89 118.94 37.47 Favored 'General case' 0 C--N 1.32 -0.695 0 O-C-N 125.041 1.463 . . . . 10.0 109.136 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 2.7 mmmt -96.17 80.58 3.26 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 122.655 1.217 . . . . 10.0 110.373 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -143.27 74.96 0.32 Allowed Glycine 0 C--N 1.338 0.652 0 CA-C-N 114.101 -1.409 . . . . 10.0 110.481 179.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 58.72 -176.12 0.08 Allowed 'General case' 0 C--O 1.234 0.241 0 N-CA-C 116.125 1.898 . . . . 10.0 116.125 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 24.9 mmtt 60.81 175.58 0.1 Allowed 'General case' 0 CA--C 1.544 0.747 0 O-C-N 125.244 1.59 . . . . 10.0 114.822 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 75.2 mt-10 -123.68 88.3 2.89 Favored 'General case' 0 C--O 1.232 0.134 0 O-C-N 125.568 1.792 . . . . 10.0 113.512 179.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 142.46 -23.39 2.36 Favored Glycine 0 C--O 1.217 -0.953 0 CA-C-O 118.258 -1.301 . . . . 10.0 116.263 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 7.0 mtp180 -47.94 130.89 15.45 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.869 0.982 . . . . 10.0 112.347 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 142.99 148.96 5.03 Favored Glycine 0 N--CA 1.439 -1.111 0 O-C-N 125.874 1.984 . . . . 10.0 109.952 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' TRP . . . . . 0.498 ' CE2' ' HE1' ' A' ' 119' ' ' MET . 2.6 m0 -112.26 171.54 7.45 Favored 'General case' 0 N--CA 1.455 -0.22 0 O-C-N 121.789 -0.83 . . . . 10.0 109.727 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 4.0 m -153.54 88.98 1.3 Allowed 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 104.106 -2.553 . . . . 10.0 104.106 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 -79.76 98.23 6.94 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 125.156 1.535 . . . . 10.0 112.9 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -105.15 130.71 53.26 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 107.218 -1.401 . . . . 10.0 107.218 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.481 HD13 ' CD1' ' A' ' 4' ' ' PHE . 15.6 mt -93.18 119.64 41.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 116.679 2.103 . . . . 10.0 116.679 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -101.5 71.85 1.37 Allowed 'General case' 0 C--O 1.223 -0.303 0 CA-C-O 123.337 1.541 . . . . 10.0 108.243 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 59.52 -103.6 0.44 Allowed Glycine 0 C--N 1.341 0.826 0 N-CA-C 109.419 -1.473 . . . . 10.0 109.419 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 17.9 p-10 -87.12 16.79 4.74 Favored 'General case' 0 N--CA 1.476 0.842 0 O-C-N 121.392 -1.063 . . . . 10.0 112.54 179.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 13.4 mt-10 -138.92 158.33 44.4 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 125.166 2.412 . . . . 10.0 110.304 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.449 HD13 ' CH2' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -118.75 121.1 39.3 Favored 'General case' 0 C--O 1.24 0.582 0 N-CA-C 105.629 -1.989 . . . . 10.0 105.629 -179.931 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 48.0 t-80 -115.18 68.03 0.7 Allowed 'General case' 0 N--CA 1.444 -0.739 0 CA-C-O 123.327 1.537 . . . . 10.0 110.828 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 9.0 tt -69.48 126.28 29.27 Favored 'General case' 0 N--CA 1.441 -0.889 0 CA-C-N 113.206 -1.815 . . . . 10.0 108.796 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -128.38 98.19 4.98 Favored 'General case' 0 CA--C 1.498 -1.047 0 CA-C-O 124.31 2.005 . . . . 10.0 107.494 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.498 ' HE1' ' CE2' ' A' ' 106' ' ' TRP . 3.1 ptp -95.09 133.64 38.68 Favored 'General case' 0 CA--C 1.515 -0.396 0 O-C-N 120.663 -1.273 . . . . 10.0 112.346 -179.904 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.97 169.1 9.25 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 117.613 -1.184 . . . . 10.0 112.388 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -177.58 116.6 0.09 Allowed 'General case' 0 C--O 1.237 0.433 0 O-C-N 125.43 1.706 . . . . 10.0 106.604 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 67.91 31.56 5.61 Favored 'General case' 0 C--O 1.245 0.865 0 CA-C-O 123.354 1.55 . . . . 10.0 114.344 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 78.83 -3.81 63.3 Favored Glycine 0 CA--C 1.526 0.747 0 O-C-N 120.049 -1.657 . . . . 10.0 113.178 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 49.1 t -95.85 121.68 46.63 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 N-CA-C 105.924 -1.88 . . . . 10.0 105.924 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 4.9 m -104.4 117.47 34.26 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-O 122.407 1.099 . . . . 10.0 112.164 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 4.2 t -103.4 128.03 50.62 Favored 'General case' 0 C--O 1.214 -0.777 0 C-N-CA 126.039 1.736 . . . . 10.0 107.538 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.42 155.08 47.94 Favored 'General case' 0 C--O 1.218 -0.572 0 C-N-CA 119.098 -1.041 . . . . 10.0 111.457 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -136.22 135.54 39.16 Favored 'General case' 0 N--CA 1.439 -1.02 0 N-CA-C 113.146 0.795 . . . . 10.0 113.146 179.869 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -86.23 103.19 12.58 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 CA-C-N 114.2 -1.364 . . . . 10.0 107.676 179.601 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . 0.507 ' CD1' ' HB3' ' A' ' 8' ' ' TRP . 0.7 OUTLIER -93.52 165.58 12.68 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 118.109 -0.948 . . . . 10.0 109.096 -179.86 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 13.5 tptp -133.02 134.87 45.0 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 125.94 2.025 . . . . 10.0 108.543 179.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 15.4 tptm -88.49 131.46 34.89 Favored 'General case' 0 CA--C 1.512 -0.493 0 CA-C-N 114.603 -1.181 . . . . 10.0 109.487 -179.677 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 28.3 t -109.8 -48.42 6.94 Favored 'Isoleucine or valine' 0 C--O 1.243 0.75 0 O-C-N 125.876 1.985 . . . . 10.0 109.075 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 6.2 t-80 . . . . . 0 N--CA 1.438 -1.05 0 CA-C-N 112.84 -1.982 . . . . 10.0 114.17 -179.806 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.467 0.383 0 CA-C-O 123.512 1.625 . . . . 10.0 109.983 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 63.21 -43.32 0.21 Allowed 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 117.11 2.263 . . . . 10.0 117.11 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 42.7 t-20 -40.25 106.39 0.05 Allowed 'General case' 0 C--N 1.319 -0.744 0 C-N-CA 125.455 1.502 . . . . 10.0 114.916 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -165.45 -127.17 0.87 Allowed Glycine 0 N--CA 1.468 0.796 0 N-CA-C 116.61 1.404 . . . . 10.0 116.61 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -167.15 122.98 1.11 Allowed 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 102.664 -3.087 . . . . 10.0 102.664 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.418 ' HB3' ' CD1' ' A' ' 130' ' ' PHE . 40.9 m0 -106.77 107.69 18.83 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 117.75 -1.119 . . . . 10.0 109.345 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 20.0 pttt -97.4 108.34 21.05 Favored 'General case' 0 C--O 1.216 -0.683 0 N-CA-C 105.589 -2.004 . . . . 10.0 105.589 179.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.17 166.84 0.09 Allowed 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 115.602 1.704 . . . . 10.0 115.602 -179.868 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.3 tt -126.12 -63.88 1.08 Allowed 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 105.18 -2.156 . . . . 10.0 105.18 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 77.4 p -144.64 155.89 43.84 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 124.654 1.182 . . . . 10.0 113.891 179.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -129.35 155.7 45.21 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 125.392 1.682 . . . . 10.0 106.647 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.8 pm0 -144.81 146.88 32.31 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 116.821 2.156 . . . . 10.0 116.821 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.1 m120 54.85 16.47 1.45 Allowed 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 114.571 1.323 . . . . 10.0 114.571 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -59.17 -36.79 75.92 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 116.015 1.858 . . . . 10.0 116.015 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.38 -34.77 61.14 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-N 119.419 1.009 . . . . 10.0 111.62 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -73.55 -27.39 61.31 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 107.846 -1.168 . . . . 10.0 107.846 179.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -65.15 -42.52 93.72 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 124.994 1.317 . . . . 10.0 111.024 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.449 HD13 ' CB ' ' A' ' 33' ' ' ALA . 24.4 mt -75.11 -25.52 58.56 Favored 'General case' 0 N--CA 1.478 0.946 0 O-C-N 121.797 -0.564 . . . . 10.0 109.576 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 57.1 ttt180 -67.79 -27.66 66.93 Favored 'General case' 0 C--O 1.242 0.708 0 C-N-CA 124.582 1.153 . . . . 10.0 110.735 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.51 -42.33 71.43 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.08 1.352 . . . . 10.0 110.096 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 32.6 mt -76.99 -13.47 59.96 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 122.312 1.053 . . . . 10.0 109.741 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 29.7 m-20 45.46 39.67 4.86 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.575 1.15 . . . . 10.0 111.483 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.448 ' CG2' ' HA ' ' A' ' 78' ' ' ASP . 1.2 t -57.15 -63.54 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 O-C-N 127.428 2.955 . . . . 10.0 104.692 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -167.75 161.35 13.25 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.303 0.853 . . . . 10.0 113.303 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 2.9 t -78.51 -33.14 16.85 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 N-CA-C 114.633 1.345 . . . . 10.0 114.633 -179.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -74.67 -32.34 62.19 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.003 -0.999 . . . . 10.0 112.634 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.5 tp -78.84 -21.47 47.57 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 122.021 0.915 . . . . 10.0 113.306 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 15.7 ttm180 -74.46 -31.31 62.19 Favored 'General case' 0 C--O 1.22 -0.491 0 O-C-N 119.605 -1.935 . . . . 10.0 111.311 -179.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.2 tttp -77.95 -39.03 43.95 Favored 'General case' 0 C--O 1.225 -0.19 0 CA-C-N 114.137 -1.392 . . . . 10.0 110.209 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 10.7 mm -75.29 -46.41 38.54 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 CA-C-N 114.278 -1.328 . . . . 10.0 109.913 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.449 ' CB ' HD13 ' A' ' 20' ' ' LEU . . . -67.21 -21.07 65.78 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 115.623 1.712 . . . . 10.0 115.623 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -71.1 -45.69 63.19 Favored 'General case' 0 N--CA 1.443 -0.819 0 N-CA-C 114.886 1.439 . . . . 10.0 114.886 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.3 pp -59.04 -21.84 59.74 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 113.627 0.973 . . . . 10.0 113.627 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -69.23 159.03 33.8 Favored 'General case' 0 C--O 1.217 -0.63 0 O-C-N 124.116 0.885 . . . . 10.0 112.348 -179.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 7.6 mttp -146.28 107.29 4.16 Favored Pre-proline 0 C--N 1.322 -0.593 0 N-CA-C 103.662 -2.718 . . . . 10.0 103.662 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -89.13 104.35 0.39 Allowed 'Trans proline' 0 C--N 1.354 0.868 0 N-CA-C 118.8 2.577 . . . . 10.0 118.8 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -81.28 136.01 35.76 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 103.536 -2.764 . . . . 10.0 103.536 178.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 12.0 mtpp -118.66 142.51 47.59 Favored 'General case' 0 C--N 1.31 -1.141 0 C-N-CA 118.846 -1.142 . . . . 10.0 112.153 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -120.98 116.77 25.72 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 102.706 -3.072 . . . . 10.0 102.706 179.76 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 29.9 mt -110.66 136.26 47.22 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.058 0 CA-C-O 124.653 2.168 . . . . 10.0 111.062 -179.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 83.7 t -131.53 124.35 54.29 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.875 0 N-CA-C 105.095 -2.187 . . . . 10.0 105.095 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 -108.86 165.13 11.79 Favored 'General case' 0 C--O 1.215 -0.733 0 CA-C-N 114.733 -1.121 . . . . 10.0 109.596 179.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -145.4 -146.81 0.2 Allowed 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 104.525 -2.398 . . . . 10.0 104.525 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -84.81 91.85 1.71 Allowed Glycine 0 CA--C 1.527 0.8 0 N-CA-C 105.993 -2.843 . . . . 10.0 105.993 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 62.02 20.34 11.51 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 124.481 0.754 . . . . 10.0 112.311 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 4.9 t-160 -125.75 103.52 7.85 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 105.413 -2.069 . . . . 10.0 105.413 -179.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 2.8 ttp -109.87 107.21 17.07 Favored 'General case' 0 C--O 1.216 -0.686 0 CA-C-N 112.723 -2.035 . . . . 10.0 116.028 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 3.3 mp -88.97 146.8 5.73 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 C-N-CA 125.824 1.65 . . . . 10.0 107.858 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.8 mp -133.87 133.12 56.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 O-C-N 124.582 1.176 . . . . 10.0 108.065 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 21.1 mtt-85 -124.14 127.58 48.0 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-O 117.798 -1.096 . . . . 10.0 113.199 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 12.7 m -114.63 94.85 4.96 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 102.814 -3.032 . . . . 10.0 102.814 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 58.0 mt -82.87 100.06 10.12 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 120.554 3.539 . . . . 10.0 120.554 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 48.9 p -122.82 -139.88 0.31 Allowed 'General case' 0 C--N 1.319 -0.759 0 O-C-N 126.168 2.167 . . . . 10.0 108.028 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -139.1 -38.36 0.5 Allowed 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 119.212 0.915 . . . . 10.0 111.86 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -54.76 -81.16 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 123.048 1.404 . . . . 10.0 110.507 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 3.2 mmp_? -110.47 -25.67 9.92 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 116.767 -1.587 . . . . 10.0 113.847 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 5.2 m120 56.83 85.31 0.08 Allowed 'General case' 0 CA--C 1.537 0.477 0 O-C-N 126.41 2.319 . . . . 10.0 108.352 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -56.16 117.83 4.12 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 107.007 -1.479 . . . . 10.0 107.007 -179.548 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.6 mt -128.1 114.29 34.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 CA-C-N 113.798 -1.546 . . . . 10.0 111.454 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 3.2 mtm -121.27 172.39 8.04 Favored 'General case' 0 C--O 1.214 -0.795 0 N-CA-C 104.716 -2.327 . . . . 10.0 104.716 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -163.23 128.6 3.11 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 104.904 -2.258 . . . . 10.0 104.904 179.553 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 -135.02 178.63 6.88 Favored 'General case' 0 CA--C 1.515 -0.366 0 N-CA-C 114.142 1.164 . . . . 10.0 114.142 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -129.44 100.51 5.58 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 126.868 2.605 . . . . 10.0 105.457 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.1 t -43.95 146.59 0.32 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.594 0 O-C-N 125.879 1.987 . . . . 10.0 110.419 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 56.42 63.74 5.04 Favored Glycine 0 CA--C 1.526 0.78 0 CA-C-N 114.077 -1.42 . . . . 10.0 113.03 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.12 166.57 2.4 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 125.011 2.338 . . . . 10.0 116.22 -179.758 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -87.5 133.96 33.68 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 113.444 -1.707 . . . . 10.0 110.783 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -145.69 112.51 5.99 Favored 'General case' 0 C--N 1.318 -0.777 0 O-C-N 125.301 1.625 . . . . 10.0 114.1 -179.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 17.9 pt-20 -76.6 135.66 39.21 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 105.13 -2.174 . . . . 10.0 105.13 -179.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -99.9 -34.92 9.92 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 122.44 1.114 . . . . 10.0 112.511 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 75.83 -60.48 0.49 Allowed 'General case' 0 C--O 1.221 -0.418 0 CA-C-N 114.235 -1.348 . . . . 10.0 108.614 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 61.77 33.57 17.77 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 116.689 2.107 . . . . 10.0 116.689 179.807 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -59.44 125.2 22.67 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-O 123.144 1.45 . . . . 10.0 109.158 -179.863 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 75.33 133.41 0.36 Allowed Glycine 0 C--O 1.223 -0.554 0 CA-C-O 118.336 -1.258 . . . . 10.0 110.413 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.8 mt 92.02 20.49 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 O-C-N 126.448 1.911 . . . . 10.0 108.711 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.448 ' HA ' ' CG2' ' A' ' 25' ' ' VAL . 18.4 t70 143.32 -33.84 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.74 0 O-C-N 128.659 3.724 . . . . 10.0 114.098 179.826 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 50.48 52.85 14.0 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 124.121 0.968 . . . . 10.0 112.967 -179.648 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.5 -67.65 0.57 Allowed 'General case' 0 N--CA 1.467 0.407 0 O-C-N 119.49 -2.006 . . . . 10.0 114.094 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 88.56 118.74 0.03 OUTLIER 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 102.876 -3.009 . . . . 10.0 102.876 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 4.6 p -147.4 171.25 15.77 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 123.433 1.587 . . . . 10.0 110.246 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.09 71.75 0.87 Allowed 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 100.287 -3.968 . . . . 10.0 100.287 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' THR . . . . . 0.408 HG22 ' N ' ' A' ' 85' ' ' THR . 6.3 m -76.77 139.53 40.43 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 118.315 2.709 . . . . 10.0 118.315 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.408 ' N ' HG22 ' A' ' 84' ' ' THR . 1.9 m -124.97 129.27 50.01 Favored 'General case' 0 C--O 1.244 0.77 0 O-C-N 125.475 1.734 . . . . 10.0 107.421 -179.857 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -101.86 159.19 4.24 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.989 0 N-CA-C 104.773 -2.306 . . . . 10.0 104.773 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.4 t -145.99 167.76 22.54 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 122.75 1.262 . . . . 10.0 110.837 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 11.1 p90 -124.32 122.61 38.18 Favored 'General case' 0 C--O 1.239 0.534 0 CA-C-N 112.815 -1.993 . . . . 10.0 107.177 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -88.97 172.52 9.07 Favored 'General case' 0 C--N 1.312 -1.053 1 N-CA-C 98.593 -4.595 . . . . 10.0 98.593 179.985 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -65.87 -27.78 73.07 Favored Glycine 0 CA--C 1.496 -1.156 0 N-CA-C 108.448 -1.861 . . . . 10.0 108.448 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 44.0 p-10 -145.66 25.88 1.3 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 118.89 1.345 . . . . 10.0 111.897 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 2.1 mtmt -153.03 -157.11 0.76 Allowed 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 108.3 -1.0 . . . . 10.0 108.3 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 4.4 tp -165.27 136.48 3.99 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 106.257 -1.757 . . . . 10.0 106.257 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -132.38 156.72 46.15 Favored 'General case' 0 CA--C 1.508 -0.655 0 N-CA-C 114.623 1.342 . . . . 10.0 114.623 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -133.72 145.25 49.7 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 123.129 1.442 . . . . 10.0 111.439 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 3.8 t -138.52 153.57 26.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 114.132 -1.395 . . . . 10.0 108.908 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -148.5 152.76 37.44 Favored 'General case' 0 C--O 1.246 0.878 0 CA-C-O 122.355 1.074 . . . . 10.0 108.365 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 2.8 mttp -117.62 83.54 2.01 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 114.61 -1.177 . . . . 10.0 110.122 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -152.96 87.07 0.13 Allowed Glycine 0 C--N 1.315 -0.604 0 C-N-CA 119.174 -1.489 . . . . 10.0 110.133 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 42.61 -154.81 0.02 OUTLIER 'General case' 0 C--O 1.246 0.888 0 N-CA-C 116.968 2.21 . . . . 10.0 116.968 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.401 ' N ' ' CD ' ' A' ' 101' ' ' LYS . 0.0 OUTLIER 62.66 166.65 0.12 Allowed 'General case' 0 C--O 1.217 -0.642 0 CA-C-O 124.089 1.899 . . . . 10.0 112.552 179.759 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -100.13 4.9 44.8 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-N 112.646 -2.07 . . . . 10.0 114.451 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 170.48 58.13 0.04 OUTLIER Glycine 0 C--N 1.319 -0.373 0 N-CA-C 120.02 2.768 . . . . 10.0 120.02 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.464 ' H ' ' NE ' ' A' ' 104' ' ' ARG . 0.0 OUTLIER -86.59 161.88 18.28 Favored 'General case' 0 N--CA 1.441 -0.88 0 O-C-N 125.034 1.079 . . . . 10.0 109.44 -179.943 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 127.55 154.94 8.62 Favored Glycine 0 N--CA 1.435 -1.402 0 C-N-CA 120.624 -0.798 . . . . 10.0 111.457 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -118.77 154.64 32.48 Favored 'General case' 0 CA--C 1.506 -0.734 0 C-N-CA 124.442 1.097 . . . . 10.0 110.502 -179.776 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.1 m -131.88 139.79 48.89 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-O 123.697 1.713 . . . . 10.0 107.864 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -120.94 125.31 47.1 Favored 'General case' 0 C--O 1.246 0.917 0 CA-C-N 113.249 -1.796 . . . . 10.0 108.608 -179.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 5.5 t-105 -132.27 137.03 47.34 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 106.839 -1.541 . . . . 10.0 106.839 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 2.1 mt -111.26 140.85 28.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 O-C-N 126.352 2.283 . . . . 10.0 117.022 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -123.82 170.56 10.42 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 104.103 -2.554 . . . . 10.0 104.103 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -33.95 -80.0 0.02 OUTLIER Glycine 0 C--O 1.241 0.59 0 O-C-N 128.152 3.407 . . . . 10.0 111.159 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -115.42 15.53 16.77 Favored 'General case' 0 CA--C 1.555 1.143 0 CA-C-N 120.157 1.978 . . . . 10.0 108.776 179.737 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -126.9 154.51 44.35 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 124.547 2.117 . . . . 10.0 112.516 -179.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.443 ' CB ' ' HB2' ' A' ' 130' ' ' PHE . 0.2 OUTLIER -113.42 127.55 56.15 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 111.715 -2.493 . . . . 10.0 106.525 179.863 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -110.87 79.64 1.22 Allowed 'General case' 0 C--O 1.217 -0.656 0 CA-C-O 122.305 1.05 . . . . 10.0 111.785 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 1.7 tp -80.27 148.24 30.85 Favored 'General case' 0 C--O 1.218 -0.582 0 CA-C-O 124.417 2.056 . . . . 10.0 113.493 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.441 ' HA ' ' HB3' ' A' ' 127' ' ' LYS . 0.0 OUTLIER -142.89 136.33 28.53 Favored 'General case' 0 C--O 1.219 -0.54 0 O-C-N 119.594 -1.941 . . . . 10.0 107.264 -179.835 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 7.5 mtp -138.48 151.08 47.07 Favored 'General case' 0 CA--C 1.51 -0.589 0 CA-C-O 122.941 1.353 . . . . 10.0 108.111 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 2.8 mtt-85 -143.58 166.48 24.71 Favored 'General case' 0 CA--C 1.512 -0.512 0 O-C-N 119.852 -1.78 . . . . 10.0 112.338 -179.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 178.57 122.66 0.05 OUTLIER 'General case' 0 CA--C 1.503 -0.848 0 CA-C-N 114.418 -1.264 . . . . 10.0 109.212 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 50.92 41.19 26.68 Favored 'General case' 0 C--O 1.244 0.791 0 O-C-N 125.96 2.037 . . . . 10.0 115.947 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 84.12 -7.37 71.55 Favored Glycine 0 C--N 1.341 0.811 0 O-C-N 124.646 1.216 . . . . 10.0 115.165 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 12.7 t -91.31 126.85 43.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 CA-C-O 117.642 -1.17 . . . . 10.0 111.409 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 85.6 m -111.86 111.35 22.24 Favored 'General case' 0 N--CA 1.441 -0.904 0 O-C-N 126.725 2.516 . . . . 10.0 115.83 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 1.4 t -110.07 156.39 20.61 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 104.996 -2.224 . . . . 10.0 104.996 -179.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . 0.441 ' HB3' ' HA ' ' A' ' 118' ' ' GLU . 0.0 OUTLIER -168.07 177.92 5.32 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 123.306 1.527 . . . . 10.0 110.163 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -149.83 150.42 31.95 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 112.789 -2.005 . . . . 10.0 114.092 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 28.1 t -111.32 115.66 50.45 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.788 0 N-CA-C 105.199 -2.149 . . . . 10.0 105.199 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . 0.443 ' HB2' ' CB ' ' A' ' 115' ' ' LEU . 55.1 m-85 -110.39 162.55 14.55 Favored 'General case' 0 CA--C 1.51 -0.573 0 O-C-N 125.584 1.802 . . . . 10.0 111.809 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.45 115.22 17.18 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 105.879 -1.897 . . . . 10.0 105.879 179.866 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 9.9 tttp -76.45 116.78 17.46 Favored 'General case' 0 C--O 1.216 -0.675 0 O-C-N 125.524 1.765 . . . . 10.0 108.506 -179.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.63 -37.39 77.55 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.678 0 CA-C-N 114.127 -1.397 . . . . 10.0 112.117 -179.741 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 . . . . . 0 N--CA 1.446 -0.641 0 CA-C-O 117.195 -1.384 . . . . 10.0 107.86 179.849 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.9 t0 . . . . . 0 C--O 1.238 0.497 0 CA-C-O 123.167 1.46 . . . . 10.0 111.419 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.498 ' CE1' HD13 ' A' ' 110' ' ' ILE . 57.0 m-85 -96.5 -28.23 14.5 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 116.899 2.185 . . . . 10.0 116.899 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 47.0 p-10 -64.48 139.79 58.8 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 117.985 2.587 . . . . 10.0 117.985 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -174.23 -130.57 1.3 Allowed Glycine 0 N--CA 1.452 -0.267 0 N-CA-C 117.179 1.632 . . . . 10.0 117.179 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -160.84 98.15 1.19 Allowed 'General case' 0 C--O 1.239 0.533 0 N-CA-C 105.709 -1.96 . . . . 10.0 105.709 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.508 ' CZ3' ' HG2' ' A' ' 132' ' ' LYS . 0.8 OUTLIER -90.15 139.64 30.43 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 116.253 -1.832 . . . . 10.0 107.697 179.9 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -123.04 8.88 9.28 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 125.09 1.494 . . . . 10.0 111.481 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.402 ' HE3' ' HB3' ' A' ' 13' ' ' ASN . 0.0 OUTLIER 61.77 135.09 0.01 OUTLIER 'General case' 0 C--N 1.309 -1.163 0 O-C-N 126.718 2.511 . . . . 10.0 117.527 179.101 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.5 tp -113.05 -56.08 2.45 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 107.854 -1.165 . . . . 10.0 107.854 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.1 p -154.01 -178.25 6.96 Favored 'General case' 0 C--O 1.242 0.679 0 N-CA-C 115.522 1.675 . . . . 10.0 115.522 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . 0.402 ' HB3' ' HE3' ' A' ' 10' ' ' MET . 8.4 p30 -154.17 164.02 39.18 Favored 'General case' 0 C--O 1.238 0.457 0 N-CA-C 105.002 -2.222 . . . . 10.0 105.002 -179.484 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -156.02 18.6 0.37 Allowed 'General case' 0 C--O 1.234 0.237 0 O-C-N 118.545 -2.597 . . . . 10.0 114.658 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -163.01 26.52 0.09 Allowed 'General case' 0 C--O 1.241 0.651 0 O-C-N 125.34 1.65 . . . . 10.0 114.332 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -62.75 -52.59 62.61 Favored 'General case' 0 C--O 1.243 0.718 0 C-N-CA 124.627 1.171 . . . . 10.0 113.71 -179.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.0 tm-20 -69.01 -34.13 74.77 Favored 'General case' 0 CA--C 1.511 -0.557 0 N-CA-C 115.151 1.537 . . . . 10.0 115.151 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -77.0 -23.3 52.25 Favored 'General case' 0 C--N 1.32 -0.715 0 O-C-N 124.91 1.381 . . . . 10.0 108.034 -179.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -78.1 -32.59 50.63 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 107.994 -1.113 . . . . 10.0 107.994 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 81.8 mt -75.9 -30.4 58.77 Favored 'General case' 0 C--O 1.217 -0.656 0 O-C-N 119.926 -1.733 . . . . 10.0 111.876 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.2 ttm180 -68.96 -27.09 65.42 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 124.11 0.964 . . . . 10.0 110.245 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.26 -49.01 54.24 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.189 1.795 . . . . 10.0 109.308 -179.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.6 mt -74.9 -15.47 60.7 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 125.915 2.009 . . . . 10.0 111.793 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 69.15 28.94 4.84 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 115.396 1.628 . . . . 10.0 115.396 -179.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 6.1 m -62.0 178.12 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 N-CA-C 107.675 -1.231 . . . . 10.0 107.675 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -62.32 152.07 34.83 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 116.327 1.973 . . . . 10.0 116.327 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 14.8 p -70.74 -32.29 48.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 N-CA-C 115.072 1.508 . . . . 10.0 115.072 179.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -73.72 -25.04 60.01 Favored 'General case' 0 C--O 1.243 0.725 0 O-C-N 124.989 1.431 . . . . 10.0 109.171 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -73.99 -50.48 19.69 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-N 114.024 -1.444 . . . . 10.0 108.826 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.49 -25.37 68.23 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 125.145 1.378 . . . . 10.0 113.491 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -73.92 -44.84 53.78 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 113.166 -1.833 . . . . 10.0 112.12 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.7 mm -69.31 -54.85 17.67 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 O-C-N 120.093 -1.629 . . . . 10.0 110.755 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -45.57 -28.13 0.89 Allowed 'General case' 0 C--O 1.216 -0.696 0 N-CA-C 115.874 1.805 . . . . 10.0 115.874 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 13.9 t-20 -86.15 -2.47 58.38 Favored 'General case' 0 N--CA 1.44 -0.968 0 O-C-N 119.995 -1.691 . . . . 10.0 113.908 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 15.7 mt -104.43 -20.15 13.81 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 108.942 -0.762 . . . . 10.0 108.942 179.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -128.29 173.66 9.96 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 113.422 0.897 . . . . 10.0 113.422 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 6.5 ptpt -151.32 155.19 34.46 Favored Pre-proline 0 N--CA 1.478 0.949 0 N-CA-C 104.236 -2.505 . . . . 10.0 104.236 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo -101.74 162.56 0.35 Allowed 'Trans proline' 0 N--CA 1.459 -0.547 1 C-N-CA 126.799 4.999 . . . . 10.0 116.672 -179.803 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -110.42 -175.86 2.83 Favored 'General case' 0 C--O 1.239 0.55 0 N-CA-C 104.927 -2.249 . . . . 10.0 104.927 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.76 140.78 11.1 Favored 'General case' 0 C--N 1.309 -1.153 0 O-C-N 120.517 -1.364 . . . . 10.0 111.73 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -132.16 135.84 46.66 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 105.225 -2.139 . . . . 10.0 105.225 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.419 HG13 ' NE1' ' A' ' 8' ' ' TRP . 0.9 OUTLIER -121.52 141.21 42.92 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.026 0 N-CA-C 109.265 -0.642 . . . . 10.0 109.265 -179.926 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.5 t -137.86 135.35 45.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 105.791 -1.929 . . . . 10.0 105.791 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -126.47 113.3 16.65 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 121.482 0.658 . . . . 10.0 109.85 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -82.08 -17.57 46.09 Favored 'General case' 0 C--O 1.219 -0.543 0 N-CA-C 106.757 -1.572 . . . . 10.0 106.757 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 140.44 -110.67 0.69 Allowed Glycine 0 CA--C 1.521 0.451 0 N-CA-C 107.619 -2.192 . . . . 10.0 107.619 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 60.0 m-20 -71.24 -13.54 61.94 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 119.299 -2.294 . . . . 10.0 108.541 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 31.7 m170 -109.78 144.83 37.66 Favored 'General case' 0 N--CA 1.439 -0.997 0 N-CA-C 105.372 -2.084 . . . . 10.0 105.372 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 16.5 ttt -133.14 154.95 50.13 Favored 'General case' 0 C--N 1.317 -0.812 0 O-C-N 125.807 1.942 . . . . 10.0 111.592 179.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.405 ' N ' HD12 ' A' ' 50' ' ' ILE . 4.6 mp -142.26 132.11 23.49 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.058 0 N-CA-C 107.161 -1.422 . . . . 10.0 107.161 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -120.24 125.56 74.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 CA-C-O 117.355 -1.307 . . . . 10.0 108.785 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.5 ptp180 -115.83 128.59 55.94 Favored 'General case' 0 C--O 1.221 -0.413 0 O-C-N 126.058 2.099 . . . . 10.0 108.27 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.467 ' HB ' ' CB ' ' A' ' 60' ' ' TYR . 76.9 m -123.99 113.07 17.95 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 104.861 -2.274 . . . . 10.0 104.861 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.407 HD22 ' N ' ' A' ' 54' ' ' LEU . 2.5 mm? -119.51 140.3 50.71 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 119.52 3.156 . . . . 10.0 119.52 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -165.29 28.16 0.06 Allowed 'General case' 0 N--CA 1.445 -0.704 0 N-CA-C 109.273 -0.64 . . . . 10.0 109.273 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 9.0 m 44.14 48.21 7.58 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 112.647 0.61 . . . . 10.0 112.647 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -159.98 -70.89 0.07 Allowed 'General case' 0 C--O 1.247 0.946 0 N-CA-C 105.849 -1.908 . . . . 10.0 105.849 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.11 118.26 34.25 Favored 'General case' 0 C--O 1.245 0.836 0 CA-C-N 113.628 -1.624 . . . . 10.0 109.74 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -102.53 102.34 12.6 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.745 0.784 . . . . 10.0 109.914 179.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.467 ' CB ' ' HB ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -87.34 107.76 18.67 Favored 'General case' 0 C--O 1.212 -0.88 0 N-CA-C 105.33 -2.1 . . . . 10.0 105.33 -179.698 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 5.2 mt -135.84 141.48 41.82 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 CA-C-O 122.463 1.125 . . . . 10.0 111.312 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 28.3 mmt -149.57 178.16 9.09 Favored 'General case' 0 CA--C 1.505 -0.76 0 N-CA-C 104.549 -2.389 . . . . 10.0 104.549 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 58.6 m-20 -142.16 69.46 1.32 Allowed 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 102.638 -3.097 . . . . 10.0 102.638 -179.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.413 ' CD2' HG13 ' A' ' 86' ' ' VAL . 6.0 m-30 -70.58 146.12 50.31 Favored 'General case' 0 C--O 1.243 0.732 0 N-CA-C 115.398 1.629 . . . . 10.0 115.398 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -116.93 120.79 39.53 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 107.046 -1.465 . . . . 10.0 107.046 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 43.9 t -65.04 100.95 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.723 0 C-N-CA 123.942 0.897 . . . . 10.0 110.871 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 94.61 68.3 1.04 Allowed Glycine 0 C--O 1.221 -0.695 0 O-C-N 127.868 3.23 . . . . 10.0 112.027 -179.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -167.3 136.46 2.73 Favored 'General case' 0 C--O 1.231 0.091 0 O-C-N 119.472 -2.193 . . . . 10.0 114.851 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -84.57 136.06 33.94 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 118.485 -1.286 . . . . 10.0 111.311 179.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 44.2 p90 -158.62 128.37 5.79 Favored 'General case' 0 C--N 1.322 -0.617 0 O-C-N 120.612 -1.305 . . . . 10.0 109.268 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -61.9 155.14 24.21 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 123.719 1.723 . . . . 10.0 110.902 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 14.8 tp10 -120.95 67.49 0.86 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 113.139 -1.846 . . . . 10.0 113.564 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -68.97 71.82 0.24 Allowed 'General case' 0 C--N 1.316 -0.85 0 C-N-CA 125.395 1.478 . . . . 10.0 107.107 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -76.58 137.16 39.35 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 114.082 -1.417 . . . . 10.0 113.721 -179.807 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 51.0 p -152.78 50.91 0.75 Allowed 'General case' 0 C--O 1.242 0.707 0 N-CA-C 106.165 -1.791 . . . . 10.0 106.165 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -128.91 -59.18 0.11 Allowed Glycine 0 N--CA 1.435 -1.425 0 O-C-N 125.266 1.604 . . . . 10.0 112.417 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 46.3 mt -112.46 -87.15 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.539 0 O-C-N 124.667 0.863 . . . . 10.0 109.692 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -81.26 3.82 22.61 Favored 'General case' 0 CA--C 1.51 -0.566 0 N-CA-C 115.298 1.592 . . . . 10.0 115.298 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.8 p30 44.68 -155.76 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 114.545 1.313 . . . . 10.0 114.545 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 72.84 130.77 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 119.477 1.035 . . . . 10.0 111.841 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 6.3 ttpm? -87.73 122.45 31.41 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 104.783 -2.303 . . . . 10.0 104.783 -179.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -121.59 172.4 8.13 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 107.601 -1.259 . . . . 10.0 107.601 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' MET . . . . . 0.413 ' CB ' ' HB2' ' A' ' 98' ' ' LYS . 0.0 OUTLIER -116.48 126.6 53.6 Favored 'General case' 0 CA--C 1.512 -0.498 1 N-CA-C 98.902 -4.481 . . . . 10.0 98.902 -179.954 . . . . . . . . 4 4 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 33.9 m -127.1 140.11 52.5 Favored 'General case' 0 C--N 1.311 -1.097 0 O-C-N 121.189 -0.945 . . . . 10.0 113.513 -179.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 2.1 m -126.82 101.54 6.64 Favored 'General case' 0 C--N 1.316 -0.872 0 O-C-N 125.052 1.47 . . . . 10.0 109.345 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.413 HG13 ' CD2' ' A' ' 64' ' ' PHE . 1.3 m -81.97 138.13 20.01 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.954 0 N-CA-C 101.332 -3.581 . . . . 10.0 101.332 179.864 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 13.7 t -145.89 167.13 24.0 Favored 'General case' 0 C--N 1.317 -0.84 0 C-N-CA 119.364 -0.935 . . . . 10.0 111.037 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 5.7 t90 -97.28 129.23 44.61 Favored 'General case' 0 C--N 1.314 -0.956 0 O-C-N 125.707 1.879 . . . . 10.0 106.554 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -139.85 98.0 3.37 Favored 'General case' 0 CA--C 1.505 -0.771 0 N-CA-C 101.519 -3.512 . . . . 10.0 101.519 -179.773 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 52.19 -130.77 37.43 Favored Glycine 0 N--CA 1.437 -1.29 0 N-CA-C 104.762 -3.335 . . . . 10.0 104.762 179.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -89.37 24.23 2.29 Favored 'General case' 0 N--CA 1.446 -0.628 0 O-C-N 124.288 0.64 . . . . 10.0 112.205 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.7 167.42 12.07 Favored 'General case' 0 CA--C 1.508 -0.641 0 CA-C-O 121.601 0.715 . . . . 10.0 110.651 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -125.05 99.64 6.21 Favored 'General case' 0 C--O 1.241 0.635 0 N-CA-C 102.85 -3.018 . . . . 10.0 102.85 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 18.4 mm-40 -85.76 137.0 33.1 Favored 'General case' 0 CA--C 1.503 -0.851 0 O-C-N 124.756 1.285 . . . . 10.0 113.188 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 7.1 t -137.94 123.86 20.11 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 108.33 -0.989 . . . . 10.0 108.33 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 16.1 t -133.93 117.12 25.03 Favored 'Isoleucine or valine' 0 C--O 1.245 0.84 0 CA-C-N 112.939 -1.937 . . . . 10.0 109.256 -179.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 17.3 mt-30 -90.54 143.23 26.95 Favored 'General case' 0 C--O 1.243 0.758 0 N-CA-C 107.235 -1.394 . . . . 10.0 107.235 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.413 ' HB2' ' CB ' ' A' ' 83' ' ' MET . 0.6 OUTLIER -85.18 17.07 3.17 Favored 'General case' 0 CA--C 1.508 -0.643 0 O-C-N 124.249 0.968 . . . . 10.0 113.255 179.973 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -77.79 -178.08 48.05 Favored Glycine 0 N--CA 1.435 -1.37 0 C-N-CA 118.231 -1.937 . . . . 10.0 109.816 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -70.76 164.06 25.95 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 113.681 0.993 . . . . 10.0 113.681 -179.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 15.0 mttm 82.95 -179.91 0.05 Allowed 'General case' 0 CA--C 1.54 0.575 0 O-C-N 125.773 1.921 . . . . 10.0 112.401 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -108.17 130.76 55.11 Favored 'General case' 0 C--O 1.223 -0.301 0 O-C-N 124.76 1.288 . . . . 10.0 112.306 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 106.09 -20.55 35.47 Favored Glycine 0 C--O 1.215 -1.057 0 N-CA-C 118.338 2.095 . . . . 10.0 118.338 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 10.2 mtt180 -40.98 116.35 0.71 Allowed 'General case' 0 C--N 1.327 -0.407 0 O-C-N 125.956 1.621 . . . . 10.0 110.999 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 125.74 170.95 13.11 Favored Glycine 0 C--O 1.218 -0.898 0 N-CA-C 107.933 -2.067 . . . . 10.0 107.933 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -130.92 174.72 9.71 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 123.036 1.398 . . . . 10.0 110.038 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 48.6 m -130.97 133.69 46.03 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 104.672 -2.344 . . . . 10.0 104.672 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -122.08 125.73 46.86 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 118.254 -0.879 . . . . 10.0 110.699 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' TRP . . . . . 0.496 ' CD1' ' C ' ' A' ' 109' ' ' TRP . 0.0 OUTLIER -138.45 145.14 40.53 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 126.097 2.123 . . . . 10.0 106.74 -179.98 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.498 HD13 ' CE1' ' A' ' 4' ' ' PHE . 4.7 mt -105.36 137.9 32.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 124.184 1.945 . . . . 10.0 115.646 179.718 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -104.45 165.95 10.72 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 104.611 -2.366 . . . . 10.0 104.611 179.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -39.55 -73.07 0.19 Allowed Glycine 0 N--CA 1.448 -0.521 0 O-C-N 126.015 2.072 . . . . 10.0 111.414 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -122.46 35.98 4.75 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 121.576 0.703 . . . . 10.0 110.248 -179.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -150.45 164.12 36.69 Favored 'General case' 0 C--O 1.241 0.62 0 O-C-N 119.402 -2.061 . . . . 10.0 109.722 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -119.2 120.99 38.68 Favored 'General case' 0 C--N 1.314 -0.965 0 N-CA-C 104.351 -2.463 . . . . 10.0 104.351 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -119.0 91.1 3.47 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 119.348 0.976 . . . . 10.0 108.517 179.85 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 30.5 tp -86.98 151.2 23.49 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 124.55 1.156 . . . . 10.0 109.745 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -139.46 102.94 4.59 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 114.924 -1.034 . . . . 10.0 109.966 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 4.7 mtp -97.54 154.33 17.58 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 108.437 -0.949 . . . . 10.0 108.437 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -146.89 154.78 41.7 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 114.093 1.146 . . . . 10.0 114.093 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -170.02 118.53 0.59 Allowed 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 105.027 -2.212 . . . . 10.0 105.027 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 63.64 43.31 5.78 Favored 'General case' 0 C--O 1.242 0.7 0 O-C-N 126.664 2.477 . . . . 10.0 113.093 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 64.47 15.92 59.98 Favored Glycine 0 C--O 1.22 -0.763 0 O-C-N 121.236 -0.915 . . . . 10.0 115.37 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 2.6 t -105.16 123.25 59.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 N-CA-C 108.064 -1.087 . . . . 10.0 108.064 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 85.1 m -93.78 117.47 30.14 Favored 'General case' 0 N--CA 1.441 -0.903 0 O-C-N 123.82 0.7 . . . . 10.0 112.484 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 51.6 t -116.88 104.93 11.8 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 106.487 -1.672 . . . . 10.0 106.487 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 28.9 mtpt -106.56 152.38 23.78 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 122.396 1.093 . . . . 10.0 111.822 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -135.3 107.91 7.43 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 108.206 -1.035 . . . . 10.0 108.206 -179.579 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 76.8 t -83.14 122.37 37.38 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.73 0 O-C-N 125.555 1.784 . . . . 10.0 107.694 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 59.6 m-85 -112.07 -172.38 2.03 Favored 'General case' 0 N--CA 1.45 -0.457 0 O-C-N 125.173 1.545 . . . . 10.0 108.506 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 24.1 tptp -151.87 122.48 7.4 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 123.542 1.639 . . . . 10.0 107.745 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . 0.508 ' HG2' ' CZ3' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -78.27 110.78 13.59 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-N 115.01 -0.995 . . . . 10.0 108.866 -179.832 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 4.2 t -100.87 -1.85 9.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 118.209 -0.901 . . . . 10.0 109.313 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.44 -0.936 0 O-C-N 126.044 2.09 . . . . 10.0 110.866 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.47 0.561 0 N-CA-C 112.511 0.56 . . . . 10.0 112.511 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.472 ' CD1' HD11 ' A' ' 110' ' ' ILE . 84.9 m-85 68.86 -49.22 0.58 Allowed 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 126.168 1.787 . . . . 10.0 114.027 -179.706 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -47.55 113.17 0.65 Allowed 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 115.105 1.52 . . . . 10.0 115.105 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 169.96 -116.0 0.63 Allowed Glycine 0 CA--C 1.529 0.968 0 O-C-N 125.467 1.729 . . . . 10.0 113.954 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -165.66 144.4 6.15 Favored 'General case' 0 C--O 1.224 -0.243 0 N-CA-C 100.894 -3.743 . . . . 10.0 100.894 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.497 ' CD2' HD11 ' A' ' 115' ' ' LEU . 87.2 m95 -129.92 114.9 16.43 Favored 'General case' 0 C--N 1.315 -0.919 0 O-C-N 124.53 1.144 . . . . 10.0 109.331 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 9.1 tptt -99.01 116.91 32.32 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.231 -1.35 . . . . 10.0 110.698 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.46 135.51 57.7 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-O 122.234 1.016 . . . . 10.0 111.483 179.265 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 15.0 tp -117.02 -45.02 2.77 Favored 'General case' 0 CA--C 1.514 -0.441 0 O-C-N 120.611 -1.306 . . . . 10.0 111.436 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -122.29 156.93 32.82 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 123.977 1.846 . . . . 10.0 113.992 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -148.43 120.04 8.01 Favored 'General case' 0 CA--C 1.508 -0.666 0 CA-C-N 112.098 -2.319 . . . . 10.0 107.51 179.683 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.5 mt-10 -101.49 -71.57 0.71 Allowed 'General case' 0 C--N 1.319 -0.76 0 C-N-CA 122.861 0.465 . . . . 10.0 112.169 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 10.3 m-20 -107.18 56.38 0.64 Allowed 'General case' 0 C--O 1.24 0.586 0 CA-C-O 123.123 1.439 . . . . 10.0 112.893 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -71.26 -49.75 39.87 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 118.16 -2.838 . . . . 10.0 111.088 179.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -64.62 -36.63 84.88 Favored 'General case' 0 C--N 1.323 -0.565 0 O-C-N 119.396 -2.065 . . . . 10.0 115.633 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.68 -28.92 64.06 Favored 'General case' 0 C--O 1.216 -0.701 0 CA-C-O 122.95 1.357 . . . . 10.0 111.752 179.508 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -67.58 -42.96 81.7 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 113.142 -1.844 . . . . 10.0 111.447 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 46.9 mt -75.73 -22.35 56.65 Favored 'General case' 0 C--O 1.212 -0.902 0 O-C-N 120.989 -1.07 . . . . 10.0 110.817 179.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.34 -21.53 56.03 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 112.883 -1.962 . . . . 10.0 106.44 179.682 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.8 -35.71 59.98 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-O 125.194 2.426 . . . . 10.0 111.151 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -89.41 -7.74 54.51 Favored 'General case' 0 CA--C 1.546 0.808 0 O-C-N 120.265 -1.522 . . . . 10.0 114.618 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 64.78 38.34 6.84 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 124.232 1.968 . . . . 10.0 113.606 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.42 ' CG2' HD23 ' A' ' 29' ' ' LEU . 0.3 OUTLIER -68.22 160.47 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.709 0 N-CA-C 105.161 -2.162 . . . . 10.0 105.161 -179.909 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 13.0 p30 -63.0 160.14 15.62 Favored 'General case' 0 C--O 1.242 0.663 0 O-C-N 125.412 1.695 . . . . 10.0 114.557 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -67.95 -35.24 71.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 N-CA-C 115.925 1.824 . . . . 10.0 115.925 -179.365 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -72.66 -34.72 67.44 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 121.259 -0.9 . . . . 10.0 112.086 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.42 HD23 ' CG2' ' A' ' 25' ' ' VAL . 32.8 tp -66.18 -31.02 71.61 Favored 'General case' 0 C--N 1.32 -0.679 0 O-C-N 120.153 -1.592 . . . . 10.0 112.093 -179.719 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 7.7 ttp180 -78.04 -29.83 49.55 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 113.757 -1.565 . . . . 10.0 109.563 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -78.86 -41.08 30.82 Favored 'General case' 0 N--CA 1.466 0.328 0 O-C-N 124.431 1.082 . . . . 10.0 111.608 -179.783 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.2 mp -74.72 -30.47 24.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 CA-C-N 113.698 -1.592 . . . . 10.0 109.449 -179.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -76.8 -52.23 9.91 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 115.691 1.737 . . . . 10.0 115.691 179.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 16.8 p30 -45.65 -23.96 0.3 Allowed 'General case' 0 C--O 1.217 -0.628 0 N-CA-C 115.409 1.633 . . . . 10.0 115.409 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.0 mt -73.56 -46.95 44.37 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-O 124.198 1.951 . . . . 10.0 111.1 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.6 pp -97.51 -178.91 4.29 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 113.783 -1.553 . . . . 10.0 109.815 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 18.8 mttt -142.43 138.53 16.52 Favored Pre-proline 0 N--CA 1.468 0.438 0 N-CA-C 104.293 -2.484 . . . . 10.0 104.293 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -68.83 108.83 1.98 Allowed 'Trans proline' 0 N--CA 1.45 -1.055 0 C-N-CA 124.782 3.655 . . . . 10.0 119.018 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -88.26 136.32 33.03 Favored 'General case' 0 C--O 1.219 -0.521 0 N-CA-C 105.38 -2.082 . . . . 10.0 105.38 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.9 mttm -119.06 138.81 52.61 Favored 'General case' 0 C--O 1.211 -0.922 0 CA-C-O 123.417 1.579 . . . . 10.0 112.29 179.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -134.61 128.36 33.03 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 103.544 -2.761 . . . . 10.0 103.544 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 17.5 mt -118.01 136.84 53.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 O-C-N 125.843 1.964 . . . . 10.0 110.992 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 48.7 t -128.79 103.84 10.28 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.38 0 N-CA-C 105.162 -2.162 . . . . 10.0 105.162 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.26 142.84 27.92 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-O 123.374 1.559 . . . . 10.0 111.804 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -132.45 167.45 19.93 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 102.725 -3.065 . . . . 10.0 102.725 -179.699 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -67.9 118.43 9.65 Favored Glycine 0 C--O 1.246 0.862 0 CA-C-O 117.685 -1.619 . . . . 10.0 109.443 179.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 62.74 18.75 10.91 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 119.198 1.499 . . . . 10.0 112.695 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -156.76 119.98 4.15 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 105.837 -1.912 . . . . 10.0 105.837 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.448 ' HE1' ' CD1' ' A' ' 93' ' ' LEU . 5.6 ttp -118.88 159.61 23.45 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 114.794 -1.094 . . . . 10.0 112.226 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 35.0 mt -145.41 135.45 18.59 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 N-CA-C 108.095 -1.076 . . . . 10.0 108.095 179.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.3 mm -117.42 129.17 74.33 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 N-CA-C 105.262 -2.125 . . . . 10.0 105.262 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.9 mtp-105 -121.85 106.26 11.11 Favored 'General case' 0 N--CA 1.437 -1.091 0 O-C-N 124.338 1.024 . . . . 10.0 113.588 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.3 m -80.81 128.78 34.05 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 101.17 -3.641 . . . . 10.0 101.17 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 64.2 mt -132.94 76.46 1.68 Allowed 'General case' 0 N--CA 1.448 -0.549 1 N-CA-C 122.559 4.281 . . . . 10.0 122.559 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -110.18 129.33 55.73 Favored 'General case' 0 C--O 1.242 0.66 0 C-N-CA 124.992 1.317 . . . . 10.0 107.942 -179.737 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 22.9 p -61.41 89.11 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.728 0 O-C-N 125.145 1.528 . . . . 10.0 109.465 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 3.0 t80 174.11 -69.52 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 126.796 2.56 . . . . 10.0 109.71 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 40.2 ttm180 -148.21 105.72 3.67 Favored 'General case' 0 C--N 1.344 0.368 0 O-C-N 125.246 1.591 . . . . 10.0 114.758 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . 0.641 ' N ' HD21 ' A' ' 59' ' ' ASN . 0.7 OUTLIER -91.04 123.86 34.83 Favored 'General case' 0 C--N 1.319 -0.722 0 O-C-N 125.182 1.551 . . . . 10.0 112.668 -179.746 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.407 ' CD1' ' O ' ' A' ' 60' ' ' TYR . 0.1 OUTLIER -118.09 120.68 38.49 Favored 'General case' 0 C--O 1.211 -0.931 0 N-CA-C 104.041 -2.577 . . . . 10.0 104.041 179.697 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.0 mm -108.56 156.61 9.08 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.476 0 O-C-N 119.049 -2.282 . . . . 10.0 111.895 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -136.18 -169.07 2.35 Favored 'General case' 0 C--O 1.219 -0.551 0 CA-C-N 112.86 -1.973 . . . . 10.0 107.819 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 12.3 t0 -170.62 77.42 0.08 Allowed 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 101.598 -3.482 . . . . 10.0 101.598 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.499 ' CD1' ' CD2' ' A' ' 70' ' ' PHE . 66.4 m-85 -62.96 175.13 0.91 Allowed 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 114.722 1.379 . . . . 10.0 114.722 -179.891 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -134.75 94.05 3.12 Favored 'General case' 0 C--O 1.217 -0.65 0 N-CA-C 104.451 -2.425 . . . . 10.0 104.451 179.517 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 5.3 t -59.99 120.12 5.29 Favored 'Isoleucine or valine' 0 C--O 1.245 0.862 0 O-C-N 124.268 0.98 . . . . 10.0 112.961 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 105.66 23.35 7.56 Favored Glycine 0 CA--C 1.532 1.149 0 CA-C-N 114.903 -1.044 . . . . 10.0 114.957 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -172.43 143.5 1.4 Allowed 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 116.795 -1.574 . . . . 10.0 114.701 179.78 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.421 ' HG3' ' HB3' ' A' ' 83' ' ' MET . 0.0 OUTLIER -53.3 118.31 3.72 Favored 'General case' 0 C--N 1.319 -0.747 0 O-C-N 125.333 1.646 . . . . 10.0 108.61 179.757 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.499 ' CD2' ' CD1' ' A' ' 64' ' ' PHE . 81.8 t80 -91.83 -34.29 14.61 Favored 'General case' 0 C--O 1.239 0.525 0 CA-C-N 113.122 -1.854 . . . . 10.0 112.824 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 72.6 161.76 0.25 Allowed 'General case' 0 C--O 1.217 -0.649 0 N-CA-C 105.513 -2.032 . . . . 10.0 105.513 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -136.85 -46.92 0.59 Allowed 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 114.779 1.4 . . . . 10.0 114.779 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 56.52 28.03 13.19 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 108.405 -0.961 . . . . 10.0 108.405 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -39.57 143.25 0.23 Allowed 'General case' 0 C--N 1.313 -1.009 0 N-CA-C 116.917 2.191 . . . . 10.0 116.917 -179.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -165.84 107.62 0.75 Allowed 'General case' 0 C--O 1.241 0.626 0 N-CA-C 107.314 -1.365 . . . . 10.0 107.314 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 162.26 -54.88 0.3 Allowed Glycine 0 N--CA 1.438 -1.177 0 N-CA-C 108.988 -1.645 . . . . 10.0 108.988 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.2 pt -121.77 142.94 36.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 N-CA-C 103.441 -2.8 . . . . 10.0 103.441 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 23.5 t0 64.7 -68.5 0.1 Allowed 'General case' 0 N--CA 1.443 -0.804 0 O-C-N 125.712 1.883 . . . . 10.0 113.918 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 81.83 70.52 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.572 0 O-C-N 126.309 2.255 . . . . 10.0 111.46 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 6.3 mtm180 -121.68 -171.96 2.33 Favored 'General case' 0 C--O 1.236 0.358 0 O-C-N 120.506 -1.371 . . . . 10.0 112.733 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 5.4 mtpm? -139.27 135.77 34.2 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 103.439 -2.801 . . . . 10.0 103.439 -179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 27.5 p -172.22 159.08 4.7 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-O 123.014 1.388 . . . . 10.0 108.993 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' MET . . . . . 0.421 ' HB3' ' HG3' ' A' ' 69' ' ' GLU . 0.7 OUTLIER -107.05 108.45 19.94 Favored 'General case' 0 N--CA 1.441 -0.923 1 N-CA-C 98.381 -4.674 . . . . 10.0 98.381 -179.726 . . . . . . . . 4 4 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 17.7 m -105.04 112.79 26.05 Favored 'General case' 0 N--CA 1.445 -0.693 0 O-C-N 126.805 2.566 . . . . 10.0 116.641 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 25.5 m -106.72 115.66 30.57 Favored 'General case' 0 N--CA 1.439 -0.979 0 O-C-N 125.892 1.995 . . . . 10.0 109.284 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 58.1 t -86.76 143.21 11.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 104.625 -2.361 . . . . 10.0 104.625 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 39.1 t -163.73 133.17 4.01 Favored 'General case' 0 C--O 1.243 0.759 0 CA-C-N 113.986 -1.461 . . . . 10.0 111.712 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -82.61 126.22 32.07 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 119.573 -0.851 . . . . 10.0 110.08 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -75.28 -37.95 60.65 Favored 'General case' 0 C--N 1.313 -1.002 1 N-CA-C 98.803 -4.518 . . . . 10.0 98.803 179.868 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 163.04 -73.75 0.19 Allowed Glycine 0 C--N 1.333 0.4 0 N-CA-C 106.015 -2.834 . . . . 10.0 106.015 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -106.57 8.45 31.29 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.092 -0.643 . . . . 10.0 109.669 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.5 121.04 21.59 Favored 'General case' 0 N--CA 1.442 -0.846 0 N-CA-C 109.195 -0.669 . . . . 10.0 109.195 -179.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.448 ' CD1' ' HE1' ' A' ' 49' ' ' MET . 0.3 OUTLIER -84.24 83.32 8.01 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 104.931 -2.248 . . . . 10.0 104.931 -179.998 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -86.05 139.45 31.14 Favored 'General case' 0 C--O 1.212 -0.881 0 CA-C-N 113.051 -1.886 . . . . 10.0 113.663 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -130.86 146.05 52.17 Favored 'General case' 0 C--O 1.241 0.631 0 CA-C-N 113.521 -1.672 . . . . 10.0 109.616 -179.753 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 9.1 p -121.16 142.41 37.43 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 N-CA-C 104.765 -2.309 . . . . 10.0 104.765 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -148.82 94.43 2.26 Favored 'General case' 0 C--N 1.321 -0.656 0 O-C-N 125.106 1.504 . . . . 10.0 109.557 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.87 119.88 8.54 Favored 'General case' 0 C--O 1.213 -0.833 0 O-C-N 121.055 -1.028 . . . . 10.0 112.448 -179.697 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -134.77 -160.37 9.08 Favored Glycine 0 C--N 1.312 -0.782 0 CA-C-O 117.808 -1.551 . . . . 10.0 110.62 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -90.33 4.48 50.67 Favored 'General case' 0 C--N 1.316 -0.873 0 O-C-N 126.7 2.059 . . . . 10.0 115.723 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 11.1 mmtt -107.86 -176.27 3.01 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 115.342 1.608 . . . . 10.0 115.342 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -67.31 -60.89 2.21 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 125.546 1.779 . . . . 10.0 108.659 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -141.91 127.28 3.22 Favored Glycine 0 C--N 1.338 0.681 0 N-CA-C 117.639 1.815 . . . . 10.0 117.639 179.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -144.45 127.92 16.96 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-O 117.734 -1.127 . . . . 10.0 109.343 -179.655 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 176.49 160.68 24.11 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 109.21 -1.556 . . . . 10.0 109.21 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 38.6 m0 -116.48 105.29 12.32 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 123.321 0.648 . . . . 10.0 109.726 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.4 m -98.69 77.03 2.24 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 107.518 -1.29 . . . . 10.0 107.518 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.432 ' CG ' HD22 ' A' ' 115' ' ' LEU . 14.5 mp0 -72.02 111.69 7.47 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 122.743 1.259 . . . . 10.0 108.468 -179.754 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 4.4 t90 -113.53 109.31 18.44 Favored 'General case' 0 C--O 1.214 -0.804 0 O-C-N 120.557 -1.34 . . . . 10.0 110.934 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.472 HD11 ' CD1' ' A' ' 4' ' ' PHE . 10.3 mt -76.58 148.09 7.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 116.568 2.062 . . . . 10.0 116.568 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -130.84 58.66 1.69 Allowed 'General case' 0 C--O 1.219 -0.523 0 N-CA-C 105.429 -2.063 . . . . 10.0 105.429 -179.833 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 65.66 -94.24 0.19 Allowed Glycine 0 C--O 1.22 -0.777 0 N-CA-C 109.785 -1.326 . . . . 10.0 109.785 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -89.6 29.1 1.18 Allowed 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 122.838 1.304 . . . . 10.0 111.787 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -152.63 163.9 38.72 Favored 'General case' 0 CA--C 1.503 -0.827 0 O-C-N 120.736 -1.228 . . . . 10.0 114.082 179.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.497 HD11 ' CD2' ' A' ' 8' ' ' TRP . 2.4 tt -134.37 108.74 8.35 Favored 'General case' 0 N--CA 1.437 -1.12 0 O-C-N 126.201 2.188 . . . . 10.0 106.375 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -103.83 99.64 9.42 Favored 'General case' 0 C--O 1.212 -0.909 0 N-CA-C 105.53 -2.026 . . . . 10.0 105.53 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 17.2 tp -99.7 123.75 44.28 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 115.413 1.634 . . . . 10.0 115.413 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -99.66 73.7 1.82 Allowed 'General case' 0 N--CA 1.446 -0.665 0 O-C-N 123.479 0.487 . . . . 10.0 110.424 179.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 13.9 ttp -57.03 140.7 48.27 Favored 'General case' 0 N--CA 1.449 -0.516 0 O-C-N 124.4 1.063 . . . . 10.0 108.143 -179.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -125.64 156.04 39.85 Favored 'General case' 0 C--N 1.322 -0.621 0 O-C-N 125.928 2.018 . . . . 10.0 109.884 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 178.9 117.85 0.04 OUTLIER 'General case' 0 C--O 1.216 -0.662 0 O-C-N 126.545 2.403 . . . . 10.0 109.241 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 50.85 34.64 10.64 Favored 'General case' 0 N--CA 1.445 -0.72 0 O-C-N 125.447 1.717 . . . . 10.0 113.007 -179.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 85.02 -3.41 87.27 Favored Glycine 0 C--N 1.339 0.707 0 CA-C-O 122.385 0.992 . . . . 10.0 113.348 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 24.7 t -95.12 111.16 25.2 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 N-CA-C 107.632 -1.247 . . . . 10.0 107.632 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 4.1 m -101.1 106.25 17.5 Favored 'General case' 0 N--CA 1.442 -0.859 0 C-N-CA 125.468 1.507 . . . . 10.0 112.004 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -105.5 147.33 28.45 Favored 'General case' 0 C--O 1.214 -0.769 0 N-CA-C 105.047 -2.205 . . . . 10.0 105.047 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 7.8 mtpt -114.55 149.5 36.39 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 123.317 0.647 . . . . 10.0 110.739 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . 0.416 ' NE2' ' CZ ' ' A' ' 130' ' ' PHE . 0.1 OUTLIER -138.52 115.8 11.11 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 118.047 -0.978 . . . . 10.0 109.553 179.942 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 21.3 t -97.26 106.24 18.25 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.28 0 O-C-N 126.659 2.475 . . . . 10.0 110.885 -179.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . 0.416 ' CZ ' ' NE2' ' A' ' 128' ' ' GLN . 96.3 m-85 -92.75 172.65 8.21 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 106.58 -1.637 . . . . 10.0 106.58 179.827 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 46.5 tptt -140.88 122.13 14.83 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 107.014 -1.476 . . . . 10.0 107.014 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . 0.405 ' HB2' ' CZ3' ' A' ' 8' ' ' TRP . 18.4 ttpt -68.04 138.84 56.14 Favored 'General case' 0 C--O 1.218 -0.572 0 CA-C-N 120.169 1.35 . . . . 10.0 107.951 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -154.03 54.41 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.241 0.646 0 O-C-N 126.069 2.106 . . . . 10.0 111.139 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.441 -0.884 0 CA-C-O 116.392 -1.766 . . . . 10.0 111.925 -179.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.521 -0.135 0 CA-C-O 122.661 1.219 . . . . 10.0 109.664 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.516 ' CE1' HD12 ' A' ' 110' ' ' ILE . 99.0 m-85 -91.73 -17.39 25.5 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 117.447 2.388 . . . . 10.0 117.447 179.863 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 8.8 m120 -54.19 113.82 1.39 Allowed 'General case' 0 N--CA 1.477 0.89 0 CA-C-O 122.985 1.374 . . . . 10.0 112.858 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -177.61 -110.84 0.28 Allowed Glycine 0 C--N 1.347 1.163 0 N-CA-C 117.704 1.841 . . . . 10.0 117.704 179.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 173.09 93.99 0.01 OUTLIER 'General case' 0 C--O 1.241 0.621 0 N-CA-C 102.767 -3.049 . . . . 10.0 102.767 -179.846 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 10.0 m95 -94.38 105.48 17.45 Favored 'General case' 0 C--O 1.215 -0.724 0 CA-C-N 114.282 -1.326 . . . . 10.0 112.382 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.407 ' HB3' HG22 ' A' ' 133' ' ' VAL . 0.0 OUTLIER -68.99 -163.5 0.04 OUTLIER 'General case' 0 C--O 1.239 0.53 0 C-N-CA 118.923 -1.111 . . . . 10.0 109.401 179.789 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -128.7 134.7 48.56 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.406 0.622 . . . . 10.0 112.628 179.813 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -99.73 -63.09 1.16 Allowed 'General case' 0 C--O 1.236 0.352 0 N-CA-C 108.853 -0.795 . . . . 10.0 108.853 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -132.52 173.77 10.97 Favored 'General case' 0 CA--C 1.511 -0.532 0 O-C-N 126.771 2.544 . . . . 10.0 114.59 -179.533 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 23.8 p-10 -150.11 172.48 15.21 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 113.906 -1.497 . . . . 10.0 107.641 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -157.6 132.68 8.79 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 114.673 1.36 . . . . 10.0 114.673 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 52.32 42.95 31.19 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 122.691 1.234 . . . . 10.0 112.425 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -69.36 -44.41 71.62 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 115.004 1.483 . . . . 10.0 115.004 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.414 ' HG2' ' HG3' ' A' ' 30' ' ' ARG . 0.6 OUTLIER -71.9 -34.18 68.92 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-O 122.69 1.233 . . . . 10.0 113.758 -179.953 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 -77.44 -20.35 54.66 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 117.651 -1.166 . . . . 10.0 109.371 179.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.516 ' CZ ' ' HE1' ' A' ' 119' ' ' MET . 0.1 OUTLIER -76.19 -42.81 45.09 Favored 'General case' 0 CA--C 1.552 1.032 0 O-C-N 126.976 2.673 . . . . 10.0 108.537 179.968 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.434 HD21 ' CD2' ' A' ' 19' ' ' TYR . 3.0 mt -72.03 -21.41 61.54 Favored 'General case' 0 C--O 1.211 -0.947 0 O-C-N 120.764 -1.21 . . . . 10.0 113.211 -179.826 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.6 ttm180 -78.52 -25.37 45.54 Favored 'General case' 0 C--O 1.243 0.737 0 N-CA-C 106.252 -1.759 . . . . 10.0 106.252 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.81 -47.23 81.7 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.86 1.059 . . . . 10.0 113.86 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.499 HD11 ' CE1' ' A' ' 19' ' ' TYR . 0.4 OUTLIER -87.36 -6.4 58.49 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 119.25 0.932 . . . . 10.0 110.355 -179.705 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 71.48 19.04 5.3 Favored 'General case' 0 C--O 1.224 -0.273 0 O-C-N 123.815 0.697 . . . . 10.0 111.734 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 10.0 p -59.04 163.54 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.219 0 N-CA-C 105.621 -1.992 . . . . 10.0 105.621 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -41.81 148.31 0.17 Allowed 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 115.38 1.622 . . . . 10.0 115.38 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 2.9 p -73.32 -23.24 19.66 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.66 0 O-C-N 119.441 -2.037 . . . . 10.0 114.021 -179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -73.98 -23.75 59.51 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 109.554 -0.535 . . . . 10.0 109.554 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -71.04 -45.49 63.77 Favored 'General case' 0 C--O 1.218 -0.566 0 O-C-N 126.317 2.261 . . . . 10.0 112.694 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.414 ' HG3' ' HG2' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -68.15 -30.99 70.25 Favored 'General case' 0 CA--C 1.512 -0.499 0 O-C-N 125.107 1.504 . . . . 10.0 111.47 179.986 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.19 -44.72 59.37 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 108.647 -0.871 . . . . 10.0 108.647 -179.623 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 5.4 mt -76.21 -30.54 20.24 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 N-CA-C 108.109 -1.071 . . . . 10.0 108.109 -179.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -49.94 -61.57 2.06 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 127.977 3.298 . . . . 10.0 110.403 179.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -52.86 154.93 2.57 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 116.134 -1.888 . . . . 10.0 108.632 179.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 77.3 -39.21 0.31 Allowed 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 120.16 1.345 . . . . 10.0 113.167 -179.248 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -100.48 139.68 35.82 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 120.068 1.304 . . . . 10.0 110.948 179.693 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 14.9 mttt -127.13 111.82 21.62 Favored Pre-proline 0 CA--C 1.535 0.404 0 CA-C-O 123.151 1.453 . . . . 10.0 107.677 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -60.04 105.88 0.31 Allowed 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 123.307 2.671 . . . . 10.0 115.954 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.58 -177.98 1.67 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 118.31 0.504 . . . . 10.0 109.687 179.847 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.0 tptt -140.44 153.0 46.12 Favored 'General case' 0 C--N 1.314 -0.966 0 O-C-N 121.043 -1.036 . . . . 10.0 109.526 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -154.6 69.68 0.76 Allowed 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 104.143 -2.54 . . . . 10.0 104.143 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 25.4 mm -56.99 152.21 2.7 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.01 0 O-C-N 121.791 -0.568 . . . . 10.0 112.181 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -146.49 95.29 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 N-CA-C 104.461 -2.422 . . . . 10.0 104.461 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 55.8 tt0 -122.78 118.76 28.76 Favored 'General case' 0 C--O 1.218 -0.597 0 O-C-N 119.846 -1.784 . . . . 10.0 108.634 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -69.02 -85.89 0.02 OUTLIER 'General case' 0 C--O 1.236 0.387 0 N-CA-C 105.638 -1.986 . . . . 10.0 105.638 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -160.45 -54.79 0.01 OUTLIER Glycine 0 N--CA 1.461 0.348 0 N-CA-C 106.192 -2.763 . . . . 10.0 106.192 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.9 m-20 -100.78 4.4 42.92 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 108.643 -0.873 . . . . 10.0 108.643 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 34.6 m170 -142.07 174.2 10.82 Favored 'General case' 0 N--CA 1.438 -1.049 0 CA-C-O 117.82 -1.086 . . . . 10.0 110.246 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 14.0 ttp -149.22 165.07 32.98 Favored 'General case' 0 N--CA 1.441 -0.91 0 C-N-CA 118.699 -1.201 . . . . 10.0 111.806 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 6.8 mm -149.25 123.5 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 103.563 -2.754 . . . . 10.0 103.563 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.6 mp -110.51 133.23 56.6 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 N-CA-C 107.833 -1.173 . . . . 10.0 107.833 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 63.6 mtp180 -127.36 146.87 50.31 Favored 'General case' 0 C--O 1.214 -0.763 0 N-CA-C 109.021 -0.733 . . . . 10.0 109.021 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 18.4 m -128.22 108.21 10.42 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 102.402 -3.184 . . . . 10.0 102.402 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 11.0 mt -105.26 99.24 8.86 Favored 'General case' 0 C--N 1.32 -0.707 1 N-CA-C 122.095 4.109 . . . . 10.0 122.095 -179.775 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.5 m -129.94 173.29 10.83 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 104.879 -2.267 . . . . 10.0 104.879 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 32.5 p -101.49 31.5 3.73 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 107.211 -1.403 . . . . 10.0 107.211 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -124.5 -43.85 2.01 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-O 118.277 -0.868 . . . . 10.0 110.123 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -176.3 137.38 0.29 Allowed 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 118.006 -0.997 . . . . 10.0 112.389 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . 0.412 ' N ' ' ND2' ' A' ' 59' ' ' ASN . 0.9 OUTLIER -101.55 171.07 7.79 Favored 'General case' 0 C--O 1.241 0.621 0 O-C-N 125.012 1.445 . . . . 10.0 113.81 179.833 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -130.32 117.25 19.49 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 104.533 -2.395 . . . . 10.0 104.533 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 26.0 mm -122.8 112.86 35.78 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 N-CA-C 115.024 1.49 . . . . 10.0 115.024 179.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 3.2 mmt -130.67 178.25 6.78 Favored 'General case' 0 C--O 1.212 -0.876 0 CA-C-O 123.507 1.622 . . . . 10.0 108.372 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -151.59 107.53 3.4 Favored 'General case' 0 N--CA 1.437 -1.102 0 N-CA-C 101.929 -3.36 . . . . 10.0 101.929 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -107.73 174.31 5.94 Favored 'General case' 0 C--O 1.247 0.964 0 N-CA-C 116.854 2.168 . . . . 10.0 116.854 -179.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 5.7 mm100 -126.06 115.27 19.58 Favored 'General case' 0 N--CA 1.444 -0.743 0 N-CA-C 104.934 -2.247 . . . . 10.0 104.934 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 3.4 t -71.12 95.25 0.49 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.728 0 N-CA-C 109.218 -0.66 . . . . 10.0 109.218 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 112.29 55.74 0.46 Allowed Glycine 0 CA--C 1.532 1.131 0 C-N-CA 124.705 1.145 . . . . 10.0 115.46 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -174.06 121.9 0.3 Allowed 'General case' 0 C--O 1.236 0.388 0 C-N-CA 123.386 0.674 . . . . 10.0 112.562 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -56.08 135.81 52.65 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 124.521 1.128 . . . . 10.0 112.708 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -120.5 -174.66 2.85 Favored 'General case' 0 N--CA 1.437 -1.085 0 C-N-CA 124.165 0.986 . . . . 10.0 110.74 -179.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -148.9 66.72 1.04 Allowed 'General case' 0 C--N 1.312 -1.039 0 N-CA-C 108.149 -1.056 . . . . 10.0 108.149 179.639 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -51.4 118.39 3.26 Favored 'General case' 0 CA--C 1.509 -0.624 0 O-C-N 124.682 1.239 . . . . 10.0 111.529 179.776 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -71.54 -36.91 71.14 Favored 'General case' 0 C--N 1.318 -0.768 0 O-C-N 125.539 1.774 . . . . 10.0 110.544 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 19.4 mt 41.76 71.71 0.2 Allowed 'General case' 0 N--CA 1.441 -0.88 0 C-N-CA 124.813 1.245 . . . . 10.0 114.268 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -113.79 116.75 29.85 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 106.722 -1.584 . . . . 10.0 106.722 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 140.35 -67.84 0.49 Allowed Glycine 0 N--CA 1.444 -0.825 0 CA-C-O 118.778 -1.012 . . . . 10.0 111.361 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -111.14 147.15 15.35 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 N-CA-C 105.539 -2.022 . . . . 10.0 105.539 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 55.28 16.5 1.71 Allowed 'General case' 0 N--CA 1.443 -0.8 0 CA-C-O 116.019 -1.943 . . . . 10.0 113.414 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -2.35 68.41 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 118.062 2.615 . . . . 10.0 118.062 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.64 -163.43 1.37 Allowed 'General case' 0 N--CA 1.452 -0.337 0 O-C-N 119.936 -1.727 . . . . 10.0 111.868 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 2.1 tptp -153.18 147.64 25.98 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 102.998 -2.964 . . . . 10.0 102.998 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 5.7 p -158.84 140.6 13.55 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 122.395 1.093 . . . . 10.0 110.562 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.1 ttt -93.77 67.6 3.84 Favored 'General case' 0 N--CA 1.441 -0.895 0 N-CA-C 102.797 -3.038 . . . . 10.0 102.797 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' THR . . . . . 0.42 ' CG2' ' N ' ' A' ' 85' ' ' THR . 0.6 OUTLIER -50.89 166.21 0.09 Allowed 'General case' 0 N--CA 1.434 -1.263 0 CA-C-N 112.958 -1.928 . . . . 10.0 115.479 179.921 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.42 ' N ' ' CG2' ' A' ' 84' ' ' THR . 0.2 OUTLIER -164.27 106.05 0.89 Allowed 'General case' 0 N--CA 1.442 -0.842 0 N-CA-C 108.217 -1.031 . . . . 10.0 108.217 179.608 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 32.6 t -108.15 118.05 54.99 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.974 0 N-CA-C 103.237 -2.875 . . . . 10.0 103.237 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -124.65 149.44 47.13 Favored 'General case' 0 C--N 1.315 -0.895 0 O-C-N 124.786 1.304 . . . . 10.0 114.483 -179.868 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 4.0 t90 -85.4 127.88 34.53 Favored 'General case' 0 C--N 1.329 -0.319 0 O-C-N 121.567 -0.708 . . . . 10.0 110.055 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -92.24 -55.33 3.47 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 101.434 -3.543 . . . . 10.0 101.434 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 146.59 -76.87 0.26 Allowed Glycine 0 C--O 1.245 0.787 0 N-CA-C 107.691 -2.164 . . . . 10.0 107.691 179.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.0 -24.12 67.59 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 114.837 -0.681 . . . . 10.0 111.078 -179.768 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.33 168.08 23.51 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-O 122.249 1.023 . . . . 10.0 110.129 179.831 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -108.81 136.9 47.6 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 104.298 -2.482 . . . . 10.0 104.298 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -138.33 145.25 40.95 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 118.772 0.715 . . . . 10.0 110.199 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 6.7 m -123.03 159.98 27.27 Favored 'General case' 0 CA--C 1.505 -0.784 0 O-C-N 126.163 2.165 . . . . 10.0 114.129 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -159.02 128.75 0.75 Allowed 'Isoleucine or valine' 0 C--O 1.246 0.903 0 N-CA-C 105.134 -2.173 . . . . 10.0 105.134 -179.662 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.6 140.05 48.06 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 122.673 1.225 . . . . 10.0 110.998 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -86.92 179.69 6.67 Favored 'General case' 0 C--N 1.343 0.297 0 N-CA-C 115.013 1.486 . . . . 10.0 115.013 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 142.37 -157.01 26.44 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.972 -0.632 . . . . 10.0 112.281 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -89.03 -17.04 30.19 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 118.387 2.736 . . . . 10.0 118.387 179.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.414 ' HD3' ' N ' ' A' ' 101' ' ' LYS . 17.3 mmtt -81.96 179.55 7.78 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 115.203 1.557 . . . . 10.0 115.203 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -108.71 14.87 24.1 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 126.764 2.026 . . . . 10.0 113.004 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -148.24 -88.24 0.07 OUTLIER Glycine 0 C--N 1.342 0.914 0 CA-C-N 113.547 -1.661 . . . . 10.0 114.549 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 6.2 mtp180 31.71 92.17 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.808 0 O-C-N 126.912 2.183 . . . . 10.0 114.889 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 169.97 149.88 6.57 Favored Glycine 0 N--CA 1.441 -0.97 0 N-CA-C 110.085 -1.206 . . . . 10.0 110.085 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -112.26 168.08 9.91 Favored 'General case' 0 C--N 1.32 -0.679 0 O-C-N 120.64 -1.506 . . . . 10.0 109.257 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.7 m -151.01 120.06 6.7 Favored 'General case' 0 C--O 1.215 -0.72 0 N-CA-C 107.703 -1.221 . . . . 10.0 107.703 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -117.38 102.0 8.87 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 124.426 2.06 . . . . 10.0 114.738 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' TRP . . . . . 0.489 ' CD1' ' C ' ' A' ' 109' ' ' TRP . 0.0 OUTLIER -111.99 133.48 54.14 Favored 'General case' 0 C--O 1.217 -0.645 0 O-C-N 119.6 -1.938 . . . . 10.0 107.333 179.956 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.516 HD12 ' CE1' ' A' ' 4' ' ' PHE . 33.1 mt -98.93 142.13 15.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 O-C-N 126.603 2.439 . . . . 10.0 114.4 179.861 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -130.57 97.29 4.34 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 104.619 -2.363 . . . . 10.0 104.619 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 55.61 -118.13 10.04 Favored Glycine 0 C--O 1.221 -0.714 0 N-CA-C 109.721 -1.351 . . . . 10.0 109.721 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -92.4 12.72 21.76 Favored 'General case' 0 C--N 1.327 -0.392 0 O-C-N 126.06 1.682 . . . . 10.0 111.277 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -109.74 -179.18 3.74 Favored 'General case' 0 CA--C 1.513 -0.448 0 CA-C-O 117.701 -1.142 . . . . 10.0 111.234 179.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.504 HD22 ' CG ' ' A' ' 130' ' ' PHE . 2.3 tp -157.0 117.97 3.66 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 127.128 2.171 . . . . 10.0 106.725 179.749 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -104.47 121.21 42.96 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 106.367 -1.716 . . . . 10.0 106.367 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 10.8 tp -106.16 132.48 52.18 Favored 'General case' 0 C--N 1.315 -0.895 0 O-C-N 123.285 0.366 . . . . 10.0 111.101 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -119.25 100.53 7.38 Favored 'General case' 0 C--N 1.315 -0.893 0 O-C-N 125.149 1.531 . . . . 10.0 107.694 -179.664 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.516 ' HE1' ' CZ ' ' A' ' 19' ' ' TYR . 1.3 tmm? -109.55 136.67 48.55 Favored 'General case' 0 N--CA 1.444 -0.767 0 O-C-N 124.767 1.292 . . . . 10.0 109.372 -179.885 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -124.03 147.76 47.58 Favored 'General case' 0 C--N 1.315 -0.922 0 O-C-N 125.947 2.03 . . . . 10.0 113.172 179.756 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -156.17 131.49 9.41 Favored 'General case' 0 CA--C 1.501 -0.916 0 O-C-N 124.473 1.108 . . . . 10.0 109.314 179.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 47.42 29.5 1.35 Allowed 'General case' 0 C--N 1.319 -0.754 0 O-C-N 125.176 1.548 . . . . 10.0 114.409 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 93.6 -0.84 68.24 Favored Glycine 0 CA--C 1.528 0.881 0 N-CA-C 116.333 1.293 . . . . 10.0 116.333 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 21.2 t -107.21 158.9 7.0 Favored 'Isoleucine or valine' 0 C--O 1.242 0.676 0 N-CA-C 106.699 -1.593 . . . . 10.0 106.699 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -138.86 130.3 27.21 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 118.72 0.691 . . . . 10.0 111.94 -179.744 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 1.1 t -98.18 148.56 23.46 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 104.837 -2.282 . . . . 10.0 104.837 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 20.1 mtpt -126.83 111.48 14.24 Favored 'General case' 0 C--O 1.218 -0.605 0 O-C-N 125.491 1.744 . . . . 10.0 108.988 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -114.53 113.59 24.63 Favored 'General case' 0 N--CA 1.447 -0.622 0 O-C-N 127.287 2.867 . . . . 10.0 114.136 179.821 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 2.3 t -91.56 133.01 34.49 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.768 0 O-C-N 123.905 0.753 . . . . 10.0 109.043 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . 0.504 ' CG ' HD22 ' A' ' 115' ' ' LEU . 9.3 m-85 -121.58 177.62 5.16 Favored 'General case' 0 C--O 1.214 -0.802 0 C-N-CA 126.178 1.791 . . . . 10.0 107.259 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 4.9 ttpt -158.07 138.66 12.84 Favored 'General case' 0 N--CA 1.445 -0.715 0 O-C-N 126.281 2.238 . . . . 10.0 106.376 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 2.2 tttp -74.16 130.11 39.14 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 123.035 1.398 . . . . 10.0 108.692 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' VAL . . . . . 0.407 HG22 ' HB3' ' A' ' 9' ' ' LYS . 2.1 t -96.83 -0.69 10.52 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 CA-C-N 114.846 -1.07 . . . . 10.0 109.219 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.24 0.604 0 O-C-N 126.773 2.545 . . . . 10.0 108.778 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.541 0.62 0 N-CA-C 113.857 1.058 . . . . 10.0 113.857 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -56.82 -28.7 61.92 Favored 'General case' 0 C--O 1.222 -0.358 0 N-CA-C 117.869 2.544 . . . . 10.0 117.869 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.4 p30 -52.46 153.15 3.14 Favored 'General case' 0 N--CA 1.478 0.962 0 O-C-N 125.75 1.906 . . . . 10.0 113.673 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 148.06 -140.91 8.71 Favored Glycine 0 C--N 1.336 0.533 0 N-CA-C 116.659 1.423 . . . . 10.0 116.659 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -144.17 156.9 44.51 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 103.392 -2.818 . . . . 10.0 103.392 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.513 ' CD2' ' CD2' ' A' ' 115' ' ' LEU . 3.8 m0 -160.11 72.73 0.5 Allowed 'General case' 0 C--N 1.315 -0.897 0 O-C-N 126.313 2.258 . . . . 10.0 113.202 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.31 113.83 1.73 Allowed 'General case' 0 C--O 1.238 0.458 0 N-CA-C 107.21 -1.404 . . . . 10.0 107.21 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -68.32 146.31 53.4 Favored 'General case' 0 CA--C 1.512 -0.51 0 O-C-N 119.338 -2.101 . . . . 10.0 113.424 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.0 mt -103.98 -46.56 4.44 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.994 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.5 t -155.31 153.82 31.13 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 116.182 1.919 . . . . 10.0 116.182 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -120.37 115.12 22.9 Favored 'General case' 0 C--N 1.318 -0.789 0 O-C-N 127.059 2.725 . . . . 10.0 104.508 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -92.68 139.22 30.78 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 120.243 1.383 . . . . 10.0 112.923 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 8.2 m120 56.09 31.66 18.59 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 113.683 0.994 . . . . 10.0 113.683 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 22.0 t80 -67.5 -32.13 72.74 Favored 'General case' 0 CA--C 1.55 0.967 0 O-C-N 120.778 -1.201 . . . . 10.0 113.733 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.65 -37.43 42.06 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-O 122.729 1.252 . . . . 10.0 110.565 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.33 -20.22 60.18 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-O 123.897 1.808 . . . . 10.0 107.064 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.461 ' CD2' HD21 ' A' ' 20' ' ' LEU . 2.8 t80 -74.81 -39.26 61.78 Favored 'General case' 0 CA--C 1.553 1.093 0 CA-C-N 114.141 -1.391 . . . . 10.0 111.105 -179.66 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.461 HD21 ' CD2' ' A' ' 19' ' ' TYR . 4.0 mt -78.02 -21.13 51.22 Favored 'General case' 0 C--O 1.21 -0.987 0 O-C-N 125.152 1.532 . . . . 10.0 109.73 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 26.9 ttp180 -77.27 -24.13 51.11 Favored 'General case' 0 C--O 1.245 0.846 0 CA-C-N 114.015 -1.448 . . . . 10.0 109.101 179.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.22 -51.46 67.68 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 126.224 1.809 . . . . 10.0 113.731 -179.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -110.78 6.98 21.84 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 119.094 0.861 . . . . 10.0 112.001 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 50.57 80.77 0.07 Allowed 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.795 1.035 . . . . 10.0 113.795 179.568 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 8.7 p -99.09 39.69 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.808 0 CA-C-N 115.162 -0.926 . . . . 10.0 110.074 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 75.11 143.7 0.08 Allowed 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 117.151 2.278 . . . . 10.0 117.151 -179.48 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 63.3 t -75.4 -33.42 27.57 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 O-C-N 124.893 1.371 . . . . 10.0 114.647 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -71.51 -27.87 63.5 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 122.933 1.349 . . . . 10.0 111.223 179.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.3 tp -79.17 -34.65 42.91 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 123.685 0.794 . . . . 10.0 110.206 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 42.8 ttp85 -77.37 -30.86 53.97 Favored 'General case' 0 C--O 1.242 0.702 0 O-C-N 120.742 -1.224 . . . . 10.0 111.746 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.66 -39.5 80.64 Favored 'General case' 0 C--N 1.314 -0.947 0 C-N-CA 126.45 1.9 . . . . 10.0 109.38 179.715 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 80.1 mt -79.41 -57.16 5.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 O-C-N 125.284 1.615 . . . . 10.0 112.595 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -50.01 -31.79 13.71 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 115.127 1.528 . . . . 10.0 115.127 -179.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -61.05 -26.76 67.86 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 123.38 1.562 . . . . 10.0 113.377 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.425 ' CD2' ' N ' ' A' ' 35' ' ' LEU . 0.9 OUTLIER -97.17 -6.3 35.15 Favored 'General case' 0 C--N 1.323 -0.576 0 O-C-N 119.074 -2.266 . . . . 10.0 113.666 179.848 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 47.2 mt -96.64 109.03 21.73 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 124.933 1.395 . . . . 10.0 108.023 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 20.1 mttp -120.01 93.86 48.17 Favored Pre-proline 0 C--O 1.236 0.392 0 O-C-N 119.657 -1.902 . . . . 10.0 106.935 -179.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -69.41 172.1 12.9 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 125.205 3.937 . . . . 10.0 118.211 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -122.0 113.63 19.83 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 104.429 -2.434 . . . . 10.0 104.429 -179.825 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.411 ' HD3' ' CE2' ' A' ' 130' ' ' PHE . 3.1 mttm -81.26 138.17 35.77 Favored 'General case' 0 C--N 1.316 -0.883 0 O-C-N 120.752 -1.218 . . . . 10.0 112.431 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -128.32 107.62 9.91 Favored 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 103.783 -2.673 . . . . 10.0 103.783 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.6 mt -95.82 149.34 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 CA-C-O 123.573 1.654 . . . . 10.0 108.968 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -147.41 131.03 9.07 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 CA-C-O 123.92 1.819 . . . . 10.0 106.105 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -116.61 143.95 44.99 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 105.638 -1.986 . . . . 10.0 105.638 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -126.29 -66.65 0.91 Allowed 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 108.31 -0.996 . . . . 10.0 108.31 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -171.54 92.78 0.1 OUTLIER Glycine 0 CA--C 1.522 0.479 0 N-CA-C 107.82 -2.112 . . . . 10.0 107.82 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 60.89 19.29 9.59 Favored 'General case' 0 C--N 1.32 -0.686 0 O-C-N 121.72 -0.871 . . . . 10.0 109.663 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 5.9 m80 -137.88 78.18 1.67 Allowed 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 104.884 -2.265 . . . . 10.0 104.884 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.475 ' HB2' ' CG2' ' A' ' 66' ' ' VAL . 1.0 OUTLIER -78.3 126.27 30.54 Favored 'General case' 0 N--CA 1.441 -0.889 0 CA-C-N 114.114 -1.403 . . . . 10.0 112.133 179.925 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 76.3 mt -110.6 139.68 33.14 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.544 0 N-CA-C 107.872 -1.159 . . . . 10.0 107.872 -179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.8 mp -132.43 109.56 15.0 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 N-CA-C 105.629 -1.989 . . . . 10.0 105.629 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 36.7 mtt180 -106.15 116.15 31.44 Favored 'General case' 0 C--N 1.315 -0.904 0 O-C-N 126.802 2.564 . . . . 10.0 111.487 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.1 m -105.28 127.59 53.02 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 100.441 -3.911 . . . . 10.0 100.441 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 11.6 mt -117.29 98.28 6.35 Favored 'General case' 0 C--N 1.321 -0.662 1 N-CA-C 121.929 4.048 . . . . 10.0 121.929 179.772 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 82.7 p -108.72 138.75 44.54 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 126.926 2.09 . . . . 10.0 106.342 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -82.36 9.22 9.43 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 116.873 -1.537 . . . . 10.0 111.564 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 29.1 t80 -110.1 -46.62 3.43 Favored 'General case' 0 C--O 1.24 0.599 0 N-CA-C 108.27 -1.011 . . . . 10.0 108.27 -179.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 2.4 tpm_? -163.86 102.62 0.9 Allowed 'General case' 0 C--O 1.241 0.618 0 O-C-N 124.65 1.219 . . . . 10.0 111.93 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -76.05 170.09 16.94 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 120.737 -1.227 . . . . 10.0 111.435 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.459 ' CG ' ' O ' ' A' ' 60' ' ' TYR . 0.1 OUTLIER -151.44 56.19 0.87 Allowed 'General case' 0 C--O 1.214 -0.802 0 CA-C-O 125.088 2.375 . . . . 10.0 107.194 179.902 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.9 mm -39.79 134.15 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 O-C-N 120.429 -1.42 . . . . 10.0 114.593 -179.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -106.92 -178.06 3.54 Favored 'General case' 0 CA--C 1.513 -0.457 0 O-C-N 125.426 1.704 . . . . 10.0 107.345 -179.668 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -166.76 87.76 0.32 Allowed 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 101.878 -3.378 . . . . 10.0 101.878 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -93.2 164.87 13.08 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 116.249 1.944 . . . . 10.0 116.249 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.64 125.22 33.49 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 102.79 -3.041 . . . . 10.0 102.79 -179.715 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.475 ' CG2' ' HB2' ' A' ' 49' ' ' MET . 5.1 t -80.18 95.51 2.37 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 O-C-N 124.143 0.902 . . . . 10.0 112.803 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 102.8 39.8 2.64 Favored Glycine 0 CA--C 1.52 0.383 0 N-CA-C 114.99 0.756 . . . . 10.0 114.99 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -160.96 144.84 13.41 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 115.256 1.576 . . . . 10.0 115.256 -179.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -91.91 129.2 37.93 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 108.639 -0.874 . . . . 10.0 108.639 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 29.6 p90 -150.05 31.17 0.69 Allowed 'General case' 0 N--CA 1.439 -0.989 0 CA-C-O 116.113 -1.898 . . . . 10.0 113.413 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 12.6 pm0 36.18 84.53 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.773 0 O-C-N 126.243 2.215 . . . . 10.0 110.762 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -23.65 -43.51 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.959 0 O-C-N 126.764 2.54 . . . . 10.0 117.124 -179.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 73.29 89.68 0.09 Allowed 'General case' 0 C--O 1.224 -0.277 0 CA-C-N 113.223 -1.808 . . . . 10.0 109.871 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 8.6 mt -104.41 65.46 0.78 Allowed 'General case' 0 C--N 1.313 -0.988 0 O-C-N 121.145 -0.972 . . . . 10.0 112.798 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 11.0 p -107.99 33.22 4.22 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.447 -0.946 . . . . 10.0 108.447 179.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -116.98 -26.68 2.93 Favored Glycine 0 CA--C 1.509 -0.334 0 CA-C-O 117.617 -1.657 . . . . 10.0 113.277 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -132.11 -80.1 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.721 0 CA-C-N 119.202 1.501 . . . . 10.0 110.022 -179.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -87.52 36.85 0.76 Allowed 'General case' 0 N--CA 1.444 -0.768 0 CA-C-O 116.697 -1.621 . . . . 10.0 115.02 -179.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 25.0 t0 11.75 74.93 0.01 OUTLIER 'General case' 0 C--O 1.219 -0.501 0 O-C-N 126.283 2.24 . . . . 10.0 116.45 179.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.86 96.09 1.11 Allowed 'General case' 0 CA--C 1.508 -0.653 0 O-C-N 126.667 2.48 . . . . 10.0 114.299 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 11.1 ttpt -67.75 128.6 37.08 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 106.378 -1.712 . . . . 10.0 106.378 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 41.3 m -120.97 171.82 8.37 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 126.856 2.598 . . . . 10.0 108.159 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 18.5 mtt -95.54 107.35 19.52 Favored 'General case' 0 C--N 1.314 -0.977 1 N-CA-C 99.697 -4.186 . . . . 10.0 99.697 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 5.2 m -122.89 144.14 49.42 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 117.665 2.468 . . . . 10.0 117.665 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -136.52 125.61 24.49 Favored 'General case' 0 N--CA 1.441 -0.878 0 N-CA-C 107.661 -1.237 . . . . 10.0 107.661 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -100.1 149.62 5.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 N-CA-C 102.798 -3.038 . . . . 10.0 102.798 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -165.77 156.86 13.71 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 114.306 1.224 . . . . 10.0 114.306 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . 0.423 ' CZ3' HG11 ' A' ' 66' ' ' VAL . 0.0 OUTLIER -97.55 112.32 24.22 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 114.574 -1.194 . . . . 10.0 109.49 -179.829 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -118.8 85.03 2.29 Favored 'General case' 0 CA--C 1.532 0.288 1 N-CA-C 99.998 -4.075 . . . . 10.0 99.998 -179.774 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 92.93 -133.91 11.93 Favored Glycine 0 CA--C 1.498 -0.977 0 N-CA-C 105.308 -3.117 . . . . 10.0 105.308 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -104.43 35.17 2.81 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 122.841 0.457 . . . . 10.0 110.0 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 7.5 mtpt -128.18 172.33 11.1 Favored 'General case' 0 N--CA 1.463 0.18 0 O-C-N 126.506 2.379 . . . . 10.0 106.817 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -133.65 89.48 2.59 Favored 'General case' 0 C--N 1.323 -0.572 0 O-C-N 126.715 2.509 . . . . 10.0 107.275 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -76.16 154.99 34.97 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 116.465 -0.334 . . . . 10.0 110.828 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 3.3 m -144.27 133.74 23.34 Favored 'General case' 0 C--O 1.218 -0.587 0 O-C-N 126.212 2.195 . . . . 10.0 110.506 179.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -136.83 132.84 48.05 Favored 'Isoleucine or valine' 0 C--O 1.243 0.747 0 CA-C-N 113.42 -1.718 . . . . 10.0 107.395 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -118.54 121.1 39.42 Favored 'General case' 0 C--O 1.24 0.597 0 C-N-CA 124.36 1.064 . . . . 10.0 110.776 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 6.9 mttm -90.7 87.31 6.64 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 119.123 0.874 . . . . 10.0 109.979 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -131.11 75.55 0.42 Allowed Glycine 0 N--CA 1.438 -1.174 0 CA-C-O 116.458 -2.301 . . . . 10.0 114.082 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 28.04 39.74 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 117.549 2.426 . . . . 10.0 117.549 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 5.8 mmtt -131.46 160.01 36.41 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 115.31 1.596 . . . . 10.0 115.31 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -73.75 -37.95 64.88 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 112.676 -2.056 . . . . 10.0 108.829 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -135.78 134.0 6.97 Favored Glycine 0 C--O 1.222 -0.617 0 CA-C-O 117.201 -1.888 . . . . 10.0 113.681 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 173.72 106.07 0.01 OUTLIER 'General case' 0 N--CA 1.439 -0.983 0 O-C-N 124.91 1.006 . . . . 10.0 110.034 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 166.45 160.31 13.49 Favored Glycine 0 C--O 1.215 -1.063 0 N-CA-C 109.313 -1.515 . . . . 10.0 109.313 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 6.2 m0 -123.04 -179.65 4.35 Favored 'General case' 0 N--CA 1.442 -0.841 0 O-C-N 126.496 1.939 . . . . 10.0 109.268 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -164.47 151.55 11.46 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 104.163 -2.532 . . . . 10.0 104.163 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 3.4 tp-100 -140.32 151.98 45.48 Favored 'General case' 0 N--CA 1.444 -0.744 0 O-C-N 125.731 1.894 . . . . 10.0 108.808 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' TRP . . . . . 0.458 ' CD1' ' C ' ' A' ' 109' ' ' TRP . 0.0 OUTLIER -167.34 137.39 2.88 Favored 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 125.156 1.382 . . . . 10.0 107.529 179.977 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 33.6 mt -96.92 114.98 35.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 118.624 2.824 . . . . 10.0 118.624 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -95.97 161.75 13.86 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 102.645 -3.094 . . . . 10.0 102.645 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -57.75 106.25 0.75 Allowed Glycine 0 N--CA 1.443 -0.843 0 CA-C-O 118.571 -1.127 . . . . 10.0 110.835 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 69.34 11.76 8.18 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 126.133 1.725 . . . . 10.0 112.701 -179.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -151.86 120.57 6.53 Favored 'General case' 0 CA--C 1.499 -0.989 0 CA-C-O 124.712 2.196 . . . . 10.0 114.559 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.513 ' CD2' ' CD2' ' A' ' 8' ' ' TRP . 2.9 tp -78.07 138.06 38.57 Favored 'General case' 0 C--N 1.319 -0.717 0 CA-C-N 113.903 -1.498 . . . . 10.0 107.52 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -117.81 112.01 19.83 Favored 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 106.601 -1.629 . . . . 10.0 106.601 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 6.9 tp -122.65 131.83 53.99 Favored 'General case' 0 C--N 1.315 -0.921 0 C-N-CA 124.952 1.301 . . . . 10.0 107.922 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -135.81 151.93 50.57 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 106.183 -1.784 . . . . 10.0 106.183 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -156.39 160.42 39.63 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.328 -0.851 . . . . 10.0 109.641 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 3.4 mtm180 -138.82 179.55 6.42 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 117.289 -1.338 . . . . 10.0 114.042 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -173.62 132.5 0.45 Allowed 'General case' 0 CA--C 1.499 -1.016 0 O-C-N 125.269 1.606 . . . . 10.0 106.734 179.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 35.56 60.46 0.75 Allowed 'General case' 0 N--CA 1.475 0.821 0 O-C-N 126.669 2.481 . . . . 10.0 116.661 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 64.52 10.33 42.63 Favored Glycine 0 N--CA 1.444 -0.813 0 C-N-CA 123.877 0.751 . . . . 10.0 113.091 179.601 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 14.9 t -107.81 151.42 9.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 CA-C-N 118.958 1.379 . . . . 10.0 108.203 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 3.1 m -121.85 140.01 52.92 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 122.648 1.213 . . . . 10.0 112.279 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -137.77 175.23 9.77 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 113.165 -1.834 . . . . 10.0 106.466 -179.749 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 177.74 163.33 0.6 Allowed 'General case' 0 C--O 1.24 0.553 0 O-C-N 123.973 0.795 . . . . 10.0 111.309 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -131.01 133.51 45.83 Favored 'General case' 0 CA--C 1.5 -0.961 0 CA-C-N 115.708 -0.678 . . . . 10.0 111.461 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 55.5 t -100.21 90.56 1.94 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.43 0 C-N-CA 124.675 1.19 . . . . 10.0 109.68 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . 0.434 ' HB2' ' HB3' ' A' ' 115' ' ' LEU . 13.4 m-30 -81.96 166.57 19.74 Favored 'General case' 0 N--CA 1.442 -0.85 0 CA-C-O 122.557 1.17 . . . . 10.0 111.31 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.23 127.14 16.36 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 106.318 -1.734 . . . . 10.0 106.318 179.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 8.6 tttp -77.55 142.98 38.72 Favored 'General case' 0 CA--C 1.504 -0.807 0 N-CA-C 106.376 -1.713 . . . . 10.0 106.376 179.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 10.4 p -97.03 -14.26 7.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 119.369 0.986 . . . . 10.0 111.978 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 12.0 t-80 . . . . . 0 C--N 1.314 -0.946 0 O-C-N 126.315 2.259 . . . . 10.0 110.87 -179.958 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 . . . . . 0 C--O 1.239 0.52 0 N-CA-C 113.89 1.07 . . . . 10.0 113.89 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.462 ' CE1' HD12 ' A' ' 110' ' ' ILE . 14.9 m-85 -85.45 24.32 1.2 Allowed 'General case' 0 C--O 1.243 0.719 0 O-C-N 121.119 -0.988 . . . . 10.0 111.759 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 13.2 m-80 -55.92 125.51 21.74 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 120.909 -1.12 . . . . 10.0 111.762 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 159.26 -163.38 33.35 Favored Glycine 0 C--O 1.214 -1.132 0 C-N-CA 117.963 -2.065 . . . . 10.0 116.409 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -122.7 173.26 7.84 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 105.058 -2.201 . . . . 10.0 105.058 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.46 ' CE3' HD13 ' A' ' 115' ' ' LEU . 1.1 m0 -169.56 98.58 0.33 Allowed 'General case' 0 N--CA 1.445 -0.698 0 O-C-N 125.306 1.629 . . . . 10.0 114.782 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.53 146.95 28.06 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 104.362 -2.458 . . . . 10.0 104.362 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.413 ' HB2' ' HE1' ' A' ' 10' ' ' MET . 0.0 OUTLIER -93.39 132.4 37.67 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 117.554 -1.658 . . . . 10.0 114.447 179.794 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -80.92 -54.98 5.1 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 113.731 -1.577 . . . . 10.0 110.07 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 33.9 m -156.47 130.79 8.68 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 115.598 1.703 . . . . 10.0 115.598 -179.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 5.1 p30 -116.18 171.36 7.86 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 112.534 -2.121 . . . . 10.0 105.521 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -136.57 -56.51 0.74 Allowed 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 116.703 2.112 . . . . 10.0 116.703 -179.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -92.96 51.05 1.62 Allowed 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 114.029 1.122 . . . . 10.0 114.029 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 27.9 t80 -71.72 -49.58 38.05 Favored 'General case' 0 C--O 1.243 0.761 0 CA-C-O 117.219 -1.372 . . . . 10.0 112.861 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.407 ' OE2' ' ND2' ' A' ' 34' ' ' ASN . 1.7 mp0 -72.66 -39.09 67.39 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 114.362 1.245 . . . . 10.0 114.362 -179.766 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.94 -24.7 63.39 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 121.831 0.824 . . . . 10.0 110.871 -179.816 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -74.63 -42.8 57.92 Favored 'General case' 0 C--N 1.319 -0.756 0 O-C-N 120.292 -1.505 . . . . 10.0 107.803 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 45.7 mt -75.92 -20.13 58.23 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-O 123.408 1.575 . . . . 10.0 109.64 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -79.7 -29.1 40.61 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 107.577 -1.268 . . . . 10.0 107.577 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.82 -23.23 64.24 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 120.427 -1.421 . . . . 10.0 111.977 -179.61 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 85.2 mt -102.42 -21.92 14.17 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 118.247 -0.882 . . . . 10.0 111.394 179.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 50.0 m-20 70.86 63.85 0.18 Allowed 'General case' 0 C--O 1.247 0.935 0 O-C-N 126.965 2.666 . . . . 10.0 114.561 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -93.1 167.22 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 106.203 -1.777 . . . . 10.0 106.203 179.811 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 43.9 t30 -43.67 159.02 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 117.154 2.279 . . . . 10.0 117.154 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.4 t -77.19 -40.92 30.33 Favored 'Isoleucine or valine' 0 C--O 1.232 0.158 0 CA-C-N 113.057 -1.883 . . . . 10.0 112.791 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.75 -33.9 71.29 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.212 -0.904 . . . . 10.0 111.798 -179.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 10.5 tt -72.31 -26.94 62.15 Favored 'General case' 0 C--O 1.218 -0.585 0 CA-C-N 115.662 -0.699 . . . . 10.0 111.969 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.1 -31.35 62.76 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 125.024 1.33 . . . . 10.0 110.535 179.703 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 30.4 tttp -78.24 -41.28 34.7 Favored 'General case' 0 N--CA 1.447 -0.606 0 O-C-N 123.735 0.647 . . . . 10.0 112.736 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 40.2 mt -75.46 -44.48 41.43 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.321 0 O-C-N 124.048 0.843 . . . . 10.0 111.623 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -63.12 -22.57 66.95 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.267 -0.879 . . . . 10.0 113.034 -179.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.407 ' ND2' ' OE2' ' A' ' 17' ' ' GLU . 49.4 t30 -81.25 -5.35 57.68 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 113.934 1.087 . . . . 10.0 113.934 179.761 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.5 13.05 36.16 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-O 116.711 -1.614 . . . . 10.0 112.859 -179.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -137.14 172.98 12.2 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 119.557 1.071 . . . . 10.0 110.184 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -127.94 102.29 22.15 Favored Pre-proline 0 C--O 1.24 0.601 0 N-CA-C 104.853 -2.277 . . . . 10.0 104.853 -179.593 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -57.56 87.57 0.05 OUTLIER 'Trans proline' 0 C--O 1.221 -0.374 0 N-CA-C 116.947 1.864 . . . . 10.0 116.947 179.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -61.55 152.57 30.0 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 122.165 0.983 . . . . 10.0 108.819 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -108.75 156.39 19.67 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.038 -1.437 . . . . 10.0 110.335 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -149.62 103.05 3.22 Favored 'General case' 0 N--CA 1.439 -1.007 0 N-CA-C 103.477 -2.786 . . . . 10.0 103.477 -179.866 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 5.0 mt -101.66 133.99 43.43 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 CA-C-N 115.586 -0.734 . . . . 10.0 111.885 179.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 47.2 t -136.66 90.62 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.883 0 N-CA-C 105.265 -2.124 . . . . 10.0 105.265 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 21.8 tt0 -90.0 126.76 35.87 Favored 'General case' 0 C--N 1.313 -0.983 0 O-C-N 125.6 1.813 . . . . 10.0 109.288 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -95.71 -22.48 17.52 Favored 'General case' 0 C--N 1.319 -0.747 0 O-C-N 120.571 -1.331 . . . . 10.0 108.829 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 140.34 -126.49 3.2 Favored Glycine 0 CA--C 1.534 1.243 0 N-CA-C 105.943 -2.863 . . . . 10.0 105.943 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -47.25 -30.75 3.23 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 119.737 1.769 . . . . 10.0 111.672 -179.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 40.7 m170 -102.37 128.46 48.94 Favored 'General case' 0 N--CA 1.444 -0.766 0 O-C-N 120.037 -1.664 . . . . 10.0 106.571 179.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 31.7 ttm -122.2 142.11 50.77 Favored 'General case' 0 N--CA 1.437 -1.102 0 O-C-N 119.698 -1.876 . . . . 10.0 112.374 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 10.1 mt -131.33 121.85 49.62 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.068 0 N-CA-C 107.383 -1.339 . . . . 10.0 107.383 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mp -116.16 125.98 73.46 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 N-CA-C 104.985 -2.228 . . . . 10.0 104.985 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.9 mtt85 -120.16 94.96 4.56 Favored 'General case' 0 C--O 1.214 -0.766 0 O-C-N 126.069 2.106 . . . . 10.0 109.074 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.8 m -83.16 113.5 20.68 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 101.323 -3.584 . . . . 10.0 101.323 -179.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 6.6 mp -102.74 93.97 5.37 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 118.267 2.691 . . . . 10.0 118.267 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -100.21 132.0 45.83 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 104.413 -2.439 . . . . 10.0 104.413 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 8.4 p -46.88 -28.57 1.63 Allowed 'General case' 0 CA--C 1.545 0.776 0 O-C-N 125.252 1.595 . . . . 10.0 109.041 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -106.01 99.79 9.36 Favored 'General case' 0 C--O 1.245 0.817 0 C-N-CA 125.048 1.339 . . . . 10.0 110.446 -179.609 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 67.79 149.74 0.06 Allowed 'General case' 0 C--N 1.321 -0.659 0 O-C-N 126.697 2.498 . . . . 10.0 110.743 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -108.73 150.37 27.68 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 113.594 -1.639 . . . . 10.0 110.785 179.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 6.5 t80 -137.59 84.67 2.06 Favored 'General case' 0 N--CA 1.434 -1.244 0 CA-C-N 114.035 -1.438 . . . . 10.0 107.468 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -102.99 157.33 4.94 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-N 120.492 1.496 . . . . 10.0 112.488 179.821 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 2.4 mtp -134.82 158.97 42.83 Favored 'General case' 0 C--N 1.32 -0.686 0 O-C-N 126.378 2.299 . . . . 10.0 107.826 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -145.55 95.84 2.72 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 100.79 -3.782 . . . . 10.0 100.79 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.426 ' CD2' HG21 ' A' ' 86' ' ' VAL . 8.6 m-30 -116.87 163.38 16.28 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 117.026 2.232 . . . . 10.0 117.026 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 82.2 mt-30 -117.23 116.33 27.05 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 103.611 -2.737 . . . . 10.0 103.611 179.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.9 t -66.95 138.99 21.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 124.025 1.869 . . . . 10.0 109.483 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 66.06 24.39 71.73 Favored Glycine 0 C--N 1.336 0.553 0 CA-C-N 114.081 -1.418 . . . . 10.0 113.818 179.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 11.7 mttt -141.41 158.22 44.15 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 118.417 -1.313 . . . . 10.0 113.389 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -72.74 167.88 19.94 Favored 'General case' 0 C--N 1.316 -0.885 0 O-C-N 124.87 1.357 . . . . 10.0 109.145 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -157.48 -175.28 5.31 Favored 'General case' 0 C--O 1.247 0.941 0 C-N-CA 124.482 1.113 . . . . 10.0 110.547 -179.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -163.14 127.51 2.96 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 105.304 -2.11 . . . . 10.0 105.304 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -120.17 169.51 10.17 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 114.913 -1.039 . . . . 10.0 113.543 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -100.22 -15.24 18.17 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 107.258 -1.386 . . . . 10.0 107.258 179.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.415 ' HA ' ' HB2' ' A' ' 79' ' ' ASP . 3.3 pp -141.72 -174.64 4.12 Favored 'General case' 0 C--N 1.314 -0.954 0 O-C-N 125.495 1.747 . . . . 10.0 114.706 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.422 HG21 ' HA ' ' A' ' 79' ' ' ASP . 0.5 OUTLIER -141.88 -76.1 0.29 Allowed 'General case' 0 C--O 1.218 -0.582 0 N-CA-C 106.899 -1.519 . . . . 10.0 106.899 179.829 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -130.78 76.33 0.41 Allowed Glycine 0 C--O 1.238 0.37 0 CA-C-O 119.702 -0.499 . . . . 10.0 112.273 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 19.5 mt 64.63 -71.22 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.714 0 CA-C-O 118.262 -0.875 . . . . 10.0 109.928 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -45.25 -29.81 1.08 Allowed 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 124.917 1.287 . . . . 10.0 110.536 -179.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . 0.422 ' HA ' HG21 ' A' ' 75' ' ' THR . 2.8 p30 56.25 168.77 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 129.386 3.074 . . . . 10.0 118.595 179.348 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.9 ttm-85 169.03 118.23 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 116.107 -1.902 . . . . 10.0 108.134 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 23.3 mtpt -47.52 121.19 3.76 Favored 'General case' 0 C--N 1.314 -0.973 0 O-C-N 125.336 1.648 . . . . 10.0 107.583 -179.545 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -133.93 170.61 15.36 Favored 'General case' 0 C--N 1.315 -0.901 0 O-C-N 125.933 2.021 . . . . 10.0 109.696 179.868 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 4.3 mtp -126.75 98.43 5.37 Favored 'General case' 0 N--CA 1.44 -0.964 1 N-CA-C 100.063 -4.051 . . . . 10.0 100.063 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 26.1 m -99.94 131.24 46.03 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 124.371 2.034 . . . . 10.0 114.762 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 1.2 m -115.88 128.93 56.18 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 112.773 -2.012 . . . . 10.0 107.032 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.426 HG21 ' CD2' ' A' ' 64' ' ' PHE . 2.2 t -106.2 127.32 61.51 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.929 0 N-CA-C 103.384 -2.821 . . . . 10.0 103.384 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.2 t -151.13 147.11 26.65 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 123.143 1.449 . . . . 10.0 111.547 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 2.2 p-90 -95.75 130.4 42.68 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 105.589 -2.004 . . . . 10.0 105.589 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -78.3 -51.17 10.53 Favored 'General case' 0 C--O 1.247 0.93 1 N-CA-C 99.904 -4.11 . . . . 10.0 99.904 179.888 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -157.25 -76.55 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.445 0 N-CA-C 108.192 -1.963 . . . . 10.0 108.192 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -114.48 19.05 16.45 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 115.103 1.52 . . . . 10.0 115.103 179.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 9.0 mttm -129.98 -171.96 2.66 Favored 'General case' 0 C--O 1.244 0.792 0 CA-C-O 118.24 -0.886 . . . . 10.0 108.725 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.3 tt -137.34 131.92 32.86 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 104.57 -2.382 . . . . 10.0 104.57 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -137.43 -173.62 3.53 Favored 'General case' 0 C--O 1.219 -0.508 0 N-CA-C 114.78 1.4 . . . . 10.0 114.78 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 1.1 m -156.33 137.28 13.53 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 118.817 0.735 . . . . 10.0 110.156 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 3.7 t -95.8 -52.83 8.9 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 N-CA-C 106.845 -1.539 . . . . 10.0 106.845 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 1.9 mm-40 71.44 114.37 0.05 Allowed 'General case' 0 C--O 1.244 0.809 0 C-N-CA 127.395 2.278 . . . . 10.0 109.572 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 13.4 mttt -97.21 74.58 2.54 Favored 'General case' 0 C--N 1.343 0.306 0 CA-C-O 116.756 -1.593 . . . . 10.0 112.41 -179.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -107.5 -93.22 2.29 Favored Glycine 0 N--CA 1.451 -0.305 0 O-C-N 125.473 1.733 . . . . 10.0 109.967 179.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -167.55 -39.01 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 117.553 2.427 . . . . 10.0 117.553 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.05 146.34 11.43 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 113.808 1.04 . . . . 10.0 113.808 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -78.82 83.37 4.95 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 125.08 1.352 . . . . 10.0 112.341 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 142.23 -1.75 1.71 Allowed Glycine 0 C--O 1.219 -0.802 0 O-C-N 126.516 2.385 . . . . 10.0 115.544 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 23.7 mtt180 -52.63 161.81 0.66 Allowed 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 118.572 1.186 . . . . 10.0 112.835 -179.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 107.65 152.88 17.82 Favored Glycine 0 C--O 1.224 -0.485 0 CA-C-N 112.522 -2.126 . . . . 10.0 110.562 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' TRP . . . . . 0.423 ' CD1' ' N ' ' A' ' 106' ' ' TRP . 0.0 OUTLIER -117.39 179.28 4.09 Favored 'General case' 0 C--N 1.33 -0.249 0 O-C-N 120.198 -1.766 . . . . 10.0 110.246 179.909 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -153.51 99.08 2.3 Favored 'General case' 0 CA--C 1.503 -0.839 0 O-C-N 124.748 1.28 . . . . 10.0 108.517 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 62.4 mt-30 -98.49 147.41 24.78 Favored 'General case' 0 C--O 1.239 0.52 0 O-C-N 126.564 2.415 . . . . 10.0 112.309 -179.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -169.41 128.76 1.01 Allowed 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 105.966 -1.864 . . . . 10.0 105.966 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.462 HD12 ' CE1' ' A' ' 4' ' ' PHE . 69.5 mt -88.56 160.28 2.86 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.802 0 N-CA-C 116.894 2.183 . . . . 10.0 116.894 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -139.28 63.04 1.51 Allowed 'General case' 0 N--CA 1.463 0.194 0 O-C-N 126.36 2.287 . . . . 10.0 106.474 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 72.89 -98.64 0.88 Allowed Glycine 0 CA--C 1.531 1.036 0 N-CA-C 107.928 -2.069 . . . . 10.0 107.928 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -108.13 19.63 19.71 Favored 'General case' 0 C--N 1.321 -0.655 0 O-C-N 121.453 -1.028 . . . . 10.0 113.078 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -128.86 95.8 4.19 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 120.554 -1.341 . . . . 10.0 111.071 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.46 HD13 ' CE3' ' A' ' 8' ' ' TRP . 0.2 OUTLIER -64.89 120.1 11.91 Favored 'General case' 0 C--N 1.319 -0.738 0 O-C-N 121.123 -0.985 . . . . 10.0 109.677 -179.838 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 5.0 t60 -109.97 103.28 12.01 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 107.083 -1.451 . . . . 10.0 107.083 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -110.09 115.94 30.66 Favored 'General case' 0 C--N 1.321 -0.653 0 O-C-N 125.237 1.586 . . . . 10.0 109.11 -179.853 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -108.83 90.99 3.46 Favored 'General case' 0 CA--C 1.507 -0.711 0 N-CA-C 105.408 -2.071 . . . . 10.0 105.408 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -78.01 154.93 31.03 Favored 'General case' 0 N--CA 1.443 -0.823 0 C-N-CA 126.336 1.854 . . . . 10.0 111.15 179.776 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -136.98 137.62 39.68 Favored 'General case' 0 C--N 1.319 -0.734 0 O-C-N 126.027 2.079 . . . . 10.0 113.809 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -160.91 129.97 4.72 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 116.362 -1.78 . . . . 10.0 109.291 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 40.23 49.42 2.46 Favored 'General case' 0 C--O 1.241 0.647 0 N-CA-C 115.639 1.718 . . . . 10.0 115.639 -179.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 70.49 16.87 74.1 Favored Glycine 0 CA--C 1.538 1.512 0 CA-C-O 115.945 -2.586 . . . . 10.0 115.847 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 4.0 m -108.1 169.45 3.04 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 O-C-N 125.723 1.484 . . . . 10.0 108.698 179.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 2.7 m -136.39 91.08 2.63 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.98 -0.554 . . . . 10.0 111.573 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 26.2 t -95.23 99.62 11.55 Favored 'General case' 0 C--O 1.216 -0.66 0 N-CA-C 105.691 -1.966 . . . . 10.0 105.691 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.33 151.01 22.4 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 114.055 -1.429 . . . . 10.0 109.564 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 14.1 mt-30 -144.4 125.5 14.53 Favored 'General case' 0 C--N 1.315 -0.911 0 O-C-N 126.136 2.147 . . . . 10.0 113.462 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 19.4 t -91.03 114.4 28.31 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 107.077 -1.453 . . . . 10.0 107.077 -179.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . 0.432 ' HB3' ' CD1' ' A' ' 8' ' ' TRP . 89.5 m-85 -101.99 177.21 4.96 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.661 -0.866 . . . . 10.0 108.661 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -148.17 120.06 8.16 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 106.339 -1.726 . . . . 10.0 106.339 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -79.64 125.58 29.81 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 117.86 -1.536 . . . . 10.0 107.632 -179.619 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 18.3 t -82.61 -66.18 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-O 117.934 -1.031 . . . . 10.0 109.996 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.255 1.364 0 O-C-N 125.289 1.618 . . . . 10.0 109.711 179.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 . . . . . 0 C--O 1.237 0.4 0 N-CA-C 112.59 0.589 . . . . 10.0 112.59 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.424 ' CZ ' HD11 ' A' ' 110' ' ' ILE . 0.2 OUTLIER 68.1 -28.97 0.15 Allowed 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 117.296 2.332 . . . . 10.0 117.296 179.971 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -37.39 115.14 0.38 Allowed 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 116.499 2.037 . . . . 10.0 116.499 179.695 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -176.16 164.19 33.98 Favored Glycine 0 CA--C 1.527 0.808 0 N-CA-C 117.384 1.714 . . . . 10.0 117.384 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 16.9 m-30 -94.96 141.92 28.08 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 101.138 -3.653 . . . . 10.0 101.138 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.434 ' CE3' ' HB2' ' A' ' 115' ' ' LEU . 57.8 m95 -134.82 85.73 2.2 Favored 'General case' 0 C--N 1.313 -1.0 0 O-C-N 126.012 2.07 . . . . 10.0 111.591 179.726 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.06 149.39 27.82 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 104.912 -2.255 . . . . 10.0 104.912 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.434 ' HE1' ' CZ ' ' A' ' 130' ' ' PHE . 27.4 ttm -99.93 150.09 22.76 Favored 'General case' 0 N--CA 1.444 -0.748 0 N-CA-C 115.171 1.545 . . . . 10.0 115.171 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.8 mp -108.71 -64.71 1.2 Allowed 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 113.394 -1.73 . . . . 10.0 107.281 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -156.42 154.61 30.74 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 117.023 2.231 . . . . 10.0 117.023 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -113.8 165.79 12.21 Favored 'General case' 0 CA--C 1.509 -0.616 0 O-C-N 128.406 3.566 . . . . 10.0 109.154 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -142.37 138.06 30.92 Favored 'General case' 0 C--O 1.24 0.565 0 O-C-N 120.659 -1.275 . . . . 10.0 112.962 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 60.79 17.71 7.94 Favored 'General case' 0 C--O 1.247 0.959 0 CA-C-O 124.737 2.208 . . . . 10.0 115.686 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -52.24 -50.48 61.94 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 116.607 -3.808 . . . . 10.0 115.966 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 59.7 mt-10 -63.33 -30.43 71.57 Favored 'General case' 0 C--O 1.219 -0.535 0 N-CA-C 114.748 1.388 . . . . 10.0 114.748 179.496 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -79.87 -28.99 39.92 Favored 'General case' 0 C--N 1.328 -0.361 0 O-C-N 127.022 2.701 . . . . 10.0 109.989 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -65.5 -53.26 44.95 Favored 'General case' 0 C--N 1.317 -0.823 0 O-C-N 124.209 0.943 . . . . 10.0 111.369 179.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 12.8 mt -65.45 -21.7 66.68 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 114.091 1.145 . . . . 10.0 114.091 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -71.18 -31.41 67.62 Favored 'General case' 0 C--N 1.317 -0.81 0 C-N-CA 124.316 1.046 . . . . 10.0 110.534 -179.776 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.68 -48.64 79.89 Favored 'General case' 0 CA--C 1.531 0.24 0 O-C-N 125.204 1.565 . . . . 10.0 113.396 179.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -90.76 -12.3 36.96 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.406 -1.27 . . . . 10.0 109.167 179.906 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.2 t0 55.83 57.82 4.91 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 114.512 -1.222 . . . . 10.0 113.529 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 14.5 m -73.37 -164.8 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-N 114.703 -1.135 . . . . 10.0 109.123 -179.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -64.17 140.83 58.91 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 116.232 1.938 . . . . 10.0 116.232 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.4 p -60.15 -39.14 79.67 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.945 0 C-N-CA 126.188 1.795 . . . . 10.0 115.775 179.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.63 -21.16 64.49 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 114.16 -1.382 . . . . 10.0 111.043 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.41 -43.18 23.87 Favored 'General case' 0 C--O 1.218 -0.603 0 O-C-N 124.773 1.296 . . . . 10.0 110.719 -179.762 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.5 ttm180 -59.58 -34.12 72.31 Favored 'General case' 0 C--O 1.243 0.763 0 C-N-CA 125.709 1.604 . . . . 10.0 114.291 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.0 ttpt -75.89 -46.73 28.6 Favored 'General case' 0 N--CA 1.438 -1.032 0 O-C-N 125.715 1.885 . . . . 10.0 112.659 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 7.8 mm -76.19 -39.36 35.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 O-C-N 121.427 -0.796 . . . . 10.0 111.451 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -63.64 -24.23 67.71 Favored 'General case' 0 C--O 1.215 -0.752 0 N-CA-C 115.732 1.752 . . . . 10.0 115.732 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -65.32 -56.54 12.06 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 119.522 -0.871 . . . . 10.0 109.903 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.5 pp -79.89 0.87 29.38 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 113.031 0.752 . . . . 10.0 113.031 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 12.3 tp -105.68 125.1 50.6 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 124.451 1.094 . . . . 10.0 108.728 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.56 103.06 53.08 Favored Pre-proline 0 C--N 1.316 -0.862 0 CA-C-N 120.463 1.483 . . . . 10.0 109.582 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -70.59 112.41 3.22 Favored 'Trans proline' 0 C--N 1.354 0.826 0 CA-C-O 123.906 1.544 . . . . 10.0 114.516 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -71.5 169.61 15.07 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 114.407 -1.27 . . . . 10.0 109.443 -179.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.6 mtmt -136.58 153.21 51.03 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-O 122.575 1.178 . . . . 10.0 112.527 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -142.1 115.35 8.89 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 103.003 -2.962 . . . . 10.0 103.003 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.414 HD12 ' NE1' ' A' ' 8' ' ' TRP . 61.7 mt -100.49 147.65 7.58 Favored 'Isoleucine or valine' 0 C--O 1.247 0.925 0 N-CA-C 108.757 -0.831 . . . . 10.0 108.757 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.5 t -147.96 130.32 7.05 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.836 0 N-CA-C 105.727 -1.953 . . . . 10.0 105.727 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -132.56 151.98 51.75 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 122.68 1.229 . . . . 10.0 109.667 -179.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -149.82 100.47 2.96 Favored 'General case' 0 N--CA 1.444 -0.763 0 N-CA-C 106.876 -1.528 . . . . 10.0 106.876 179.841 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.17 -115.49 4.04 Favored Glycine 0 C--N 1.345 1.045 0 N-CA-C 109.056 -1.618 . . . . 10.0 109.056 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -119.12 18.46 13.09 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 108.62 -0.882 . . . . 10.0 108.62 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 7.6 t-160 -107.85 122.24 46.39 Favored 'General case' 0 CA--C 1.508 -0.671 0 N-CA-C 106.601 -1.629 . . . . 10.0 106.601 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 4.1 ttt -109.68 134.43 51.98 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 114.333 1.234 . . . . 10.0 114.333 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 7.1 mt -118.63 98.79 6.85 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.994 0 N-CA-C 107.751 -1.204 . . . . 10.0 107.751 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.0 mp -89.0 131.37 36.5 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.969 0 N-CA-C 105.527 -2.027 . . . . 10.0 105.527 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 22.0 mtm180 -129.31 133.96 47.7 Favored 'General case' 0 C--O 1.215 -0.745 0 N-CA-C 113.506 0.928 . . . . 10.0 113.506 -179.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 54.1 m -114.13 99.37 7.58 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 101.048 -3.686 . . . . 10.0 101.048 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 8.4 mt -99.41 133.22 44.04 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 120.194 3.405 . . . . 10.0 120.194 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -158.33 155.26 28.46 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 126.679 1.992 . . . . 10.0 105.683 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 7.0 t -87.05 -1.96 58.27 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 105.753 -1.943 . . . . 10.0 105.753 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -124.49 102.41 7.63 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 105.27 -2.122 . . . . 10.0 105.27 179.761 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 63.85 129.83 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 125.434 2.54 . . . . 10.0 110.825 179.799 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -150.28 157.24 42.86 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-O 125.15 2.405 . . . . 10.0 110.376 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 32.3 p90 -152.25 139.74 19.62 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 104.743 -2.317 . . . . 10.0 104.743 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.0 mp -130.87 139.64 50.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 O-C-N 125.299 1.625 . . . . 10.0 111.443 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 5.0 ptp -115.89 179.78 3.88 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 127.322 2.249 . . . . 10.0 104.975 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -157.08 102.93 1.99 Allowed 'General case' 0 N--CA 1.441 -0.876 0 N-CA-C 102.575 -3.12 . . . . 10.0 102.575 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -114.47 160.67 18.94 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 117.696 2.48 . . . . 10.0 117.696 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 5.6 mm-40 -116.31 152.01 34.71 Favored 'General case' 0 C--O 1.216 -0.706 0 N-CA-C 107.734 -1.21 . . . . 10.0 107.734 179.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 14.7 t -95.19 115.9 35.25 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 CA-C-O 123.492 1.615 . . . . 10.0 111.062 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 79.41 23.94 61.91 Favored Glycine 0 C--O 1.224 -0.481 0 CA-C-N 113.943 -1.481 . . . . 10.0 113.729 179.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.86 145.08 51.33 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 123.346 0.658 . . . . 10.0 111.145 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 66.5 tt0 -68.95 165.17 20.58 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 107.56 -1.274 . . . . 10.0 107.56 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -160.26 131.44 5.76 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 122.741 1.258 . . . . 10.0 112.465 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -96.24 67.52 2.56 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.514 -1.221 . . . . 10.0 109.916 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 57.1 tt0 -58.79 125.11 22.13 Favored 'General case' 0 N--CA 1.442 -0.865 0 O-C-N 126.798 2.561 . . . . 10.0 115.985 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -111.61 105.11 13.56 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-O 122.853 1.311 . . . . 10.0 108.337 179.729 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 20.9 mt -80.53 137.39 36.42 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 114.752 -1.113 . . . . 10.0 113.587 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 53.8 p -120.2 105.38 10.91 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 106.155 -1.794 . . . . 10.0 106.155 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 98.79 -169.39 23.17 Favored Glycine 0 C--O 1.243 0.69 0 CA-C-O 117.171 -1.905 . . . . 10.0 108.98 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER 39.64 54.11 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 O-C-N 126.739 2.082 . . . . 10.0 110.474 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 5.0 t70 86.97 -26.85 0.08 Allowed 'General case' 0 C--O 1.239 0.526 0 O-C-N 126.126 2.141 . . . . 10.0 112.426 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 47.07 100.24 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 123.947 1.832 . . . . 10.0 115.931 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.89 93.73 1.98 Allowed 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 114.222 -1.354 . . . . 10.0 110.187 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 5.4 pttt -58.44 141.02 52.84 Favored 'General case' 0 N--CA 1.444 -0.743 0 N-CA-C 104.51 -2.404 . . . . 10.0 104.51 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -134.64 -177.3 4.55 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 113.715 -1.584 . . . . 10.0 110.002 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 25.6 mtm -119.85 66.15 0.81 Allowed 'General case' 0 CA--C 1.503 -0.844 0 N-CA-C 102.564 -3.125 . . . . 10.0 102.564 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 96.7 m -72.17 139.12 48.09 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 117.623 2.453 . . . . 10.0 117.623 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -120.63 116.64 25.73 Favored 'General case' 0 C--N 1.319 -0.752 0 O-C-N 126.955 2.659 . . . . 10.0 105.566 179.782 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 1.4 t -107.36 146.89 13.01 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 O-C-N 126.961 2.663 . . . . 10.0 104.407 179.647 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.9 t -148.78 -173.83 4.46 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 123.65 0.78 . . . . 10.0 109.091 -179.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 1.1 p-90 -151.65 122.71 7.64 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 106.834 -1.543 . . . . 10.0 106.834 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -112.24 56.67 0.66 Allowed 'General case' 0 CA--C 1.5 -0.976 0 N-CA-C 101.648 -3.464 . . . . 10.0 101.648 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 117.43 -154.0 16.94 Favored Glycine 0 C--N 1.338 0.659 0 N-CA-C 104.92 -3.272 . . . . 10.0 104.92 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 12.0 t0 -82.85 58.63 4.42 Favored 'General case' 0 C--O 1.219 -0.528 0 O-C-N 120.024 -1.868 . . . . 10.0 112.027 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.5 mtmt -136.03 -172.11 3.04 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 122.644 1.211 . . . . 10.0 108.249 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 1.5 tp -152.64 98.29 2.34 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 108.385 -0.968 . . . . 10.0 108.385 -179.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.31 138.31 40.25 Favored 'General case' 0 C--O 1.216 -0.688 0 CA-C-O 121.863 0.84 . . . . 10.0 110.023 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 7.7 m -128.81 143.99 51.05 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 123.784 0.834 . . . . 10.0 111.7 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 23.8 t -137.46 110.48 7.75 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 N-CA-C 105.157 -2.164 . . . . 10.0 105.157 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 -101.65 127.29 48.45 Favored 'General case' 0 C--O 1.244 0.79 0 C-N-CA 123.219 0.608 . . . . 10.0 110.041 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 1.3 pttt -114.62 88.39 2.85 Favored 'General case' 0 C--O 1.233 0.204 0 N-CA-C 113.06 0.763 . . . . 10.0 113.06 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -115.17 -91.49 1.77 Allowed Glycine 0 N--CA 1.437 -1.252 0 N-CA-C 110.361 -1.096 . . . . 10.0 110.361 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -134.83 -8.15 2.4 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 116.966 2.21 . . . . 10.0 116.966 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.04 -177.53 4.52 Favored 'General case' 0 C--N 1.326 -0.423 0 O-C-N 126.682 2.489 . . . . 10.0 113.856 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -123.04 30.64 6.29 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 126.962 2.105 . . . . 10.0 112.869 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -161.93 -19.32 0.03 OUTLIER Glycine 0 N--CA 1.467 0.758 0 N-CA-C 119.855 2.702 . . . . 10.0 119.855 -179.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 1.5 mtt180 -51.42 116.12 1.92 Allowed 'General case' 0 C--O 1.223 -0.339 0 CA-C-O 124.133 1.921 . . . . 10.0 110.989 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 165.11 150.39 6.18 Favored Glycine 0 CA--C 1.518 0.26 0 N-CA-C 108.963 -1.655 . . . . 10.0 108.963 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -135.27 -173.05 3.22 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-N 114.181 -1.01 . . . . 10.0 112.227 -179.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 35.5 m -165.63 136.03 3.64 Favored 'General case' 0 N--CA 1.443 -0.782 0 C-N-CA 124.651 1.18 . . . . 10.0 108.544 -179.767 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -125.94 103.75 7.92 Favored 'General case' 0 C--O 1.244 0.807 0 C-N-CA 126.675 1.99 . . . . 10.0 108.944 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' TRP . . . . . 0.476 ' CD1' ' C ' ' A' ' 109' ' ' TRP . 0.0 OUTLIER -100.9 161.48 13.56 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 106.254 -1.758 . . . . 10.0 106.254 -179.805 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.424 HD11 ' CZ ' ' A' ' 4' ' ' PHE . 0.6 OUTLIER -131.28 143.03 41.87 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.028 0 N-CA-C 114.957 1.466 . . . . 10.0 114.957 179.999 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -136.59 90.14 2.53 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 112.703 -2.044 . . . . 10.0 108.993 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 47.4 -91.86 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.672 0 N-CA-C 109.278 -1.529 . . . . 10.0 109.278 179.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -96.94 -19.83 18.53 Favored 'General case' 0 C--N 1.333 -0.146 0 O-C-N 120.57 -1.547 . . . . 10.0 113.95 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -98.09 148.87 23.1 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 121.162 1.801 . . . . 10.0 113.937 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.434 ' HB2' ' CE3' ' A' ' 8' ' ' TRP . 13.7 tp -116.53 138.0 51.73 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 106.483 -1.673 . . . . 10.0 106.483 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 48.3 m80 -132.76 89.38 2.63 Favored 'General case' 0 C--N 1.315 -0.928 0 O-C-N 121.006 -1.058 . . . . 10.0 108.62 -179.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 31.6 tp -94.68 142.95 26.85 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 114.317 -1.31 . . . . 10.0 109.686 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -140.78 107.5 5.36 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 119.239 -0.984 . . . . 10.0 108.769 179.904 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 6.4 mtt -87.83 149.3 24.22 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 109.446 -0.575 . . . . 10.0 109.446 179.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -133.61 142.93 48.33 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 118.814 0.734 . . . . 10.0 109.481 179.616 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -154.27 134.5 13.28 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 108.828 -0.805 . . . . 10.0 108.828 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 36.0 44.14 0.24 Allowed 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 116.298 1.962 . . . . 10.0 116.298 -179.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 91.46 2.35 70.46 Favored Glycine 0 N--CA 1.468 0.807 0 CA-C-O 118.15 -1.361 . . . . 10.0 115.878 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -109.9 162.56 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 CA-C-N 120.398 2.099 . . . . 10.0 109.667 179.873 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 20.9 m -135.92 101.68 4.81 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 114.966 1.469 . . . . 10.0 114.966 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -86.09 143.78 27.88 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 107.538 -1.282 . . . . 10.0 107.538 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 2.1 mttt -140.17 118.8 12.32 Favored 'General case' 0 C--N 1.322 -0.612 0 O-C-N 124.081 0.863 . . . . 10.0 111.539 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -111.02 130.01 55.72 Favored 'General case' 0 C--O 1.244 0.811 0 O-C-N 125.068 1.48 . . . . 10.0 113.106 -179.491 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 4.8 t -97.58 127.12 50.22 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-O 122.302 1.048 . . . . 10.0 111.516 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . 0.434 ' CZ ' ' HE1' ' A' ' 10' ' ' MET . 0.0 OUTLIER -121.39 155.7 34.24 Favored 'General case' 0 N--CA 1.443 -0.793 0 C-N-CA 126.156 1.782 . . . . 10.0 110.646 179.952 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 4.9 tptt -125.59 120.45 30.85 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 105.128 -2.175 . . . . 10.0 105.128 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.81 116.14 8.15 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 120.928 1.694 . . . . 10.0 111.182 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 27.6 m -122.98 52.29 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 113.772 1.027 . . . . 10.0 113.772 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 . . . . . 0 C--O 1.242 0.7 0 CA-C-N 114.639 -1.164 . . . . 10.0 113.701 -180.0 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 . . . . . 0 C--O 1.226 -0.14 0 CA-C-O 120.993 0.425 . . . . 10.0 110.394 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -128.74 -39.3 1.63 Allowed 'General case' 0 C--O 1.241 0.629 0 N-CA-C 117.531 2.419 . . . . 10.0 117.531 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -50.24 137.91 17.32 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 115.665 1.728 . . . . 10.0 115.665 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -167.04 -97.33 0.11 Allowed Glycine 0 C--N 1.341 0.827 0 CA-C-O 125.011 2.451 . . . . 10.0 112.903 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . 0.492 ' CB ' ' CG1' ' A' ' 133' ' ' VAL . 0.1 OUTLIER 178.4 178.28 0.4 Allowed 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 104.626 -2.361 . . . . 10.0 104.626 -179.833 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.533 ' CD2' ' HB2' ' A' ' 39' ' ' ASP 0.297 36.0 p-90 -147.4 -179.6 6.97 Favored 'General case' 0 C--N 1.317 -0.809 0 O-C-N 127.403 2.939 . . . . 10.0 113.846 -178.384 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.2 ptmm? 166.42 99.8 0.0 OUTLIER 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 111.756 -2.475 . . . . 10.0 108.564 178.678 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.48 148.54 48.36 Favored 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 125.139 1.525 . . . . 10.0 114.44 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -113.25 -10.93 13.29 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.263 -0.881 . . . . 10.0 109.572 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 42.3 t -172.06 168.19 5.89 Favored 'General case' 0 CA--C 1.515 -0.377 0 N-CA-C 115.199 1.555 . . . . 10.0 115.199 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.4 t-20 -163.76 122.97 2.02 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 105.198 -2.149 . . . . 10.0 105.198 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -125.28 178.09 5.78 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 119.734 1.152 . . . . 10.0 111.278 -179.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 37.7 m-20 34.22 33.59 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.478 0 O-C-N 127.057 2.723 . . . . 10.0 112.298 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -68.42 -42.87 78.31 Favored 'General case' 0 CA--C 1.546 0.796 0 O-C-N 120.018 -1.676 . . . . 10.0 112.939 179.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 74.7 mt-10 -71.22 -34.48 70.87 Favored 'General case' 0 N--CA 1.464 0.238 0 O-C-N 120.317 -1.489 . . . . 10.0 112.55 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -74.58 -34.43 62.89 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 106.968 -1.493 . . . . 10.0 106.968 179.524 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -69.63 -27.9 65.46 Favored 'General case' 0 C--O 1.245 0.832 0 O-C-N 126.04 2.088 . . . . 10.0 109.079 179.587 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 44.5 mt -79.0 -25.59 43.33 Favored 'General case' 0 C--O 1.22 -0.479 0 N-CA-C 112.652 0.612 . . . . 10.0 112.652 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 17.3 tpt180 -79.11 -20.37 48.82 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 113.629 -1.623 . . . . 10.0 109.437 179.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.68 -44.42 96.3 Favored 'General case' 0 C--O 1.213 -0.847 0 C-N-CA 126.383 1.873 . . . . 10.0 113.228 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -84.88 -21.56 29.69 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 123.714 1.721 . . . . 10.0 109.712 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.9 t0 74.45 67.73 0.09 Allowed 'General case' 0 N--CA 1.48 1.027 0 CA-C-N 113.404 -1.725 . . . . 10.0 113.519 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 5.8 m -98.44 -176.89 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.469 0 N-CA-C 105.316 -2.105 . . . . 10.0 105.316 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.43 133.54 55.17 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-O 123.617 1.675 . . . . 10.0 113.411 -179.771 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 4.2 m -63.69 -31.77 54.34 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 N-CA-C 116.409 2.003 . . . . 10.0 116.409 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -74.14 -30.22 62.18 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-O 123.593 1.663 . . . . 10.0 108.829 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 60.8 tp -73.63 -22.06 60.11 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 113.325 -1.761 . . . . 10.0 112.686 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.5 ttp-105 -71.97 -31.02 65.87 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 114.931 -1.031 . . . . 10.0 111.917 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 14.8 tttm -74.2 -39.13 63.36 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-O 122.943 1.354 . . . . 10.0 113.872 -179.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.405 ' N ' ' CD1' ' A' ' 32' ' ' ILE . 1.2 mm -72.61 -33.21 44.1 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.747 0 O-C-N 119.619 -1.926 . . . . 10.0 112.074 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -69.77 -33.15 72.01 Favored 'General case' 0 C--O 1.217 -0.654 0 CA-C-O 118.348 -0.834 . . . . 10.0 111.659 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -60.21 -14.3 16.93 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 118.04 -1.464 . . . . 10.0 113.109 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.9 mt -93.8 -18.6 21.87 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 118.517 -1.273 . . . . 10.0 111.86 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -91.28 134.39 34.62 Favored 'General case' 0 N--CA 1.48 1.05 0 O-C-N 124.654 1.221 . . . . 10.0 109.033 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 16.8 mtpp -123.33 103.93 35.13 Favored Pre-proline 0 N--CA 1.475 0.783 0 N-CA-C 104.785 -2.302 . . . . 10.0 104.785 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -60.69 136.64 68.02 Favored 'Trans proline' 0 C--N 1.357 1.009 0 N-CA-C 117.796 2.191 . . . . 10.0 117.796 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.533 ' HB2' ' CD2' ' A' ' 8' ' ' TRP . 0.4 OUTLIER -100.05 174.66 6.06 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 104.876 -2.268 . . . . 10.0 104.876 179.455 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.408 ' C ' ' CD1' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -167.77 119.05 0.85 Allowed 'General case' 0 CA--C 1.497 -1.075 0 C-N-CA 116.82 -1.952 . . . . 10.0 112.681 179.839 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -103.71 137.6 41.51 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 107.084 -1.45 . . . . 10.0 107.084 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 16.0 mt -112.64 153.23 14.28 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-O 117.427 -1.273 . . . . 10.0 107.709 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -147.75 126.32 3.79 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.734 0 N-CA-C 105.523 -2.029 . . . . 10.0 105.523 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 6.5 mm100 -131.86 113.44 13.47 Favored 'General case' 0 C--N 1.314 -0.977 0 O-C-N 125.605 1.816 . . . . 10.0 110.404 179.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -104.66 -11.77 16.73 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 105.089 -2.189 . . . . 10.0 105.089 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 166.47 -123.89 1.18 Allowed Glycine 0 CA--C 1.511 -0.171 0 N-CA-C 108.958 -1.657 . . . . 10.0 108.958 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -84.37 -8.13 59.08 Favored 'General case' 0 C--O 1.216 -0.701 0 CA-C-N 121.242 2.521 . . . . 10.0 108.308 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -96.02 118.03 31.82 Favored 'General case' 0 C--O 1.219 -0.524 0 N-CA-C 105.907 -1.886 . . . . 10.0 105.907 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.411 ' CE ' HD12 ' A' ' 51' ' ' ILE . 17.9 ttp -115.46 127.29 55.22 Favored 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 115.216 1.561 . . . . 10.0 115.216 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 15.0 mt -113.5 145.37 19.48 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.057 0 N-CA-C 105.175 -2.157 . . . . 10.0 105.175 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.411 HD12 ' CE ' ' A' ' 49' ' ' MET . 2.6 mt -136.75 114.15 13.66 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-O 122.956 1.36 . . . . 10.0 107.807 -179.646 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -95.92 84.32 3.84 Favored 'General case' 0 CA--C 1.503 -0.83 0 CA-C-N 112.911 -1.95 . . . . 10.0 111.555 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 98.5 m -89.35 115.91 27.16 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 100.203 -3.999 . . . . 10.0 100.203 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 43.9 mt -117.47 73.79 0.9 Allowed 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 119.174 3.028 . . . . 10.0 119.174 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 4.3 m -69.01 101.09 1.32 Allowed 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 102.572 -3.122 . . . . 10.0 102.572 179.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.8 t -60.16 96.35 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 119.991 1.269 . . . . 10.0 108.466 -179.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER 160.08 -42.6 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 126.713 2.005 . . . . 10.0 106.247 -179.865 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -144.11 105.16 4.21 Favored 'General case' 0 CA--C 1.511 -0.55 0 O-C-N 126.117 2.135 . . . . 10.0 112.517 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.92 125.38 23.78 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 120.079 -1.638 . . . . 10.0 108.637 179.848 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -109.01 125.92 52.57 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 102.403 -3.184 . . . . 10.0 102.403 -179.817 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 5.1 mt -132.81 129.55 58.25 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.722 0 N-CA-C 112.931 0.715 . . . . 10.0 112.931 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -134.0 164.32 27.58 Favored 'General case' 0 C--O 1.216 -0.7 0 N-CA-C 108.033 -1.099 . . . . 10.0 108.033 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -157.61 77.21 0.83 Allowed 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 101.041 -3.689 . . . . 10.0 101.041 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 1.8 m-30 -91.59 -178.07 4.97 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 117.212 2.301 . . . . 10.0 117.212 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -132.69 145.04 50.72 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 107.099 -1.445 . . . . 10.0 107.099 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 95.3 t -81.74 85.41 1.63 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.207 0 O-C-N 124.669 1.231 . . . . 10.0 113.335 -179.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 110.16 55.21 0.54 Allowed Glycine 0 C--O 1.221 -0.676 0 C-N-CA 120.547 -0.835 . . . . 10.0 113.367 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 34.4 ttmt -157.93 138.46 12.85 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-N 118.663 1.231 . . . . 10.0 112.6 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -78.2 123.15 26.58 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-O 123.197 1.475 . . . . 10.0 110.142 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -106.54 178.04 4.68 Favored 'General case' 0 C--O 1.244 0.79 0 CA-C-N 112.737 -2.028 . . . . 10.0 108.444 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -145.84 81.82 1.61 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 113.265 -1.789 . . . . 10.0 109.439 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -75.31 139.99 42.82 Favored 'General case' 0 C--O 1.219 -0.545 0 O-C-N 124.768 1.293 . . . . 10.0 112.068 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -112.32 70.88 0.72 Allowed 'General case' 0 N--CA 1.456 -0.154 0 CA-C-O 124.082 1.896 . . . . 10.0 106.007 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.63 129.96 41.61 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 123.789 1.757 . . . . 10.0 111.625 179.778 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -135.19 65.75 1.55 Allowed 'General case' 0 CA--C 1.51 -0.589 0 N-CA-C 105.806 -1.924 . . . . 10.0 105.806 179.78 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -159.5 -178.89 33.91 Favored Glycine 0 N--CA 1.438 -1.207 0 CA-C-O 117.334 -1.814 . . . . 10.0 109.705 -179.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.439 ' CD1' ' N ' ' A' ' 77' ' ' ILE . 0.0 OUTLIER 37.7 -93.99 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.51 -0.589 0 O-C-N 127.179 2.34 . . . . 10.0 110.035 -179.848 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -87.94 -31.19 19.55 Favored 'General case' 0 CA--C 1.51 -0.578 0 N-CA-C 114.963 1.468 . . . . 10.0 114.963 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.4 t0 77.91 116.25 0.06 Allowed 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 127.451 2.3 . . . . 10.0 113.587 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 3.6 mtt180 169.15 161.96 0.05 Allowed 'General case' 0 C--N 1.315 -0.899 0 O-C-N 120.676 -1.265 . . . . 10.0 109.152 -179.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.04 165.78 11.22 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 108.802 -0.814 . . . . 10.0 108.802 -179.732 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -135.13 -174.8 3.71 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 122.522 1.153 . . . . 10.0 110.179 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -145.86 44.49 1.27 Allowed 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 101.44 -3.541 . . . . 10.0 101.44 179.868 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -42.14 150.13 0.13 Allowed 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 118.931 2.937 . . . . 10.0 118.931 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 87.6 m -139.16 104.36 4.99 Favored 'General case' 0 CA--C 1.506 -0.746 0 N-CA-C 104.785 -2.302 . . . . 10.0 104.785 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -91.53 107.02 18.26 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.068 0 N-CA-C 102.795 -3.039 . . . . 10.0 102.795 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 15.6 p -139.97 135.41 32.73 Favored 'General case' 0 C--O 1.243 0.724 0 C-N-CA 119.001 -1.08 . . . . 10.0 111.562 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -65.94 110.74 3.01 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-O 123.072 1.415 . . . . 10.0 108.21 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -84.96 -24.12 28.47 Favored 'General case' 0 C--O 1.248 1.001 0 N-CA-C 102.76 -3.052 . . . . 10.0 102.76 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 146.05 70.74 0.02 OUTLIER Glycine 0 C--N 1.317 -0.525 0 N-CA-C 103.175 -3.97 . . . . 10.0 103.175 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 86.56 -57.23 0.06 Allowed 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 124.812 1.245 . . . . 10.0 108.113 -179.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.7 ttpp -55.86 105.29 0.17 Allowed 'General case' 0 C--O 1.236 0.36 0 N-CA-C 106.112 -1.81 . . . . 10.0 106.112 -179.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 4.2 tp -67.97 99.48 0.86 Allowed 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 103.935 -2.617 . . . . 10.0 103.935 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -88.44 113.62 24.22 Favored 'General case' 0 C--O 1.218 -0.598 0 N-CA-C 114.858 1.429 . . . . 10.0 114.858 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 27.1 m -104.83 98.43 8.16 Favored 'General case' 0 N--CA 1.443 -0.787 0 O-C-N 126.044 2.09 . . . . 10.0 110.068 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -108.24 116.89 52.6 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 N-CA-C 105.061 -2.2 . . . . 10.0 105.061 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -110.45 118.4 36.16 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 126.727 2.517 . . . . 10.0 112.942 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 12.0 mtmt -74.61 119.53 18.92 Favored 'General case' 0 C--O 1.215 -0.754 0 O-C-N 124.276 0.985 . . . . 10.0 112.431 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -173.99 -160.69 22.72 Favored Glycine 0 C--N 1.338 0.669 0 N-CA-C 109.683 -1.367 . . . . 10.0 109.683 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -82.54 -172.15 3.88 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-O 116.204 -1.855 . . . . 10.0 111.568 179.86 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 81.05 -157.07 0.02 OUTLIER 'General case' 0 C--N 1.317 -0.84 0 O-C-N 127.087 2.742 . . . . 10.0 111.319 -179.863 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -136.29 -41.34 0.64 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.983 0.897 . . . . 10.0 113.087 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -97.61 1.39 60.02 Favored Glycine 0 CA--C 1.526 0.78 0 CA-C-O 116.108 -2.496 . . . . 10.0 117.041 -179.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 1.8 mtt180 -53.16 129.69 32.01 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 123.289 1.518 . . . . 10.0 109.692 -179.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 134.88 133.29 3.26 Favored Glycine 0 C--O 1.219 -0.829 0 CA-C-N 113.493 -1.685 . . . . 10.0 109.558 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -110.75 -169.47 1.46 Allowed 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 108.812 -0.81 . . . . 10.0 108.812 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -162.03 132.94 5.06 Favored 'General case' 0 C--O 1.211 -0.933 0 O-C-N 125.684 1.865 . . . . 10.0 108.713 -179.753 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -115.74 95.3 5.06 Favored 'General case' 0 C--N 1.316 -0.877 0 O-C-N 125.69 1.869 . . . . 10.0 109.846 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' TRP . . . . . 0.461 ' CD1' ' C ' ' A' ' 109' ' ' TRP . 1.3 t90 -109.73 114.18 27.56 Favored 'General case' 0 C--O 1.221 -0.414 0 CA-C-N 114.592 -1.185 . . . . 10.0 108.859 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.406 HG22 ' N ' ' A' ' 111' ' ' GLU . 88.3 mt -91.52 140.08 16.67 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 CA-C-N 113.412 -1.722 . . . . 10.0 114.041 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . 0.406 ' N ' HG22 ' A' ' 110' ' ' ILE . 3.9 mt-10 -116.67 64.45 0.71 Allowed 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 104.143 -2.54 . . . . 10.0 104.143 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 66.68 -119.24 11.93 Favored Glycine 0 N--CA 1.467 0.744 0 N-CA-C 108.294 -1.923 . . . . 10.0 108.294 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -63.15 -4.37 2.36 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 121.121 -1.223 . . . . 10.0 113.247 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -118.14 156.66 28.32 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 119.388 0.994 . . . . 10.0 110.047 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.433 ' HB3' ' HB3' ' A' ' 130' ' ' PHE . 0.2 OUTLIER -124.19 105.86 9.85 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 105.299 -2.111 . . . . 10.0 105.299 179.755 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 18.8 m80 -97.81 85.96 3.66 Favored 'General case' 0 CA--C 1.505 -0.788 0 O-C-N 119.55 -1.969 . . . . 10.0 109.049 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.82 115.15 24.05 Favored 'General case' 0 N--CA 1.447 -0.599 0 O-C-N 125.271 1.607 . . . . 10.0 110.869 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -117.16 90.68 3.39 Favored 'General case' 0 CA--C 1.498 -1.055 0 CA-C-O 118.47 -0.776 . . . . 10.0 111.264 -179.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 34.6 mtm -82.28 162.22 22.37 Favored 'General case' 0 CA--C 1.514 -0.414 0 C-N-CA 119.193 -1.003 . . . . 10.0 110.425 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 3.8 ttm180 -150.53 150.24 30.99 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 122.396 1.093 . . . . 10.0 112.38 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -166.62 124.75 1.39 Allowed 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 114.338 -1.301 . . . . 10.0 108.457 -179.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 53.58 34.74 19.25 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 117.952 2.575 . . . . 10.0 117.952 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 91.01 -6.97 81.69 Favored Glycine 0 C--N 1.336 0.546 0 N-CA-C 117.551 1.78 . . . . 10.0 117.551 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 15.1 t -108.72 117.97 55.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 CA-C-N 118.213 1.007 . . . . 10.0 112.469 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 22.7 m -92.37 119.28 31.76 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 126.009 2.068 . . . . 10.0 112.352 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -107.96 139.29 42.8 Favored 'General case' 0 C--N 1.322 -0.595 0 O-C-N 127.513 3.008 . . . . 10.0 106.175 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.42 149.58 34.98 Favored 'General case' 0 C--N 1.319 -0.745 0 C-N-CA 118.759 -1.176 . . . . 10.0 112.926 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -132.96 117.7 17.97 Favored 'General case' 0 C--N 1.318 -0.78 0 O-C-N 127.877 3.236 . . . . 10.0 109.509 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 38.9 t -78.39 87.42 1.1 Allowed 'Isoleucine or valine' 0 C--O 1.217 -0.636 0 C-N-CA 118.549 -1.26 . . . . 10.0 110.227 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . 0.433 ' HB3' ' HB3' ' A' ' 115' ' ' LEU . 0.7 OUTLIER -73.42 167.68 20.78 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 108.451 -0.944 . . . . 10.0 108.451 -179.967 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -139.04 88.25 2.27 Favored 'General case' 0 C--O 1.241 0.616 0 N-CA-C 106.343 -1.725 . . . . 10.0 106.343 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 9.2 ttpt -61.67 98.82 0.1 Allowed 'General case' 0 C--N 1.32 -0.702 0 O-C-N 121.95 -0.469 . . . . 10.0 110.017 179.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' VAL . . . . . 0.492 ' CG1' ' CB ' ' A' ' 7' ' ' TYR . 9.5 p -43.96 -31.18 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 C-N-CA 124.76 1.224 . . . . 10.0 111.275 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 54.7 t-80 . . . . . 0 C--O 1.245 0.826 0 O-C-N 126.189 2.181 . . . . 10.0 110.981 -179.72 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 . . . . . 0 C--O 1.24 0.601 0 N-CA-C 110.715 -0.106 . . . . 10.0 110.715 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -74.08 -15.9 61.04 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 123.989 0.806 . . . . 10.0 112.652 179.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -58.01 115.38 2.84 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 122.493 1.14 . . . . 10.0 112.766 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -162.3 -101.33 0.16 Allowed Glycine 0 C--N 1.344 0.986 0 N-CA-C 118.87 2.308 . . . . 10.0 118.87 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . 0.459 ' HA ' ' CE3' ' A' ' 8' ' ' TRP . 6.4 m-85 -167.9 163.28 13.85 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 102.535 -3.135 . . . . 10.0 102.535 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.566 ' CZ3' ' CG ' ' A' ' 41' ' ' GLU 0.285 29.6 p90 -144.41 -176.39 5.02 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 125.683 1.593 . . . . 10.0 113.51 -179.492 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 164.41 93.52 0.0 OUTLIER 'General case' 0 C--O 1.232 0.173 0 CA-C-N 111.984 -2.371 . . . . 10.0 107.999 179.3 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.477 ' HE2' ' CB ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -41.68 153.36 0.06 Allowed 'General case' 0 C--N 1.311 -1.083 0 N-CA-C 115.164 1.542 . . . . 10.0 115.164 179.435 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.431 ' CD1' ' HB2' ' A' ' 131' ' ' LYS . 0.3 OUTLIER -118.61 -49.0 2.47 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 108.065 -1.087 . . . . 10.0 108.065 -179.976 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.8 t -161.76 164.36 29.01 Favored 'General case' 0 C--O 1.242 0.68 0 N-CA-C 115.079 1.511 . . . . 10.0 115.079 179.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -129.25 151.36 50.0 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 105.121 -2.177 . . . . 10.0 105.121 179.837 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -151.47 137.53 18.26 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 116.839 2.163 . . . . 10.0 116.839 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 74.1 m-20 55.56 19.97 3.54 Favored 'General case' 0 N--CA 1.444 -0.754 0 O-C-N 125.793 1.933 . . . . 10.0 112.657 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.463 ' CZ ' ' HA ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -69.01 -20.43 64.15 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 114.551 1.315 . . . . 10.0 114.551 179.723 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -78.58 -40.14 35.5 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 119.794 -1.816 . . . . 10.0 111.576 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.483 ' CG ' HG12 ' A' ' 124' ' ' VAL . 2.1 pt-20 -75.55 -20.89 58.35 Favored 'General case' 0 CA--C 1.51 -0.581 0 N-CA-C 108.256 -1.016 . . . . 10.0 108.256 179.815 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -72.93 -34.2 66.43 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 105.964 -1.865 . . . . 10.0 105.964 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 41.5 mt -78.81 -23.31 45.2 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 120.82 1.646 . . . . 10.0 108.858 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.5 ttm-85 -69.33 -30.39 68.43 Favored 'General case' 0 N--CA 1.447 -0.617 0 O-C-N 126.127 2.142 . . . . 10.0 108.652 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.86 -38.95 83.75 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 125.152 1.381 . . . . 10.0 110.923 -179.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 33.4 mt -75.9 -28.17 57.98 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 117.51 -1.233 . . . . 10.0 109.454 179.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.4 t70 78.51 45.96 0.06 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 126.762 2.539 . . . . 10.0 113.042 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 3.2 m -85.64 -162.65 0.08 OUTLIER 'Isoleucine or valine' 0 C--O 1.243 0.748 0 N-CA-C 106.998 -1.482 . . . . 10.0 106.998 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -93.4 170.83 9.32 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 116.599 2.074 . . . . 10.0 116.599 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.5 m -75.89 -35.46 29.99 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 CA-C-N 112.847 -1.979 . . . . 10.0 111.733 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.05 -34.19 74.79 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 122.884 1.326 . . . . 10.0 111.293 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.433 ' CD1' ' C ' ' A' ' 29' ' ' LEU . 1.7 tm? -76.9 -40.85 45.95 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.492 -1.231 . . . . 10.0 111.553 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.5 ttp85 -61.38 -29.08 69.69 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 125.432 1.493 . . . . 10.0 113.948 179.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.48 -41.47 39.37 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 106.495 -1.669 . . . . 10.0 106.495 179.75 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 2.1 mm -62.25 -40.57 88.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 O-C-N 120.204 -1.56 . . . . 10.0 112.196 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -73.79 -48.25 32.9 Favored 'General case' 0 N--CA 1.476 0.83 0 O-C-N 125.245 1.591 . . . . 10.0 110.943 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.463 ' HA ' ' CZ ' ' A' ' 16' ' ' PHE . 0.0 OUTLIER -67.79 175.24 3.09 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-O 115.381 -2.247 . . . . 10.0 107.976 179.085 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.412 ' N ' ' CG ' ' A' ' 34' ' ' ASN . 0.3 OUTLIER 84.0 -43.6 0.09 Allowed 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 114.957 1.466 . . . . 10.0 114.957 179.831 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.415 HD13 ' CB ' ' A' ' 57' ' ' PHE . 51.9 mt -83.79 152.13 24.81 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 126.626 2.454 . . . . 10.0 111.182 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.477 ' CB ' ' HE2' ' A' ' 10' ' ' MET . 6.9 mttt -125.52 96.22 39.06 Favored Pre-proline 0 C--N 1.318 -0.797 0 O-C-N 127.374 2.921 . . . . 10.0 107.132 -179.737 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -63.6 -170.35 0.11 Allowed 'Trans proline' 0 C--O 1.219 -0.447 0 O-C-N 124.806 1.95 . . . . 10.0 116.261 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.53 ' CB ' ' CD1' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -141.93 171.36 14.16 Favored 'General case' 0 C--O 1.235 0.33 0 O-C-N 126.665 2.478 . . . . 10.0 108.024 179.942 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.453 ' HB2' ' CZ ' ' A' ' 130' ' ' PHE . 0.8 OUTLIER -149.21 90.93 1.78 Allowed 'General case' 0 CA--C 1.498 -1.046 0 CA-C-O 123.63 1.681 . . . . 10.0 112.398 -179.698 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.566 ' CG ' ' CZ3' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -88.98 142.72 27.4 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 103.609 -2.737 . . . . 10.0 103.609 -179.793 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.7 mm -127.31 149.97 32.8 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.736 0 CA-C-N 119.403 1.001 . . . . 10.0 108.51 179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 16.9 t -153.82 132.43 2.95 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 N-CA-C 104.963 -2.236 . . . . 10.0 104.963 179.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -141.7 130.03 22.37 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 124.178 1.942 . . . . 10.0 107.397 179.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -88.8 -9.21 52.62 Favored 'General case' 0 C--N 1.313 -0.995 0 C-N-CA 126.399 1.88 . . . . 10.0 107.98 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 145.49 -96.1 0.18 Allowed Glycine 0 N--CA 1.468 0.786 0 O-C-N 127.333 2.896 . . . . 10.0 108.888 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -90.57 -23.67 20.8 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 118.555 1.177 . . . . 10.0 110.586 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.4 t-160 -85.51 116.8 24.03 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 104.447 -2.427 . . . . 10.0 104.447 179.866 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 58.3 ttp -101.81 147.11 26.88 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 113.637 -1.62 . . . . 10.0 114.179 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 31.9 mt -137.79 115.46 12.81 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.735 0 O-C-N 119.113 -2.242 . . . . 10.0 107.852 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.6 mp -105.89 127.63 60.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 105.415 -2.068 . . . . 10.0 105.415 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 83.4 mtt180 -116.33 138.48 51.29 Favored 'General case' 0 C--O 1.212 -0.88 0 O-C-N 126.687 2.492 . . . . 10.0 111.799 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 5.8 m -131.19 134.28 46.33 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 100.547 -3.871 . . . . 10.0 100.547 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.2 mp -126.48 63.81 1.27 Allowed 'General case' 0 C--N 1.321 -0.636 1 N-CA-C 121.845 4.017 . . . . 10.0 121.845 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.3 m -84.57 153.05 23.47 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 105.376 -2.083 . . . . 10.0 105.376 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -63.54 -29.16 70.46 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 107.249 -1.389 . . . . 10.0 107.249 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.415 ' CB ' HD13 ' A' ' 36' ' ' LEU . 2.1 t80 -112.41 123.74 50.95 Favored 'General case' 0 C--O 1.243 0.76 0 O-C-N 125.831 1.957 . . . . 10.0 107.945 -179.899 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 53.53 91.67 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 113.813 1.042 . . . . 10.0 113.813 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . 0.459 ' HB3' ' CD1' ' A' ' 61' ' ' ILE . 6.0 m-20 -58.32 -52.39 65.81 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 115.126 -0.943 . . . . 10.0 110.736 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER 76.42 84.95 0.09 Allowed 'General case' 0 C--N 1.311 -1.105 0 C-N-CA 126.325 1.85 . . . . 10.0 106.105 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.459 ' CD1' ' HB3' ' A' ' 59' ' ' ASN . 1.7 mp -105.75 135.54 43.55 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.81 0 O-C-N 120.834 -1.166 . . . . 10.0 110.33 -179.868 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 7.8 mtt -125.58 166.58 16.43 Favored 'General case' 0 C--O 1.214 -0.802 0 N-CA-C 107.692 -1.225 . . . . 10.0 107.692 179.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -146.02 89.61 1.9 Allowed 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 100.301 -3.963 . . . . 10.0 100.301 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.503 ' CD2' HG23 ' A' ' 86' ' ' VAL . 3.7 m-30 -100.63 157.43 16.68 Favored 'General case' 0 C--N 1.32 -0.714 0 O-C-N 126.168 2.168 . . . . 10.0 113.999 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -120.22 104.47 10.09 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 105.504 -2.035 . . . . 10.0 105.504 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.7 t -59.48 113.12 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.921 0 CA-C-N 115.423 -0.808 . . . . 10.0 109.49 -179.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 103.2 22.01 9.56 Favored Glycine 0 C--O 1.224 -0.5 0 CA-C-O 117.613 -1.659 . . . . 10.0 114.98 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.1 tttm -140.95 159.36 42.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 121.055 2.428 . . . . 10.0 115.951 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.86 144.19 35.22 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 107.765 -1.198 . . . . 10.0 107.765 -179.846 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -144.02 98.69 3.26 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-O 123.543 1.639 . . . . 10.0 112.686 179.735 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -70.33 103.4 2.39 Favored 'General case' 0 C--O 1.22 -0.474 0 O-C-N 119.364 -2.085 . . . . 10.0 105.639 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.407 ' HB3' ' HG ' ' A' ' 74' ' ' LEU . 3.5 mt-10 -75.86 -34.39 60.04 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-O 117.214 -1.374 . . . . 10.0 114.342 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 41.53 73.65 0.12 Allowed 'General case' 0 C--N 1.317 -0.816 0 O-C-N 126.409 2.318 . . . . 10.0 109.702 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.407 ' HG ' ' HB3' ' A' ' 72' ' ' GLU . 1.2 mt -95.55 126.77 41.07 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 115.742 1.756 . . . . 10.0 115.742 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 35.6 p -123.84 41.56 3.45 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 103.845 -2.65 . . . . 10.0 103.845 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -155.0 165.99 32.36 Favored Glycine 0 N--CA 1.446 -0.668 0 N-CA-C 109.733 -1.347 . . . . 10.0 109.733 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 3.0 mm 64.21 -73.81 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 O-C-N 126.089 1.699 . . . . 10.0 107.772 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 23.7 p30 -139.09 39.02 2.12 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 117.548 -1.215 . . . . 10.0 108.567 179.635 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 4.26 91.16 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.646 0 O-C-N 127.523 3.014 . . . . 10.0 117.528 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.46 112.59 8.59 Favored 'General case' 0 CA--C 1.506 -0.726 0 CA-C-O 121.645 0.736 . . . . 10.0 112.828 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 7.3 pttt -80.25 121.54 25.76 Favored 'General case' 0 N--CA 1.438 -1.074 0 N-CA-C 103.515 -2.772 . . . . 10.0 103.515 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 28.2 p -153.21 -178.59 7.06 Favored 'General case' 0 C--O 1.216 -0.705 0 CA-C-N 114.906 -1.043 . . . . 10.0 108.204 -179.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.1 ptt? -130.48 132.78 45.83 Favored 'General case' 0 CA--C 1.505 -0.773 1 N-CA-C 99.003 -4.443 . . . . 10.0 99.003 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 25.6 m -132.64 120.71 22.12 Favored 'General case' 0 CA--C 1.505 -0.769 0 N-CA-C 118.179 2.659 . . . . 10.0 118.179 -179.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.12 118.6 36.83 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 112.313 -2.221 . . . . 10.0 108.471 -179.811 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.503 HG23 ' CD2' ' A' ' 64' ' ' PHE . 96.5 t -104.66 120.3 54.89 Favored 'Isoleucine or valine' 0 C--O 1.24 0.561 0 N-CA-C 105.795 -1.928 . . . . 10.0 105.795 -179.922 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -127.15 -159.14 0.91 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 123.94 1.829 . . . . 10.0 109.821 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 7.4 p-90 -148.77 123.59 9.93 Favored 'General case' 0 CA--C 1.51 -0.573 0 O-C-N 120.569 -1.332 . . . . 10.0 107.9 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -80.0 -38.33 32.33 Favored 'General case' 0 N--CA 1.447 -0.62 1 N-CA-C 98.862 -4.495 . . . . 10.0 98.862 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 134.4 126.81 2.67 Favored Glycine 0 N--CA 1.44 -1.034 0 N-CA-C 103.857 -3.697 . . . . 10.0 103.857 -179.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 58.14 20.44 7.01 Favored 'General case' 0 N--CA 1.468 0.426 0 O-C-N 120.706 -1.467 . . . . 10.0 110.247 179.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 5.0 ttpt -156.7 143.47 18.55 Favored 'General case' 0 C--N 1.341 0.211 0 O-C-N 125.879 1.987 . . . . 10.0 108.501 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 2.9 tp -111.45 82.94 1.69 Allowed 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 106.137 -1.801 . . . . 10.0 106.137 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -86.79 145.31 26.67 Favored 'General case' 0 CA--C 1.505 -0.769 0 O-C-N 119.716 -1.865 . . . . 10.0 111.303 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -144.07 141.72 30.23 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-N 114.392 -1.277 . . . . 10.0 109.777 179.75 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 1.6 t -122.62 142.71 38.08 Favored 'Isoleucine or valine' 0 C--O 1.242 0.702 0 N-CA-C 105.217 -2.142 . . . . 10.0 105.217 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 31.3 mt-30 -125.15 100.01 6.36 Favored 'General case' 0 C--O 1.246 0.881 0 CA-C-N 114.074 -1.421 . . . . 10.0 112.247 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 28.8 mmtt -63.45 113.49 3.3 Favored 'General case' 0 CA--C 1.505 -0.77 0 N-CA-C 115.396 1.628 . . . . 10.0 115.396 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -145.99 -114.11 0.85 Allowed Glycine 0 C--O 1.217 -0.953 0 C-N-CA 118.584 -1.769 . . . . 10.0 113.357 -179.651 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 18.8 tp10 -126.8 -9.02 6.1 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 115.348 1.611 . . . . 10.0 115.348 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 21.5 mmtt -107.57 158.26 17.38 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 117.699 2.481 . . . . 10.0 117.699 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -51.55 -63.07 1.25 Allowed 'General case' 0 C--O 1.238 0.48 0 O-C-N 119.674 -1.891 . . . . 10.0 109.948 -179.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -78.09 -82.76 0.6 Allowed Glycine 0 CA--C 1.505 -0.558 0 C-N-CA 121.14 -0.552 . . . . 10.0 114.143 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 46.2 81.85 0.04 OUTLIER 'General case' 0 N--CA 1.44 -0.956 0 CA-C-O 124.524 2.107 . . . . 10.0 114.398 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 179.23 174.57 45.46 Favored Glycine 0 C--O 1.219 -0.841 0 CA-C-N 112.686 -2.052 . . . . 10.0 111.191 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' TRP . . . . . 0.455 ' CE3' HD11 ' A' ' 117' ' ' LEU . 15.5 m0 -123.02 144.47 49.24 Favored 'General case' 0 C--O 1.217 -0.613 0 N-CA-C 108.077 -1.083 . . . . 10.0 108.077 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -131.1 133.34 45.55 Favored 'General case' 0 C--O 1.21 -0.979 0 N-CA-C 106.252 -1.759 . . . . 10.0 106.252 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 9.5 tp60 -141.97 112.79 7.32 Favored 'General case' 0 C--N 1.323 -0.569 0 O-C-N 125.706 1.879 . . . . 10.0 113.462 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -126.46 104.11 7.98 Favored 'General case' 0 C--O 1.212 -0.89 0 CA-C-O 122.929 1.347 . . . . 10.0 112.102 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 14.6 mt -55.21 109.29 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 112.968 -1.924 . . . . 10.0 112.614 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -96.46 -175.96 3.49 Favored 'General case' 0 C--N 1.333 -0.123 0 O-C-N 126.685 2.491 . . . . 10.0 106.865 -179.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -52.5 94.31 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.638 0 O-C-N 126.103 2.127 . . . . 10.0 111.378 179.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 44.86 33.42 0.99 Allowed 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 123.555 1.645 . . . . 10.0 111.669 -179.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -139.39 124.17 18.56 Favored 'General case' 0 C--O 1.241 0.613 0 N-CA-C 115.539 1.681 . . . . 10.0 115.539 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.41 ' HB2' ' HB3' ' A' ' 130' ' ' PHE . 0.5 OUTLIER -84.96 125.51 32.74 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 103.643 -2.725 . . . . 10.0 103.643 179.797 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -129.13 91.62 3.23 Favored 'General case' 0 N--CA 1.445 -0.689 0 O-C-N 121.784 -0.573 . . . . 10.0 110.239 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.455 HD11 ' CE3' ' A' ' 106' ' ' TRP . 1.1 tp -95.79 122.17 38.29 Favored 'General case' 0 N--CA 1.442 -0.857 0 O-C-N 124.988 1.43 . . . . 10.0 110.722 179.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -122.23 108.0 12.79 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 117.999 -1.0 . . . . 10.0 109.085 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -98.32 136.51 38.39 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 118.571 0.623 . . . . 10.0 112.124 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -113.65 146.63 39.48 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 113.022 0.749 . . . . 10.0 113.022 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -162.44 113.54 1.56 Allowed 'General case' 0 C--N 1.32 -0.699 0 O-C-N 125.527 1.767 . . . . 10.0 109.639 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 52.72 46.7 26.23 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 117.279 -1.343 . . . . 10.0 112.899 179.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 74.13 14.49 80.45 Favored Glycine 0 N--CA 1.469 0.888 0 O-C-N 125.72 1.888 . . . . 10.0 117.205 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . 0.483 HG12 ' CG ' ' A' ' 18' ' ' GLU . 97.3 t -116.31 112.98 41.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 N-CA-C 106.974 -1.491 . . . . 10.0 106.974 179.877 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 37.0 m -90.97 87.65 6.7 Favored 'General case' 0 N--CA 1.444 -0.736 0 O-C-N 125.169 1.543 . . . . 10.0 114.508 179.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 8.6 t -76.31 136.28 39.58 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 105.148 -2.168 . . . . 10.0 105.148 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -127.46 157.46 40.0 Favored 'General case' 0 N--CA 1.474 0.773 0 O-C-N 125.284 1.615 . . . . 10.0 112.055 -179.61 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -140.38 97.1 3.15 Favored 'General case' 0 CA--C 1.503 -0.846 0 CA-C-O 122.478 1.132 . . . . 10.0 110.044 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 40.7 t -72.93 129.09 36.11 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 O-C-N 120.62 -1.3 . . . . 10.0 107.92 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . 0.453 ' CZ ' ' HB2' ' A' ' 40' ' ' LYS . 0.6 OUTLIER -128.21 160.13 33.05 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 113.614 -1.63 . . . . 10.0 110.218 179.776 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . 0.431 ' HB2' ' CD1' ' A' ' 11' ' ' LEU . 4.4 mmtt -132.54 127.78 35.87 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 105.817 -1.92 . . . . 10.0 105.817 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 12.7 tttt -90.7 102.84 15.59 Favored 'General case' 0 C--O 1.219 -0.536 0 O-C-N 125.178 1.549 . . . . 10.0 108.904 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 16.5 t -41.83 -55.17 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 127.491 2.994 . . . . 10.0 114.257 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.445 -0.699 0 O-C-N 125.508 1.755 . . . . 10.0 111.463 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.241 0.615 0 N-CA-C 108.936 -0.765 . . . . 10.0 108.936 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.541 ' CD1' ' CD1' ' A' ' 110' ' ' ILE . 20.8 m-30 -59.0 -14.85 10.52 Favored 'General case' 0 C--O 1.22 -0.486 0 N-CA-C 112.828 0.677 . . . . 10.0 112.828 -179.751 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.49 124.9 21.55 Favored 'General case' 0 C--O 1.244 0.765 0 N-CA-C 114.347 1.24 . . . . 10.0 114.347 -179.704 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -155.91 -105.39 0.23 Allowed Glycine 0 CA--C 1.532 1.106 0 C-N-CA 118.447 -1.835 . . . . 10.0 116.198 -179.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -166.11 166.38 17.14 Favored 'General case' 0 C--O 1.241 0.619 0 N-CA-C 102.445 -3.169 . . . . 10.0 102.445 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.503 ' CZ3' ' HB2' ' A' ' 41' ' ' GLU 0.302 18.1 p90 -144.3 -173.71 4.1 Favored 'General case' 0 C--N 1.314 -0.942 0 C-N-CA 126.591 1.957 . . . . 10.0 113.458 179.964 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.474 ' N ' ' CD1' ' A' ' 8' ' ' TRP . 0.0 OUTLIER 162.5 72.71 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.575 0 O-C-N 127.428 2.955 . . . . 10.0 106.271 177.757 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 0.51 -58.46 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.924 0 O-C-N 127.697 3.123 . . . . 10.0 117.57 -179.459 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.449 ' N ' ' O ' ' A' ' 9' ' ' LYS . 0.2 OUTLIER 81.71 -58.17 0.24 Allowed 'General case' 0 C--O 1.246 0.92 0 C-N-CA 127.421 2.288 . . . . 10.0 107.671 179.83 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -163.71 159.3 21.34 Favored 'General case' 0 C--N 1.323 -0.574 0 O-C-N 125.178 1.549 . . . . 10.0 114.114 179.844 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 4.6 p-10 -157.57 164.16 37.59 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 112.429 -2.169 . . . . 10.0 108.291 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -144.31 -178.92 6.21 Favored 'General case' 0 C--O 1.219 -0.515 0 O-C-N 125.623 1.827 . . . . 10.0 111.88 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 28.09 44.13 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.555 0 O-C-N 126.458 2.349 . . . . 10.0 114.119 179.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -72.13 -45.79 59.16 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-O 117.88 -1.057 . . . . 10.0 110.608 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -78.4 -22.51 47.69 Favored 'General case' 0 C--O 1.218 -0.567 0 CA-C-O 123.488 1.613 . . . . 10.0 110.358 179.82 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -76.55 -27.06 55.77 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 123.499 1.619 . . . . 10.0 107.11 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -77.25 -33.65 55.98 Favored 'General case' 0 CA--C 1.55 0.947 0 CA-C-N 113.475 -1.693 . . . . 10.0 110.49 -179.856 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 83.5 mt -70.55 -31.28 68.27 Favored 'General case' 0 C--O 1.215 -0.712 0 O-C-N 124.501 1.126 . . . . 10.0 110.561 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.56 -22.77 58.83 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 114.972 -1.013 . . . . 10.0 110.383 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.93 -31.34 67.92 Favored 'General case' 0 C--O 1.214 -0.807 0 CA-C-N 119.154 0.888 . . . . 10.0 112.287 179.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.8 mt -92.26 -21.36 20.37 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 124.658 1.224 . . . . 10.0 109.175 179.568 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 34.9 t0 76.98 49.36 0.05 Allowed 'General case' 0 C--O 1.244 0.788 0 N-CA-C 115.849 1.796 . . . . 10.0 115.849 -179.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 33.1 m -80.12 -179.2 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.815 0 O-C-N 118.716 -2.49 . . . . 10.0 108.406 179.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -60.54 155.48 18.48 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 119.093 -1.043 . . . . 10.0 111.769 179.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.6 m -75.91 -26.09 17.51 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.921 0 N-CA-C 116.834 2.161 . . . . 10.0 116.834 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -77.52 -25.26 50.09 Favored 'General case' 0 C--O 1.243 0.755 0 O-C-N 121.047 -1.033 . . . . 10.0 109.866 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.38 -31.14 65.33 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 114.625 -1.171 . . . . 10.0 111.757 -179.693 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.4 ttm180 -68.39 -33.3 74.0 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 125.791 1.636 . . . . 10.0 110.223 179.667 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -74.39 -40.29 62.15 Favored 'General case' 0 CA--C 1.508 -0.65 0 CA-C-N 113.168 -1.833 . . . . 10.0 111.535 -179.746 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.527 HG21 ' CE1' ' A' ' 57' ' ' PHE . 0.4 OUTLIER -73.58 -52.57 20.74 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 CA-C-O 122.471 1.129 . . . . 10.0 112.975 179.968 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -56.06 -21.8 23.96 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 112.511 -2.131 . . . . 10.0 112.659 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -66.87 -47.67 71.16 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-O 118.231 -0.89 . . . . 10.0 112.656 -179.742 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.2 pp -73.01 -2.53 21.48 Favored 'General case' 0 CA--C 1.517 -0.303 0 O-C-N 125.091 1.494 . . . . 10.0 114.088 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -103.66 156.04 18.1 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 122.928 1.347 . . . . 10.0 112.748 179.504 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.403 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 17.4 mttt -140.32 126.94 12.08 Favored Pre-proline 0 N--CA 1.466 0.347 0 N-CA-C 105.689 -1.967 . . . . 10.0 105.689 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 37' ' ' LYS . 12.5 Cg_exo -86.27 153.14 9.4 Favored 'Trans proline' 0 CA--C 1.538 0.715 0 C-N-CA 124.836 3.69 . . . . 10.0 116.632 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.477 ' CB ' ' NE1' ' A' ' 8' ' ' TRP . 0.5 OUTLIER -114.63 166.74 11.41 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 125.571 1.548 . . . . 10.0 106.974 179.872 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.42 ' HB3' ' CZ ' ' A' ' 130' ' ' PHE . 9.4 ttmt -161.36 104.93 1.27 Allowed 'General case' 0 CA--C 1.496 -1.103 0 C-N-CA 116.697 -2.001 . . . . 10.0 112.148 -179.643 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.503 ' HB2' ' CZ3' ' A' ' 8' ' ' TRP . 27.6 tt0 -94.79 135.64 36.04 Favored 'General case' 0 C--O 1.24 0.556 0 N-CA-C 102.41 -3.182 . . . . 10.0 102.41 179.881 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.431 HG21 ' N ' ' A' ' 43' ' ' VAL . 62.4 mt -120.62 150.78 23.42 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 CA-C-N 120.291 1.405 . . . . 10.0 109.319 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.431 ' N ' HG21 ' A' ' 42' ' ' ILE . 0.2 OUTLIER -141.84 127.19 17.87 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 N-CA-C 103.898 -2.63 . . . . 10.0 103.898 -179.882 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -132.62 103.52 6.18 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 125.203 1.564 . . . . 10.0 110.953 -179.757 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -69.45 -63.05 1.14 Allowed 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 106.262 -1.755 . . . . 10.0 106.262 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -163.67 -78.75 0.03 OUTLIER Glycine 0 CA--C 1.532 1.108 0 N-CA-C 109.614 -1.394 . . . . 10.0 109.614 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -107.24 53.71 0.69 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 123.351 1.548 . . . . 10.0 109.089 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -163.43 168.52 20.16 Favored 'General case' 0 C--O 1.215 -0.733 0 N-CA-C 105.041 -2.207 . . . . 10.0 105.041 -179.846 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.405 ' HG2' ' CD1' ' A' ' 51' ' ' ILE . 6.6 ttp -163.41 102.54 0.95 Allowed 'General case' 0 C--O 1.216 -0.659 0 O-C-N 126.112 2.132 . . . . 10.0 112.317 179.66 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 2.3 mp -93.98 100.6 11.43 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.759 0 O-C-N 124.483 1.115 . . . . 10.0 108.177 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.405 ' CD1' ' HG2' ' A' ' 49' ' ' MET . 0.4 OUTLIER -95.59 114.82 33.12 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.805 0 CA-C-O 123.722 1.725 . . . . 10.0 106.745 -179.897 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -115.03 125.97 54.19 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 112.926 -1.943 . . . . 10.0 111.843 179.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 26.7 m -112.32 121.71 45.66 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 100.908 -3.738 . . . . 10.0 100.908 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.9 mt -94.64 12.82 26.3 Favored 'General case' 0 CA--C 1.513 -0.467 0 N-CA-C 121.597 3.925 . . . . 10.0 121.597 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.2 p -68.19 129.08 38.86 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 103.908 -2.627 . . . . 10.0 103.908 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -83.32 156.53 23.0 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 107.869 -1.16 . . . . 10.0 107.869 -179.906 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.527 ' CE1' HG21 ' A' ' 32' ' ' ILE . 3.9 t80 83.75 10.77 0.46 Allowed 'General case' 0 C--N 1.324 -0.506 0 O-C-N 126.468 2.355 . . . . 10.0 105.308 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 5.7 mtp85 -151.45 -69.01 0.17 Allowed 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 126.066 1.747 . . . . 10.0 111.235 -179.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 24.49 88.91 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.775 0 O-C-N 128.441 3.588 . . . . 10.0 112.139 179.66 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 46.3 p90 -121.78 148.85 44.14 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 106.86 -1.533 . . . . 10.0 106.86 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.2 mp -133.27 158.87 43.14 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.869 0 N-CA-C 112.475 0.546 . . . . 10.0 112.475 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -141.86 158.31 43.94 Favored 'General case' 0 C--O 1.215 -0.715 0 N-CA-C 107.031 -1.47 . . . . 10.0 107.031 -179.672 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 29.9 t0 -125.63 77.73 1.68 Allowed 'General case' 0 N--CA 1.441 -0.876 0 N-CA-C 104.279 -2.489 . . . . 10.0 104.279 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 8.4 m-30 -76.8 177.03 7.95 Favored 'General case' 0 C--O 1.242 0.686 0 N-CA-C 115.898 1.814 . . . . 10.0 115.898 -179.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 56.5 mt-30 -151.61 123.65 8.14 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 125.038 1.461 . . . . 10.0 108.089 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 53.2 t -58.16 137.79 19.96 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 C-N-CA 125.848 1.659 . . . . 10.0 109.156 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 65.74 9.89 47.59 Favored Glycine 0 N--CA 1.439 -1.108 0 CA-C-O 118.418 -1.212 . . . . 10.0 114.506 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.06 165.58 12.49 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 120.714 2.257 . . . . 10.0 112.442 179.668 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -122.34 149.11 44.22 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 108.09 -1.078 . . . . 10.0 108.09 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -152.38 -170.66 3.7 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 122.98 1.371 . . . . 10.0 110.528 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -143.73 110.38 5.56 Favored 'General case' 0 C--N 1.319 -0.73 0 C-N-CA 119.139 -1.024 . . . . 10.0 110.468 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -95.8 72.77 3.07 Favored 'General case' 0 N--CA 1.441 -0.877 0 O-C-N 120.385 -1.447 . . . . 10.0 111.172 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.44 ' HA ' ' CB ' ' A' ' 81' ' ' LYS . 6.0 p-10 -44.59 137.33 3.86 Favored 'General case' 0 C--N 1.315 -0.929 0 O-C-N 128.945 3.903 . . . . 10.0 105.815 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.424 HD22 ' N ' ' A' ' 75' ' ' THR . 0.8 OUTLIER 63.85 119.72 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 116.748 2.129 . . . . 10.0 116.748 -179.717 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.427 ' O ' ' N ' ' A' ' 79' ' ' ASP . 1.7 m -104.6 102.42 12.03 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 106.794 -1.558 . . . . 10.0 106.794 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -57.9 101.35 0.18 Allowed Glycine 0 CA--C 1.531 1.054 0 CA-C-O 115.945 -2.586 . . . . 10.0 110.216 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 7.0 mt 134.32 -68.53 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.954 0 O-C-N 127.748 2.675 . . . . 10.0 109.81 179.522 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -103.41 8.29 38.03 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 112.908 0.707 . . . . 10.0 112.908 -179.526 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . 0.427 ' N ' ' O ' ' A' ' 75' ' ' THR . 0.0 OUTLIER 44.02 -166.71 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 127.136 2.174 . . . . 10.0 116.472 -179.694 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 78.08 156.52 0.17 Allowed 'General case' 0 CA--C 1.505 -0.766 0 CA-C-O 122.35 1.072 . . . . 10.0 110.998 179.761 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.44 ' CB ' ' HA ' ' A' ' 73' ' ' ASP . 1.4 pttm -96.11 136.61 36.34 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 105.32 -2.104 . . . . 10.0 105.32 179.804 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -120.45 137.71 54.19 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 125.651 1.58 . . . . 10.0 107.481 179.701 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.3 mtp -100.95 91.48 4.6 Favored 'General case' 0 N--CA 1.441 -0.897 0 N-CA-C 102.926 -2.99 . . . . 10.0 102.926 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 68.7 m -91.83 129.13 37.85 Favored 'General case' 0 C--O 1.215 -0.761 0 N-CA-C 114.121 1.156 . . . . 10.0 114.121 179.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 40.9 m -127.2 118.02 23.48 Favored 'General case' 0 N--CA 1.44 -0.94 0 O-C-N 126.564 2.415 . . . . 10.0 104.594 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 22.9 m -91.42 -175.75 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 N-CA-C 104.084 -2.561 . . . . 10.0 104.084 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 172.2 132.76 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.86 0 O-C-N 124.256 0.973 . . . . 10.0 111.268 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . 0.521 ' CD1' ' HA ' ' A' ' 91' ' ' ASP . 0.7 OUTLIER -78.74 80.83 5.08 Favored 'General case' 0 C--O 1.22 -0.469 0 N-CA-C 105.209 -2.145 . . . . 10.0 105.209 179.873 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -95.22 105.47 17.41 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 103.986 -2.598 . . . . 10.0 103.986 179.777 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 67.13 31.62 78.13 Favored Glycine 0 CA--C 1.504 -0.608 0 N-CA-C 108.552 -1.819 . . . . 10.0 108.552 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.521 ' HA ' ' CD1' ' A' ' 88' ' ' TRP . 0.5 OUTLIER 73.81 -11.59 0.94 Allowed 'General case' 0 C--O 1.236 0.394 0 CA-C-N 119.694 1.747 . . . . 10.0 114.768 179.911 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.488 ' HD3' ' CZ3' ' A' ' 109' ' ' TRP . 11.0 pttm -90.45 151.76 21.25 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 106.797 -1.557 . . . . 10.0 106.797 -179.863 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.41 92.73 7.07 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 106.104 -1.813 . . . . 10.0 106.104 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -98.41 95.88 7.63 Favored 'General case' 0 C--O 1.214 -0.789 0 O-C-N 120.515 -1.366 . . . . 10.0 110.003 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 30.8 p -106.25 143.87 33.76 Favored 'General case' 0 CA--C 1.507 -0.693 0 CA-C-O 124.382 2.039 . . . . 10.0 114.102 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -123.02 138.91 51.44 Favored 'Isoleucine or valine' 0 C--O 1.245 0.827 0 N-CA-C 104.551 -2.389 . . . . 10.0 104.551 179.801 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -123.41 76.23 1.38 Allowed 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.33 1.019 . . . . 10.0 112.642 -179.802 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 3.5 mmmt -46.39 124.92 6.24 Favored 'General case' 0 CA--C 1.512 -0.492 0 N-CA-C 113.753 1.02 . . . . 10.0 113.753 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 172.34 62.48 0.04 OUTLIER Glycine 0 CA--C 1.501 -0.82 0 O-C-N 126.081 2.113 . . . . 10.0 112.337 179.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 75.88 -172.44 0.1 Allowed 'General case' 0 C--N 1.316 -0.864 0 O-C-N 126.433 1.902 . . . . 10.0 114.574 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 13.0 mmtt 65.34 -177.25 0.18 Allowed 'General case' 0 N--CA 1.442 -0.873 0 CA-C-O 123.689 1.709 . . . . 10.0 113.184 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -124.3 49.6 1.77 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 113.519 -1.673 . . . . 10.0 114.231 179.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 153.21 36.59 0.03 OUTLIER Glycine 0 C--O 1.218 -0.885 0 N-CA-C 118.814 2.285 . . . . 10.0 118.814 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 43.3 mtp180 -75.95 163.64 26.97 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 116.951 0.375 . . . . 10.0 110.11 179.592 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 119.29 144.54 7.38 Favored Glycine 0 N--CA 1.437 -1.27 0 C-N-CA 118.956 -1.592 . . . . 10.0 110.225 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 19.1 m0 -111.27 173.89 6.12 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-O 117.123 -1.418 . . . . 10.0 109.267 179.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 2.7 m -147.96 135.73 20.94 Favored 'General case' 0 C--O 1.209 -1.07 0 O-C-N 124.908 1.38 . . . . 10.0 108.384 179.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -120.56 131.25 54.57 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 125.758 1.911 . . . . 10.0 107.974 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' TRP . . . . . 0.488 ' CZ3' ' HD3' ' A' ' 92' ' ' LYS . 2.6 t-105 -146.37 124.87 12.4 Favored 'General case' 0 CA--C 1.5 -0.959 0 CA-C-O 122.453 1.121 . . . . 10.0 110.134 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.541 ' CD1' ' CD1' ' A' ' 4' ' ' PHE . 43.2 mt -99.16 124.6 52.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 116.281 1.956 . . . . 10.0 116.281 179.63 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -129.78 110.25 11.6 Favored 'General case' 0 CA--C 1.509 -0.611 0 O-C-N 126.318 2.261 . . . . 10.0 105.514 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 53.97 -104.4 0.23 Allowed Glycine 0 N--CA 1.459 0.227 0 N-CA-C 108.682 -1.767 . . . . 10.0 108.682 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -114.86 4.0 14.75 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 125.331 1.253 . . . . 10.0 110.683 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 73.5 tt0 -102.96 101.52 11.54 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 115.176 1.547 . . . . 10.0 115.176 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.413 ' HB3' ' HB3' ' A' ' 130' ' ' PHE . 0.2 OUTLIER -67.48 107.65 2.54 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 103.574 -2.75 . . . . 10.0 103.574 179.764 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -99.34 103.63 15.46 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 119.671 -1.893 . . . . 10.0 110.372 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.427 HD22 ' HB2' ' A' ' 128' ' ' GLN . 0.0 OUTLIER -103.73 143.06 33.3 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 124.228 1.966 . . . . 10.0 111.534 179.814 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -141.01 120.14 12.88 Favored 'General case' 0 CA--C 1.5 -0.98 0 O-C-N 120.507 -1.37 . . . . 10.0 108.758 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.42 ' HE1' HD11 ' A' ' 117' ' ' LEU . 3.5 mtm -95.53 -174.85 3.29 Favored 'General case' 0 N--CA 1.439 -1.007 0 N-CA-C 113.779 1.029 . . . . 10.0 113.779 179.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 9.2 tpt180 -167.84 129.8 1.51 Allowed 'General case' 0 N--CA 1.445 -0.695 0 O-C-N 124.238 0.961 . . . . 10.0 112.912 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -156.91 121.16 4.36 Favored 'General case' 0 CA--C 1.503 -0.832 0 CA-C-O 122.936 1.35 . . . . 10.0 110.037 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 59.99 14.52 4.39 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 124.022 1.868 . . . . 10.0 115.338 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 105.9 9.55 32.22 Favored Glycine 0 C--O 1.241 0.591 0 O-C-N 120.818 -1.176 . . . . 10.0 115.775 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 20.1 m -101.69 164.32 3.05 Favored 'Isoleucine or valine' 0 C--O 1.239 0.539 0 CA-C-N 118.77 1.285 . . . . 10.0 110.061 179.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 1.3 m -131.41 108.67 9.78 Favored 'General case' 0 N--CA 1.447 -0.599 0 O-C-N 125.3 1.625 . . . . 10.0 114.558 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -111.47 137.45 49.26 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 104.753 -2.314 . . . . 10.0 104.753 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.88 166.98 23.15 Favored 'General case' 0 CA--C 1.509 -0.618 0 O-C-N 125.362 1.664 . . . . 10.0 114.913 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . 0.427 ' HB2' HD22 ' A' ' 117' ' ' LEU . 3.8 mt-30 -139.99 163.76 31.83 Favored 'General case' 0 C--O 1.242 0.7 0 O-C-N 125.902 2.001 . . . . 10.0 108.665 -179.836 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 6.9 m -125.98 66.95 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 N-CA-C 105.713 -1.958 . . . . 10.0 105.713 179.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . 0.439 ' CE1' ' HB2' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -56.22 132.34 50.33 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 125.576 1.55 . . . . 10.0 109.309 -179.927 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 37.4 tptt -111.48 104.78 13.22 Favored 'General case' 0 C--O 1.242 0.68 0 N-CA-C 106.387 -1.708 . . . . 10.0 106.387 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 1.4 ttpt -73.72 97.62 2.74 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 105.467 -2.049 . . . . 10.0 105.467 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 2.6 t -42.97 -31.9 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 124.546 1.154 . . . . 10.0 112.947 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 10.1 t60 . . . . . 0 C--N 1.317 -0.837 0 O-C-N 127.372 2.92 . . . . 10.0 110.924 179.677 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.0 t0 . . . . . 0 C--O 1.233 0.235 0 CA-C-O 118.69 -0.671 . . . . 10.0 111.268 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -175.45 -49.38 0.01 OUTLIER 'General case' 0 C--O 1.244 0.776 0 N-CA-C 116.356 1.984 . . . . 10.0 116.356 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 35.0 t-20 -35.91 104.5 0.03 OUTLIER 'General case' 0 C--O 1.241 0.655 0 N-CA-C 115.659 1.726 . . . . 10.0 115.659 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -148.06 -137.04 2.83 Favored Glycine 0 C--O 1.217 -0.906 0 N-CA-C 117.61 1.804 . . . . 10.0 117.61 179.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 15.4 t80 -156.26 101.08 2.04 Favored 'General case' 0 C--O 1.242 0.691 0 N-CA-C 102.964 -2.976 . . . . 10.0 102.964 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.668 ' CE3' ' CE2' ' A' ' 130' ' ' PHE . 0.0 OUTLIER -90.59 121.93 32.95 Favored 'General case' 0 C--N 1.312 -1.04 0 N-CA-C 114.657 1.354 . . . . 10.0 114.657 -179.972 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.69 132.25 42.54 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 103.033 -2.951 . . . . 10.0 103.033 178.825 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.42 ' HG2' ' HB3' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -78.98 150.52 31.97 Favored 'General case' 0 C--N 1.312 -1.049 0 N-CA-C 116.386 1.995 . . . . 10.0 116.386 -179.419 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.9 tp -124.02 -59.21 1.51 Allowed 'General case' 0 CA--C 1.505 -0.778 0 CA-C-N 113.265 -1.789 . . . . 10.0 111.535 -179.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -131.73 172.38 12.34 Favored 'General case' 0 C--O 1.221 -0.413 0 N-CA-C 115.958 1.836 . . . . 10.0 115.958 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -161.57 135.32 6.62 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 111.375 -2.648 . . . . 10.0 109.037 179.814 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -107.05 -77.13 0.6 Allowed 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 115.818 1.784 . . . . 10.0 115.818 -179.828 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 36.1 m120 -96.4 58.51 1.77 Allowed 'General case' 0 C--N 1.32 -0.683 0 O-C-N 126.525 2.391 . . . . 10.0 111.389 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -70.06 -58.56 3.68 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 113.651 0.982 . . . . 10.0 113.651 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 64.3 mt-10 -67.86 -29.06 68.1 Favored 'General case' 0 C--O 1.243 0.719 0 C-N-CA 123.758 0.823 . . . . 10.0 112.74 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -76.39 -23.33 54.08 Favored 'General case' 0 C--O 1.218 -0.561 0 C-N-CA 119.118 -1.033 . . . . 10.0 109.652 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -73.98 -41.91 61.24 Favored 'General case' 0 CA--C 1.557 1.235 0 C-N-CA 124.455 1.102 . . . . 10.0 109.146 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.8 mt -70.7 -28.27 64.62 Favored 'General case' 0 C--O 1.217 -0.645 0 O-C-N 126.35 2.281 . . . . 10.0 112.891 -179.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.8 ttm-85 -73.61 -29.3 62.28 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 113.464 -1.698 . . . . 10.0 108.517 -179.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.3 -29.89 67.85 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 120.625 -1.297 . . . . 10.0 113.678 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 20.4 mt -105.45 1.2 27.49 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 125.35 1.656 . . . . 10.0 114.529 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 43.64 82.83 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.01 0 O-C-N 126.158 2.161 . . . . 10.0 110.164 -179.757 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 15.5 m -113.79 46.02 0.31 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.54 0 CA-C-N 113.344 -1.753 . . . . 10.0 111.167 -179.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 65.44 138.47 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 114.676 1.361 . . . . 10.0 114.676 179.781 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 31.1 m -64.12 -31.26 52.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 117.181 2.289 . . . . 10.0 117.181 -179.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -73.64 -41.48 62.69 Favored 'General case' 0 C--O 1.245 0.85 0 CA-C-N 114.373 -1.285 . . . . 10.0 111.748 -179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.54 -34.73 78.92 Favored 'General case' 0 C--O 1.223 -0.333 0 C-N-CA 123.628 0.771 . . . . 10.0 112.646 -179.604 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.93 -33.41 51.73 Favored 'General case' 0 CA--C 1.542 0.636 0 O-C-N 125.074 1.484 . . . . 10.0 111.488 179.718 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 33.1 ttmt -77.67 -33.71 53.28 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 123.064 1.411 . . . . 10.0 108.502 179.347 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -78.28 -38.93 23.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 N-CA-C 108.446 -0.946 . . . . 10.0 108.446 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -73.15 -20.1 60.98 Favored 'General case' 0 C--N 1.317 -0.814 0 O-C-N 124.386 1.054 . . . . 10.0 110.314 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -77.35 -33.11 55.41 Favored 'General case' 0 C--N 1.32 -0.689 0 O-C-N 121.46 -0.775 . . . . 10.0 111.677 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 73.3 mt -95.0 31.79 1.8 Allowed 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 122.24 1.019 . . . . 10.0 108.611 179.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 10.3 tp -153.83 140.59 19.06 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.495 1.118 . . . . 10.0 109.35 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.42 ' HB3' ' HG2' ' A' ' 10' ' ' MET . 0.5 OUTLIER -122.02 119.43 28.8 Favored Pre-proline 0 N--CA 1.47 0.57 0 N-CA-C 105.348 -2.093 . . . . 10.0 105.348 179.823 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -76.43 111.49 3.27 Favored 'Trans proline' 0 N--CA 1.446 -1.313 1 C-N-CA 126.365 4.71 . . . . 10.0 118.925 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -83.41 122.01 27.93 Favored 'General case' 0 C--O 1.219 -0.518 0 N-CA-C 104.329 -2.471 . . . . 10.0 104.329 179.12 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.557 ' HE3' ' CH2' ' A' ' 8' ' ' TRP . 2.5 ttpt -104.62 131.84 51.56 Favored 'General case' 0 C--O 1.209 -1.067 0 CA-C-O 123.293 1.521 . . . . 10.0 112.905 -179.511 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -115.88 129.34 56.37 Favored 'General case' 0 C--O 1.239 0.522 0 N-CA-C 104.841 -2.281 . . . . 10.0 104.841 179.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.5 mt -102.76 144.62 13.42 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 C-N-CA 119.012 -1.075 . . . . 10.0 113.331 179.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 92.8 t -140.73 124.2 16.83 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.938 0 N-CA-C 104.427 -2.434 . . . . 10.0 104.427 179.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -111.04 154.19 24.56 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 108.718 -0.845 . . . . 10.0 108.718 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -131.75 53.71 1.98 Allowed 'General case' 0 C--O 1.236 0.359 0 CA-C-O 123.163 1.459 . . . . 10.0 107.352 179.834 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 77.03 -92.45 1.04 Allowed Glycine 0 C--N 1.339 0.708 0 N-CA-C 105.602 -2.999 . . . . 10.0 105.602 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -92.48 -49.2 6.25 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 108.138 -1.06 . . . . 10.0 108.138 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 43.4 m170 -60.52 141.73 56.18 Favored 'General case' 0 C--O 1.218 -0.581 0 CA-C-O 122.482 1.134 . . . . 10.0 108.556 179.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 33.1 ttp -135.1 141.95 46.15 Favored 'General case' 0 N--CA 1.437 -1.101 0 CA-C-N 113.635 -1.62 . . . . 10.0 111.493 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 3.2 mt -130.19 136.73 58.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 106.701 -1.592 . . . . 10.0 106.701 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.441 ' HB ' ' HB2' ' A' ' 62' ' ' MET . 1.7 mm -119.93 105.36 17.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 122.998 1.38 . . . . 10.0 108.759 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 21.5 mtp85 -89.98 113.36 25.01 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 113.7 -1.591 . . . . 10.0 109.423 179.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 4.3 m -108.83 95.52 5.71 Favored 'General case' 0 C--O 1.239 0.543 0 N-CA-C 100.286 -3.968 . . . . 10.0 100.286 -180.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -95.33 146.09 24.63 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 117.531 2.419 . . . . 10.0 117.531 179.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -159.19 174.49 14.77 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 113.008 -1.905 . . . . 10.0 106.898 179.817 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 19.9 p -95.47 -8.71 34.61 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 121.647 -0.658 . . . . 10.0 110.82 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 6.4 t80 -92.6 -50.33 5.66 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 124.996 1.319 . . . . 10.0 109.461 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.89 -177.1 5.29 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 125.332 1.645 . . . . 10.0 111.052 179.714 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -138.68 156.83 47.08 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-O 124.276 1.989 . . . . 10.0 113.883 179.631 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -123.87 112.79 17.67 Favored 'General case' 0 C--O 1.211 -0.928 0 N-CA-C 104.904 -2.258 . . . . 10.0 104.904 179.827 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 19.9 mm -114.19 129.86 69.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 O-C-N 124.184 0.928 . . . . 10.0 110.65 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' MET . . . . . 0.522 ' HE1' ' CZ ' ' A' ' 64' ' ' PHE . 3.0 mtt -130.19 156.3 44.82 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 107.134 -1.432 . . . . 10.0 107.134 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -141.43 75.13 1.48 Allowed 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 103.797 -2.668 . . . . 10.0 103.797 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.522 ' CZ ' ' HE1' ' A' ' 62' ' ' MET . 2.6 m-30 -76.66 162.87 27.38 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 114.378 1.251 . . . . 10.0 114.378 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -131.32 107.1 8.72 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 113.322 -1.763 . . . . 10.0 108.34 -179.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -64.29 135.19 28.31 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 N-CA-C 108.255 -1.017 . . . . 10.0 108.255 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 56.39 36.25 69.08 Favored Glycine 0 N--CA 1.437 -1.257 0 O-C-N 126.016 2.073 . . . . 10.0 117.254 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -156.42 139.23 15.21 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 115.256 1.576 . . . . 10.0 115.256 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -52.7 138.83 27.88 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-O 119.16 -0.448 . . . . 10.0 111.786 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -140.75 96.22 2.98 Favored 'General case' 0 C--O 1.243 0.753 0 CA-C-O 123.209 1.48 . . . . 10.0 113.02 179.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -74.86 137.82 42.06 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 105.003 -2.221 . . . . 10.0 105.003 -179.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -138.58 130.53 28.16 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 124.228 1.011 . . . . 10.0 113.288 -179.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 20.9 p-10 -104.6 118.42 36.53 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-O 125.233 2.444 . . . . 10.0 111.684 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -124.66 126.62 46.04 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 116.658 2.096 . . . . 10.0 116.658 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -144.04 104.68 4.17 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 107.955 -1.128 . . . . 10.0 107.955 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 140.66 -80.42 0.26 Allowed Glycine 0 N--CA 1.442 -0.951 0 C-N-CA 119.766 -1.207 . . . . 10.0 111.047 -179.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -84.74 96.18 4.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 N-CA-C 106.302 -1.74 . . . . 10.0 106.302 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.48 -19.33 0.4 Allowed 'General case' 0 C--O 1.243 0.741 0 N-CA-C 115.16 1.541 . . . . 10.0 115.16 -179.919 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.0 p30 49.75 -164.25 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 125.756 1.622 . . . . 10.0 114.733 -179.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 8.6 ttm-85 83.82 143.74 0.07 Allowed 'General case' 0 C--N 1.32 -0.7 0 O-C-N 125.303 1.627 . . . . 10.0 110.906 179.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 5.5 pttt -93.98 165.34 12.7 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 102.412 -3.181 . . . . 10.0 102.412 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -155.1 144.42 21.12 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 120.89 -1.131 . . . . 10.0 108.695 179.848 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 31.2 mtt -114.34 52.05 0.85 Allowed 'General case' 0 N--CA 1.439 -1.001 0 N-CA-C 102.865 -3.013 . . . . 10.0 102.865 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 50.2 m -52.23 126.09 17.84 Favored 'General case' 0 N--CA 1.442 -0.862 0 N-CA-C 117.44 2.385 . . . . 10.0 117.44 -179.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 9.3 m -125.46 112.74 16.61 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 103.668 -2.716 . . . . 10.0 103.668 179.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.506 HG22 ' CD2' ' A' ' 64' ' ' PHE . 31.6 t -85.06 159.55 3.34 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.594 0 N-CA-C 101.095 -3.669 . . . . 10.0 101.095 -179.805 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -156.0 165.75 35.53 Favored 'General case' 0 C--N 1.318 -0.789 0 O-C-N 125.022 1.451 . . . . 10.0 113.296 179.857 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . 0.465 ' CD1' ' C ' ' A' ' 88' ' ' TRP . 0.0 OUTLIER -115.41 125.37 53.06 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 105.308 -2.108 . . . . 10.0 105.308 179.922 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -142.77 103.75 4.25 Favored 'General case' 0 CA--C 1.506 -0.726 0 N-CA-C 101.559 -3.497 . . . . 10.0 101.559 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 74.63 -146.94 36.27 Favored Glycine 0 CA--C 1.501 -0.796 0 N-CA-C 109.271 -1.531 . . . . 10.0 109.271 179.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -97.32 20.32 11.73 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-O 122.446 1.117 . . . . 10.0 109.681 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 6.6 mtmm -104.58 -174.67 2.59 Favored 'General case' 0 CA--C 1.508 -0.647 0 O-C-N 120.741 -1.225 . . . . 10.0 109.633 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 8.1 tp -131.36 128.6 39.99 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 103.125 -2.917 . . . . 10.0 103.125 179.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 6.6 mp0 -128.07 125.66 39.71 Favored 'General case' 0 C--N 1.316 -0.873 0 O-C-N 124.941 1.401 . . . . 10.0 112.515 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -124.7 125.62 44.38 Favored 'General case' 0 C--N 1.321 -0.667 0 O-C-N 121.9 -0.5 . . . . 10.0 109.845 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 71.1 t -120.8 142.95 34.57 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 N-CA-C 107.326 -1.361 . . . . 10.0 107.326 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 11.2 mt-30 -126.47 146.31 50.15 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 117.702 -1.142 . . . . 10.0 110.983 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 25.6 mmtt -86.24 -96.95 0.08 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 117.426 -1.273 . . . . 10.0 110.183 -179.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 51.4 -166.52 0.75 Allowed Glycine 0 CA--C 1.503 -0.674 0 O-C-N 124.126 0.891 . . . . 10.0 111.307 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -82.13 -170.11 2.73 Favored 'General case' 0 N--CA 1.447 -0.603 0 N-CA-C 112.788 0.662 . . . . 10.0 112.788 179.747 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 4.3 mttm 71.18 -158.75 0.13 Allowed 'General case' 0 N--CA 1.442 -0.867 0 CA-C-O 122.878 1.323 . . . . 10.0 113.178 179.78 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -146.75 18.2 1.29 Allowed 'General case' 0 CA--C 1.506 -0.736 0 O-C-N 119.861 -1.775 . . . . 10.0 115.272 -179.845 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -156.55 27.12 0.53 Allowed Glycine 0 C--O 1.226 -0.386 0 N-CA-C 118.226 2.05 . . . . 10.0 118.226 -179.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 8.6 mtm180 -86.07 117.78 25.12 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 121.492 -1.005 . . . . 10.0 109.641 179.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 163.24 151.58 6.48 Favored Glycine 0 N--CA 1.437 -1.242 0 O-C-N 125.66 1.85 . . . . 10.0 110.57 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' TRP . . . . . 0.437 ' CE2' ' HE3' ' A' ' 119' ' ' MET . 1.8 m0 -114.1 161.27 17.97 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 108.035 -1.098 . . . . 10.0 108.035 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.9 m -142.31 131.23 23.0 Favored 'General case' 0 C--O 1.212 -0.92 0 O-C-N 124.628 1.205 . . . . 10.0 110.984 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 -119.3 131.57 55.77 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.602 1.161 . . . . 10.0 109.603 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' TRP . . . . . 0.492 ' C ' ' CD1' ' A' ' 109' ' ' TRP . 0.0 OUTLIER -137.47 113.71 10.04 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 106.871 -1.529 . . . . 10.0 106.871 179.977 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -86.27 146.41 6.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 N-CA-C 116.38 1.992 . . . . 10.0 116.38 179.76 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -149.94 127.49 11.57 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-O 116.072 -1.918 . . . . 10.0 107.575 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 46.61 -129.23 11.37 Favored Glycine 0 CA--C 1.534 1.233 0 N-CA-C 106.24 -2.744 . . . . 10.0 106.24 179.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -95.51 29.11 2.68 Favored 'General case' 0 C--N 1.321 -0.659 0 O-C-N 124.829 0.958 . . . . 10.0 113.304 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -140.71 151.8 44.8 Favored 'General case' 0 C--O 1.24 0.595 0 CA-C-N 119.801 1.182 . . . . 10.0 111.634 179.855 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.541 ' HG ' ' CE2' ' A' ' 130' ' ' PHE . 0.7 OUTLIER -108.99 130.8 55.48 Favored 'General case' 0 C--N 1.316 -0.869 0 O-C-N 125.949 2.03 . . . . 10.0 108.992 179.882 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . 0.457 ' CE1' HG21 ' A' ' 129' ' ' VAL . 13.0 m80 -111.59 98.77 7.67 Favored 'General case' 0 CA--C 1.503 -0.83 0 N-CA-C 108.369 -0.974 . . . . 10.0 108.369 -179.809 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 15.7 tp -80.49 121.9 26.34 Favored 'General case' 0 CA--C 1.51 -0.567 0 C-N-CA 118.141 -1.424 . . . . 10.0 113.606 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -113.34 88.13 2.76 Favored 'General case' 0 C--O 1.214 -0.79 0 N-CA-C 104.239 -2.504 . . . . 10.0 104.239 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.437 ' HE3' ' CE2' ' A' ' 106' ' ' TRP . 0.0 OUTLIER -83.47 149.96 26.31 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-N 114.387 -1.278 . . . . 10.0 111.447 -179.868 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 24.4 mtt180 -144.56 137.52 26.84 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 120.466 1.485 . . . . 10.0 114.237 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -150.18 133.61 16.49 Favored 'General case' 0 CA--C 1.507 -0.701 0 N-CA-C 107.073 -1.454 . . . . 10.0 107.073 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 40.74 44.73 1.93 Allowed 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 116.943 2.201 . . . . 10.0 116.943 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 91.95 -11.96 70.76 Favored Glycine 0 CA--C 1.533 1.201 0 O-C-N 120.711 -1.243 . . . . 10.0 115.935 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 92.7 t -90.28 154.74 3.13 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 N-CA-C 107.385 -1.339 . . . . 10.0 107.385 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 34.5 m -144.57 92.35 2.29 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-O 124.728 2.204 . . . . 10.0 111.062 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -79.93 144.18 33.58 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-N 112.847 -1.978 . . . . 10.0 106.615 -179.839 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.18 101.01 5.4 Favored 'General case' 0 CA--C 1.504 -0.818 0 O-C-N 125.127 1.517 . . . . 10.0 110.948 -179.806 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.79 156.47 18.02 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 122.715 1.245 . . . . 10.0 108.625 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.457 HG21 ' CE1' ' A' ' 116' ' ' HIS . 11.0 p -143.73 137.29 24.67 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-O 117.296 -1.335 . . . . 10.0 107.756 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . 0.668 ' CE2' ' CE3' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -138.61 -169.98 2.73 Favored 'General case' 0 C--N 1.315 -0.894 0 O-C-N 125.138 1.524 . . . . 10.0 108.751 -179.858 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . 0.287 16.3 tptp -142.97 129.43 20.08 Favored 'General case' 0 C--N 1.32 -0.714 0 O-C-N 119.362 -2.086 . . . . 10.0 105.962 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 11.5 mtpt -81.47 110.55 16.98 Favored 'General case' 0 CA--C 1.503 -0.84 0 CA-C-O 123.464 1.602 . . . . 10.0 111.856 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 2.5 t -92.53 -0.45 10.02 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 114.773 -1.103 . . . . 10.0 109.091 179.679 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 12.1 m80 . . . . . 0 N--CA 1.434 -1.271 0 CA-C-N 113.938 -1.483 . . . . 10.0 111.572 179.79 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.54 0.587 0 CA-C-O 122.738 1.256 . . . . 10.0 108.934 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -70.73 -33.71 71.12 Favored 'General case' 0 C--O 1.224 -0.26 0 C-N-CA 125.653 1.581 . . . . 10.0 112.363 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 30.1 t-20 -46.38 94.49 0.01 OUTLIER 'General case' 0 C--O 1.243 0.711 0 O-C-N 124.613 1.196 . . . . 10.0 111.305 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -148.96 -114.23 0.73 Allowed Glycine 0 N--CA 1.443 -0.859 0 N-CA-C 119.2 2.44 . . . . 10.0 119.2 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -155.64 -166.37 2.21 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 104.912 -2.255 . . . . 10.0 104.912 -179.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.464 ' NE1' ' CB ' ' A' ' 39' ' ' ASP 0.359 41.9 p90 -157.93 -170.44 3.16 Favored 'General case' 0 C--N 1.311 -1.077 0 C-N-CA 125.228 1.411 . . . . 10.0 113.966 -178.104 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.487 ' HE3' ' CG1' ' A' ' 133' ' ' VAL . 5.7 ttmt 166.19 98.95 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 111.733 -2.485 . . . . 10.0 109.07 176.676 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.528 ' HA ' ' CD1' ' A' ' 130' ' ' PHE . 0.0 OUTLIER -53.85 137.49 38.43 Favored 'General case' 0 N--CA 1.442 -0.836 0 N-CA-C 115.72 1.748 . . . . 10.0 115.72 -179.746 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -108.65 -55.53 2.38 Favored 'General case' 0 C--O 1.246 0.878 0 N-CA-C 108.394 -0.965 . . . . 10.0 108.394 -179.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -169.24 145.62 3.39 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 123.646 1.688 . . . . 10.0 115.337 -179.985 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -119.17 157.31 28.2 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 111.407 -2.633 . . . . 10.0 104.094 179.735 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -152.58 170.86 19.16 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 117.353 -1.308 . . . . 10.0 111.711 179.867 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 47.87 38.19 8.58 Favored 'General case' 0 C--O 1.243 0.738 0 O-C-N 125.063 1.477 . . . . 10.0 111.699 -179.855 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -76.0 -33.67 59.7 Favored 'General case' 0 C--N 1.34 0.178 0 CA-C-N 114.342 -1.299 . . . . 10.0 114.328 -179.546 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -77.08 -34.88 56.93 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 122.344 1.069 . . . . 10.0 112.557 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -76.89 -25.37 52.96 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 113.754 -1.566 . . . . 10.0 109.124 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -65.91 -44.29 85.63 Favored 'General case' 0 CA--C 1.55 0.948 0 O-C-N 126.122 2.139 . . . . 10.0 110.01 179.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 19.6 mt -76.37 -23.58 54.14 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 119.578 1.081 . . . . 10.0 112.825 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.43 -25.56 67.58 Favored 'General case' 0 C--O 1.244 0.807 0 O-C-N 125.479 1.737 . . . . 10.0 109.001 -179.752 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.7 -45.06 72.62 Favored 'General case' 0 N--CA 1.466 0.341 0 O-C-N 124.829 1.331 . . . . 10.0 111.47 -179.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.9 mt -85.07 -15.85 42.62 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 120.018 -1.676 . . . . 10.0 112.115 -179.669 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 19.3 t0 65.79 70.93 0.43 Allowed 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 114.642 1.349 . . . . 10.0 114.642 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.474 ' CG2' HD23 ' A' ' 29' ' ' LEU . 0.9 OUTLIER -103.65 167.34 2.64 Favored 'Isoleucine or valine' 0 C--N 1.344 0.367 0 N-CA-C 108.996 -0.742 . . . . 10.0 108.996 -179.825 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -51.57 160.02 0.68 Allowed 'General case' 0 C--O 1.244 0.77 0 O-C-N 125.148 1.53 . . . . 10.0 114.331 -179.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 39.3 t -76.18 -25.54 16.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 115.038 1.495 . . . . 10.0 115.038 -179.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -74.81 -33.62 62.24 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 114.482 -1.235 . . . . 10.0 112.629 179.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.474 HD23 ' CG2' ' A' ' 25' ' ' VAL . 13.1 tp -68.75 -26.25 65.14 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 122.003 0.906 . . . . 10.0 112.737 179.782 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.54 -22.21 51.43 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 113.395 -1.729 . . . . 10.0 113.682 179.869 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.9 tptm -73.13 -46.72 49.49 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 124.621 1.168 . . . . 10.0 110.195 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.472 HG21 ' CE2' ' A' ' 57' ' ' PHE . 5.8 mm -61.69 -57.29 12.77 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 O-C-N 125.531 1.769 . . . . 10.0 111.498 -179.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -48.87 -66.23 0.43 Allowed 'General case' 0 C--N 1.319 -0.725 0 O-C-N 126.524 2.39 . . . . 10.0 113.255 179.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -59.74 83.3 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.453 0 O-C-N 119.481 -2.012 . . . . 10.0 115.194 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.439 ' CD1' HD21 ' A' ' 36' ' ' LEU . 0.8 OUTLIER 159.69 -29.87 0.0 OUTLIER 'General case' 0 N--CA 1.445 -0.696 0 O-C-N 125.407 1.692 . . . . 10.0 109.61 179.95 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.439 HD21 ' CD1' ' A' ' 35' ' ' LEU . 35.0 mt -79.39 145.21 33.5 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 119.581 -0.848 . . . . 10.0 112.964 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.2 mttt -129.89 103.11 17.36 Favored Pre-proline 0 N--CA 1.466 0.346 0 N-CA-C 107.129 -1.434 . . . . 10.0 107.129 -179.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 0.2 OUTLIER -82.66 155.5 15.85 Favored 'Trans proline' 0 N--CA 1.448 -1.198 1 C-N-CA 126.599 4.866 . . . . 10.0 117.384 179.999 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.464 ' CB ' ' NE1' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -107.86 159.4 16.55 Favored 'General case' 0 C--N 1.313 -0.984 0 O-C-N 128.661 3.725 . . . . 10.0 106.538 179.752 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.45 ' HG3' ' CZ ' ' A' ' 130' ' ' PHE . 2.4 mtpm? -144.82 109.98 5.15 Favored 'General case' 0 N--CA 1.435 -1.197 0 C-N-CA 117.837 -1.545 . . . . 10.0 113.54 -179.543 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.448 ' HB2' ' CZ3' ' A' ' 8' ' ' TRP . 1.0 OUTLIER -96.19 146.71 24.46 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 102.602 -3.11 . . . . 10.0 102.602 179.086 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 13.0 mt -132.26 139.44 50.11 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 O-C-N 124.902 1.376 . . . . 10.0 111.007 179.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 49.5 t -132.18 114.04 22.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 113.03 -1.896 . . . . 10.0 106.248 179.742 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.422 ' HG2' ' CG ' ' A' ' 49' ' ' MET . 0.0 OUTLIER -115.86 135.17 54.25 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 108.043 -1.095 . . . . 10.0 108.043 179.603 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -142.52 101.29 3.85 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 107.148 -1.426 . . . . 10.0 107.148 -179.756 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 61.14 -121.33 26.09 Favored Glycine 0 C--O 1.243 0.717 0 CA-C-O 123.154 1.419 . . . . 10.0 110.228 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -103.01 37.49 1.95 Allowed 'General case' 0 N--CA 1.472 0.668 0 O-C-N 121.907 -0.761 . . . . 10.0 109.259 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 20.5 m80 -147.39 129.35 15.38 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 106.955 -1.498 . . . . 10.0 106.955 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.422 ' CG ' ' HG2' ' A' ' 44' ' ' GLN . 2.6 ttm -133.89 158.11 44.27 Favored 'General case' 0 C--O 1.215 -0.728 0 N-CA-C 114.279 1.215 . . . . 10.0 114.279 179.802 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 35.1 mt -134.19 136.48 53.25 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.98 0 N-CA-C 105.191 -2.152 . . . . 10.0 105.191 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.2 mp -122.18 143.86 33.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 N-CA-C 104.528 -2.397 . . . . 10.0 104.528 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.41 ' HG2' HG13 ' A' ' 61' ' ' ILE . 5.1 mtt180 -133.37 109.96 9.71 Favored 'General case' 0 C--O 1.212 -0.913 0 O-C-N 125.79 1.932 . . . . 10.0 115.295 -179.934 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.9 m -90.23 125.14 35.38 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 100.554 -3.869 . . . . 10.0 100.554 -179.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -120.2 33.56 5.55 Favored 'General case' 0 C--N 1.319 -0.723 1 N-CA-C 122.555 4.28 . . . . 10.0 122.555 -179.631 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 43.0 t -69.45 177.86 2.7 Favored 'General case' 0 C--N 1.323 -0.572 0 O-C-N 120.143 -1.598 . . . . 10.0 107.046 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.5 m -108.61 64.36 0.61 Allowed 'General case' 0 C--N 1.328 -0.356 0 O-C-N 125.819 1.949 . . . . 10.0 112.05 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.472 ' CE2' HG21 ' A' ' 32' ' ' ILE . 0.8 OUTLIER -173.47 -62.23 0.02 OUTLIER 'General case' 0 C--N 1.347 0.475 0 CA-C-N 113.758 -1.565 . . . . 10.0 107.504 -179.891 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 5.6 mtp180 -118.81 110.4 17.17 Favored 'General case' 0 C--N 1.328 -0.345 0 O-C-N 124.569 1.168 . . . . 10.0 112.412 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -114.71 91.44 3.62 Favored 'General case' 0 C--N 1.327 -0.381 0 O-C-N 124.807 1.317 . . . . 10.0 112.258 -179.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 54.4 p90 -110.82 134.22 52.7 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 103.07 -2.937 . . . . 10.0 103.07 -179.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.41 HG13 ' HG2' ' A' ' 52' ' ' ARG . 1.4 mp -112.11 158.18 12.63 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.362 0 O-C-N 123.98 0.8 . . . . 10.0 111.912 179.801 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' MET . . . . . 0.459 ' HE2' ' CZ ' ' A' ' 64' ' ' PHE . 1.2 mmm -134.93 152.0 51.35 Favored 'General case' 0 C--N 1.322 -0.614 0 O-C-N 125.056 1.472 . . . . 10.0 107.517 179.774 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -134.38 90.44 2.67 Favored 'General case' 0 C--N 1.309 -1.156 0 N-CA-C 102.182 -3.266 . . . . 10.0 102.182 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.484 ' CZ ' HG23 ' A' ' 86' ' ' VAL . 1.0 OUTLIER -81.88 171.06 14.92 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 117.106 2.262 . . . . 10.0 117.106 179.916 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.98 93.09 2.21 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 103.812 -2.662 . . . . 10.0 103.812 -179.78 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.43 ' CG1' ' HB2' ' A' ' 88' ' ' TRP . 22.6 t -49.47 145.53 1.22 Allowed 'Isoleucine or valine' 0 C--O 1.246 0.901 0 CA-C-N 114.439 -1.255 . . . . 10.0 109.407 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 69.78 -3.17 9.84 Favored Glycine 0 C--O 1.213 -1.205 0 N-CA-C 116.571 1.389 . . . . 10.0 116.571 179.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.5 tttt -109.9 146.94 34.3 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 119.212 1.506 . . . . 10.0 111.846 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.36 164.98 3.87 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 107.479 -1.304 . . . . 10.0 107.479 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -166.96 117.32 0.89 Allowed 'General case' 0 N--CA 1.439 -1.006 0 O-C-N 124.629 1.206 . . . . 10.0 113.473 -179.79 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -76.89 154.1 34.06 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 117.454 -1.698 . . . . 10.0 106.722 -179.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -140.92 72.37 1.39 Allowed 'General case' 0 C--O 1.22 -0.494 0 N-CA-C 115.537 1.68 . . . . 10.0 115.537 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -78.22 121.51 24.47 Favored 'General case' 0 N--CA 1.439 -0.977 0 N-CA-C 106.552 -1.647 . . . . 10.0 106.552 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 5.7 mt -110.96 67.79 0.65 Allowed 'General case' 0 C--N 1.318 -0.777 0 O-C-N 126.628 2.455 . . . . 10.0 114.692 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 1.4 p -88.44 66.39 8.26 Favored 'General case' 0 C--O 1.241 0.635 0 N-CA-C 105.527 -2.027 . . . . 10.0 105.527 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -156.25 -43.46 0.02 OUTLIER Glycine 0 C--O 1.241 0.583 0 C-N-CA 117.608 -2.234 . . . . 10.0 112.318 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 55.4 mt -113.5 -29.66 2.25 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.912 0 CA-C-N 119.257 1.529 . . . . 10.0 110.96 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -145.67 15.09 1.41 Allowed 'General case' 0 C--O 1.239 0.506 0 N-CA-C 114.053 1.131 . . . . 10.0 114.053 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 38.27 83.34 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 115.253 1.575 . . . . 10.0 115.253 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -141.49 -176.08 4.6 Favored 'General case' 0 C--N 1.316 -0.876 0 O-C-N 127.344 2.903 . . . . 10.0 111.965 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.14 156.82 27.34 Favored 'General case' 0 N--CA 1.445 -0.707 0 N-CA-C 103.656 -2.72 . . . . 10.0 103.656 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 1.5 p -166.84 -176.8 3.58 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 106.08 -1.822 . . . . 10.0 106.08 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 33.0 mtp -127.66 95.63 4.29 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 100.243 -3.984 . . . . 10.0 100.243 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 59.6 m -95.87 139.3 32.28 Favored 'General case' 0 CA--C 1.513 -0.471 0 N-CA-C 117.149 2.277 . . . . 10.0 117.149 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 19.8 m -133.21 97.47 3.99 Favored 'General case' 0 N--CA 1.437 -1.122 0 N-CA-C 106.89 -1.522 . . . . 10.0 106.89 179.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.484 HG23 ' CZ ' ' A' ' 64' ' ' PHE . 2.5 t -76.64 97.87 1.71 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.466 0 N-CA-C 104.657 -2.349 . . . . 10.0 104.657 -179.924 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.0 t -89.7 170.39 10.49 Favored 'General case' 0 C--N 1.316 -0.857 0 O-C-N 124.946 1.404 . . . . 10.0 108.959 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . 0.43 ' HB2' ' CG1' ' A' ' 66' ' ' VAL . 5.8 t90 -123.88 96.7 5.05 Favored 'General case' 0 C--O 1.24 0.579 0 N-CA-C 107.203 -1.406 . . . . 10.0 107.203 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -57.3 -64.51 0.86 Allowed 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 103.433 -2.803 . . . . 10.0 103.433 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 141.88 115.1 1.11 Allowed Glycine 0 CA--C 1.499 -0.914 0 N-CA-C 103.973 -3.651 . . . . 10.0 103.973 179.79 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 20.1 t0 87.9 -30.83 0.04 OUTLIER 'General case' 0 N--CA 1.448 -0.55 0 O-C-N 125.894 1.585 . . . . 10.0 109.834 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 8.5 mtmt -125.06 139.82 53.46 Favored 'General case' 0 C--N 1.32 -0.682 0 O-C-N 121.215 -0.928 . . . . 10.0 110.239 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -91.04 108.38 19.83 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 103.107 -2.923 . . . . 10.0 103.107 -179.899 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -121.29 138.64 54.15 Favored 'General case' 0 C--O 1.216 -0.706 0 O-C-N 125.136 1.522 . . . . 10.0 114.077 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 19.3 p -138.42 152.75 48.64 Favored 'General case' 0 C--N 1.321 -0.667 0 O-C-N 125.022 1.451 . . . . 10.0 108.396 -179.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 2.9 t -109.66 -54.83 5.3 Favored 'Isoleucine or valine' 0 C--O 1.247 0.922 0 N-CA-C 107.143 -1.429 . . . . 10.0 107.143 179.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.44 ' CG ' ' HB3' ' A' ' 104' ' ' ARG . 0.0 OUTLIER 71.08 111.99 0.06 Allowed 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 123.802 1.763 . . . . 10.0 109.263 179.926 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.33 67.2 7.18 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-O 123.578 1.656 . . . . 10.0 115.012 179.711 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -92.04 147.91 18.95 Favored Glycine 0 C--O 1.218 -0.86 0 N-CA-C 107.754 -2.138 . . . . 10.0 107.754 179.759 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -48.38 -25.99 1.86 Allowed 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 116.993 2.22 . . . . 10.0 116.993 179.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.55 -158.56 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.804 0 CA-C-N 119.788 1.176 . . . . 10.0 113.688 179.799 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -117.01 -24.93 7.38 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 126.186 1.795 . . . . 10.0 114.0 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -117.0 10.58 15.26 Favored Glycine 0 C--N 1.342 0.865 0 N-CA-C 116.757 1.463 . . . . 10.0 116.757 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.44 ' HB3' ' CG ' ' A' ' 97' ' ' GLN . 24.2 mmm-85 -55.34 143.16 29.4 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 119.031 1.416 . . . . 10.0 113.404 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 120.07 146.02 7.59 Favored Glycine 0 C--O 1.217 -0.922 0 O-C-N 124.576 1.173 . . . . 10.0 111.376 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -124.96 176.34 6.72 Favored 'General case' 0 CA--C 1.509 -0.623 0 O-C-N 120.854 -1.38 . . . . 10.0 109.961 179.871 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 76.7 m -145.74 132.74 20.27 Favored 'General case' 0 CA--C 1.509 -0.63 0 CA-C-O 118.799 -0.62 . . . . 10.0 109.593 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -123.92 126.58 46.61 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 123.929 0.891 . . . . 10.0 111.741 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 8.5 p90 -145.4 149.34 34.56 Favored 'General case' 0 C--O 1.213 -0.848 0 C-N-CA 124.301 1.04 . . . . 10.0 110.919 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 44.1 mt -89.82 147.18 5.38 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 O-C-N 125.541 1.776 . . . . 10.0 114.81 -179.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -131.74 75.05 1.62 Allowed 'General case' 0 C--O 1.24 0.589 0 N-CA-C 107.047 -1.464 . . . . 10.0 107.047 179.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 43.53 81.73 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.544 0 CA-C-O 118.176 -1.346 . . . . 10.0 110.71 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 71.15 23.78 4.04 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 118.277 -0.868 . . . . 10.0 110.947 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -143.0 103.1 4.12 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 114.774 1.398 . . . . 10.0 114.774 -179.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.415 ' CB ' ' HB2' ' A' ' 130' ' ' PHE . 0.8 OUTLIER -63.18 123.89 19.78 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 103.86 -2.644 . . . . 10.0 103.86 -179.97 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -134.32 99.43 4.38 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 106.906 -1.516 . . . . 10.0 106.906 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 13.8 tp -89.23 149.22 23.2 Favored 'General case' 0 C--N 1.314 -0.935 0 O-C-N 125.665 1.853 . . . . 10.0 113.43 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -133.96 124.09 25.74 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 104.999 -2.223 . . . . 10.0 104.999 -179.856 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.01 131.77 53.36 Favored 'General case' 0 C--N 1.319 -0.757 0 O-C-N 120.834 -1.166 . . . . 10.0 108.423 -179.693 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 77.2 mtm-85 -125.88 145.66 50.16 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 122.568 1.175 . . . . 10.0 110.49 179.712 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -153.62 115.04 4.18 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 106.465 -1.68 . . . . 10.0 106.465 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 45.95 57.08 5.43 Favored 'General case' 0 C--O 1.245 0.843 0 O-C-N 126.154 2.159 . . . . 10.0 116.697 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 87.69 -22.18 18.64 Favored Glycine 0 CA--C 1.534 1.278 0 N-CA-C 116.543 1.377 . . . . 10.0 116.543 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 2.6 t -75.64 151.73 6.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 CA-C-N 119.478 1.639 . . . . 10.0 109.556 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 12.8 m -136.56 86.12 2.19 Favored 'General case' 0 C--N 1.318 -0.782 0 O-C-N 124.473 1.108 . . . . 10.0 110.811 179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 30.6 p -98.66 154.48 17.92 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 112.337 -2.21 . . . . 10.0 105.062 -179.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.01 146.38 27.75 Favored 'General case' 0 C--O 1.221 -0.445 0 CA-C-O 123.374 1.559 . . . . 10.0 114.397 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -113.11 124.58 52.9 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 114.035 -1.439 . . . . 10.0 111.133 179.902 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 55.2 t -105.57 138.4 30.86 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.82 0 CA-C-N 113.41 -1.723 . . . . 10.0 107.203 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . 0.528 ' CD1' ' HA ' ' A' ' 10' ' ' MET . 15.3 m-85 -128.93 -177.68 4.31 Favored 'General case' 0 C--O 1.215 -0.72 0 C-N-CA 124.996 1.319 . . . . 10.0 110.452 -179.619 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . 0.414 ' CB ' ' HD2' ' A' ' 9' ' ' LYS . 0.0 OUTLIER -134.1 99.37 4.39 Favored 'General case' 0 C--O 1.24 0.597 0 CA-C-N 113.972 -1.467 . . . . 10.0 107.454 179.852 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -68.07 98.3 0.76 Allowed 'General case' 0 CA--C 1.508 -0.659 0 C-N-CA 117.345 -1.742 . . . . 10.0 107.623 179.888 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' VAL . . . . . 0.487 ' CG1' ' HE3' ' A' ' 9' ' ' LYS . 20.2 m -76.15 -4.26 5.95 Favored 'Isoleucine or valine' 0 C--O 1.241 0.62 0 C-N-CA 118.689 -1.204 . . . . 10.0 112.574 -179.696 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 66.5 t-80 . . . . . 0 C--N 1.325 -0.493 0 O-C-N 125.623 1.827 . . . . 10.0 111.751 179.766 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.216 -0.661 0 N-CA-C 110.859 -0.052 . . . . 10.0 110.859 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.477 ' CE1' HD12 ' A' ' 93' ' ' LEU . 43.1 m-85 62.72 -67.11 0.08 Allowed 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 115.968 1.84 . . . . 10.0 115.968 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -49.64 149.05 2.58 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.1 0.96 . . . . 10.0 111.854 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 170.15 -61.9 0.18 Allowed Glycine 0 N--CA 1.438 -1.203 0 O-C-N 125.082 1.489 . . . . 10.0 116.386 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -177.18 -166.65 0.14 Allowed 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 102.805 -3.035 . . . . 10.0 102.805 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.542 ' CZ3' ' HB3' ' A' ' 39' ' ' ASP 0.257 0.5 OUTLIER -153.36 -44.57 0.09 Allowed 'General case' 0 N--CA 1.442 -0.857 0 CA-C-O 116.663 -1.637 . . . . 10.0 115.108 -178.036 . . . . . . . . 4 4 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.49 ' HA ' ' CE3' ' A' ' 8' ' ' TRP . 1.3 pttt 12.46 98.94 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.001 1 O-C-N 129.45 4.218 . . . . 10.0 111.859 -177.201 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.415 ' HE2' ' HB3' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -61.72 157.58 17.5 Favored 'General case' 0 N--CA 1.441 -0.878 0 O-C-N 118.087 -2.883 . . . . 10.0 116.058 -179.891 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -111.89 -51.01 2.88 Favored 'General case' 0 C--O 1.245 0.859 0 CA-C-N 112.703 -2.044 . . . . 10.0 107.311 -179.692 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.1 p -146.45 -172.9 4.06 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 115.51 1.67 . . . . 10.0 115.51 179.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -169.16 133.84 1.48 Allowed 'General case' 0 C--O 1.22 -0.497 0 O-C-N 126.92 2.638 . . . . 10.0 106.961 -179.621 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -155.39 159.4 39.86 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-O 122.38 1.086 . . . . 10.0 111.497 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 72.16 5.7 5.37 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 116.103 1.89 . . . . 10.0 116.103 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -57.58 -23.75 52.48 Favored 'General case' 0 CA--C 1.551 0.991 0 N-CA-C 115.054 1.501 . . . . 10.0 115.054 179.577 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -79.54 -41.54 27.07 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-O 123.979 1.847 . . . . 10.0 110.762 -179.757 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.99 -27.2 63.53 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 122.486 1.136 . . . . 10.0 110.343 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -67.84 -58.11 5.14 Favored 'General case' 0 C--O 1.242 0.706 0 C-N-CA 124.521 1.128 . . . . 10.0 108.951 -179.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.59 -22.49 65.37 Favored 'General case' 0 C--O 1.211 -0.93 0 O-C-N 120.034 -1.666 . . . . 10.0 111.491 179.573 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.7 ttm-85 -75.4 -35.0 61.11 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 106.866 -1.531 . . . . 10.0 106.866 -179.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.14 -44.67 91.45 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 127.123 2.764 . . . . 10.0 112.435 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 26.5 mt -78.33 -34.15 48.75 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 125.493 1.517 . . . . 10.0 112.02 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 80.64 48.33 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.108 0 O-C-N 127.011 2.694 . . . . 10.0 113.529 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 27.9 m -82.85 164.46 2.77 Favored 'Isoleucine or valine' 0 C--O 1.242 0.71 0 O-C-N 124.996 1.435 . . . . 10.0 107.141 -179.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 9.0 m-20 -36.71 148.37 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.436 0 O-C-N 125.778 1.923 . . . . 10.0 115.213 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -70.63 -35.68 62.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 116.412 2.005 . . . . 10.0 116.412 -179.67 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -72.53 -21.06 61.23 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 123.517 1.627 . . . . 10.0 110.851 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.89 -41.96 77.59 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 119.31 -2.119 . . . . 10.0 111.733 179.632 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 15.8 ttp180 -56.5 -36.41 69.12 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 127.016 2.126 . . . . 10.0 113.51 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.8 tmtp? -68.53 -38.79 81.14 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 112.855 -1.975 . . . . 10.0 111.234 179.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 66.8 mt -75.36 -58.84 3.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 114.035 -1.439 . . . . 10.0 109.94 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -48.98 -31.97 8.35 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 116.335 1.976 . . . . 10.0 116.335 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -65.68 -18.24 65.18 Favored 'General case' 0 CA--C 1.516 -0.332 0 O-C-N 125.084 1.49 . . . . 10.0 110.888 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 53.1 mt -105.96 -7.38 18.17 Favored 'General case' 0 N--CA 1.448 -0.552 0 O-C-N 125.358 1.661 . . . . 10.0 113.44 -179.544 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -96.26 154.69 17.12 Favored 'General case' 0 C--O 1.219 -0.525 0 N-CA-C 114.203 1.186 . . . . 10.0 114.203 179.754 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.415 ' HB3' ' HE2' ' A' ' 10' ' ' MET . 3.6 mtmt -139.93 100.32 7.29 Favored Pre-proline 0 C--N 1.327 -0.413 0 N-CA-C 104.717 -2.327 . . . . 10.0 104.717 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_exo -70.02 167.47 24.7 Favored 'Trans proline' 0 C--O 1.24 0.6 1 C-N-CA 125.74 4.293 . . . . 10.0 116.322 -179.711 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.542 ' HB3' ' CZ3' ' A' ' 8' ' ' TRP . 2.9 p30 -124.71 166.72 15.66 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 106.207 -1.775 . . . . 10.0 106.207 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.94 90.04 1.43 Allowed 'General case' 0 N--CA 1.434 -1.254 0 CA-C-O 122.93 1.348 . . . . 10.0 112.848 179.903 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -85.72 103.94 14.97 Favored 'General case' 0 N--CA 1.442 -0.859 0 N-CA-C 105.232 -2.136 . . . . 10.0 105.232 179.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 10.2 mt -91.28 146.56 6.08 Favored 'Isoleucine or valine' 0 C--O 1.248 0.979 0 CA-C-N 113.691 -1.595 . . . . 10.0 109.384 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -151.44 121.53 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.817 0 CA-C-O 123.875 1.798 . . . . 10.0 109.466 -179.849 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.11 147.42 40.24 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 119.31 -2.119 . . . . 10.0 110.969 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -131.74 73.74 1.55 Allowed 'General case' 0 C--O 1.225 -0.217 0 CA-C-O 124.387 2.041 . . . . 10.0 106.375 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 88.81 -117.1 4.79 Favored Glycine 0 CA--C 1.533 1.189 0 N-CA-C 107.381 -2.288 . . . . 10.0 107.381 179.596 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -91.83 -13.83 30.77 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 118.142 -1.423 . . . . 10.0 108.062 -179.898 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 45.4 t-80 -81.01 138.38 36.04 Favored 'General case' 0 CA--C 1.518 -0.272 0 O-C-N 120.831 -1.168 . . . . 10.0 108.262 179.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 3.1 ttt -134.78 142.1 46.61 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.45 1.094 . . . . 10.0 110.923 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 8.8 mt -127.02 124.48 64.61 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.682 0 N-CA-C 106.573 -1.64 . . . . 10.0 106.573 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.438 ' N ' ' CD1' ' A' ' 51' ' ' ILE . 0.3 OUTLIER -106.84 100.17 10.11 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.901 0 N-CA-C 106.939 -1.504 . . . . 10.0 106.939 179.686 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.437 ' HG2' ' CD1' ' A' ' 61' ' ' ILE . 0.0 OUTLIER -93.58 127.55 39.3 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-O 122.136 0.969 . . . . 10.0 111.107 -179.868 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 57.5 m -106.69 121.43 44.33 Favored 'General case' 0 C--O 1.219 -0.507 0 N-CA-C 102.789 -3.041 . . . . 10.0 102.789 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.2 mp -104.1 58.05 0.72 Allowed 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 119.57 3.174 . . . . 10.0 119.57 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.8 t -83.36 172.53 12.41 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 104.475 -2.417 . . . . 10.0 104.475 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' THR . . . . . 0.429 HG21 ' CD1' ' A' ' 57' ' ' PHE . 9.6 t -106.09 -39.4 5.98 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.874 0.845 . . . . 10.0 109.648 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.429 ' CD1' HG21 ' A' ' 56' ' ' THR . 48.1 m-85 -72.38 -21.8 61.23 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 116.949 -1.501 . . . . 10.0 108.12 179.732 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 18.7 ptt-85 -151.7 -170.84 3.76 Favored 'General case' 0 C--N 1.328 -0.361 0 O-C-N 126.678 2.486 . . . . 10.0 111.698 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -179.51 82.21 0.01 OUTLIER 'General case' 0 C--O 1.243 0.733 0 CA-C-N 114.479 -1.237 . . . . 10.0 111.257 -179.624 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.413 ' CD1' ' O ' ' A' ' 60' ' ' TYR . 0.1 OUTLIER -93.22 127.84 38.95 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 124.991 2.329 . . . . 10.0 106.797 -179.702 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.437 ' CD1' ' HG2' ' A' ' 52' ' ' ARG . 17.9 mm -108.67 137.69 39.29 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.818 0 O-C-N 118.201 -2.812 . . . . 10.0 111.001 -179.746 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 20.4 mtm -110.66 162.83 14.36 Favored 'General case' 0 CA--C 1.515 -0.37 0 O-C-N 126.411 2.32 . . . . 10.0 108.983 179.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -144.48 78.3 1.57 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 102.126 -3.287 . . . . 10.0 102.126 179.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.425 ' CD2' HG11 ' A' ' 86' ' ' VAL . 1.9 m-30 -85.53 125.11 32.82 Favored 'General case' 0 N--CA 1.445 -0.699 0 O-C-N 126.045 2.091 . . . . 10.0 114.657 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 25.8 tt0 -105.72 139.55 40.14 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 111.94 -2.391 . . . . 10.0 105.703 -179.821 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -93.85 121.25 44.34 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-O 123.726 1.727 . . . . 10.0 108.67 -179.79 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 97.56 -12.74 64.62 Favored Glycine 0 C--O 1.213 -1.212 0 O-C-N 120.422 -1.423 . . . . 10.0 113.993 179.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.77 138.98 41.06 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 115.948 1.832 . . . . 10.0 115.948 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -80.16 135.95 36.4 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-O 122.317 1.056 . . . . 10.0 110.579 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -116.12 167.63 10.82 Favored 'General case' 0 C--O 1.248 1.0 0 CA-C-O 118.256 -0.878 . . . . 10.0 110.263 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 19.8 tt0 -137.44 82.63 1.94 Allowed 'General case' 0 C--N 1.317 -0.828 0 O-C-N 125.89 1.994 . . . . 10.0 108.443 -179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -73.18 133.59 44.1 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 116.677 2.103 . . . . 10.0 116.677 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -104.46 -13.8 15.93 Favored 'General case' 0 C--O 1.221 -0.414 0 N-CA-C 106.372 -1.714 . . . . 10.0 106.372 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 61.09 -84.36 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 118.812 -0.613 . . . . 10.0 112.066 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 29.4 m 55.05 60.8 3.24 Favored 'General case' 0 C--N 1.32 -0.704 0 O-C-N 126.169 2.168 . . . . 10.0 108.682 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 172.26 137.47 2.35 Favored Glycine 0 N--CA 1.44 -1.056 0 O-C-N 126.886 2.616 . . . . 10.0 108.123 -179.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 11.3 mt 72.46 -64.91 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 N-CA-C 104.21 -2.515 . . . . 10.0 104.21 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -107.52 -80.05 0.57 Allowed 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 117.017 -1.468 . . . . 10.0 112.186 -179.885 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 21.1 p-10 122.39 28.83 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.699 0 O-C-N 128.203 3.439 . . . . 10.0 117.779 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.95 164.48 13.63 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 123.081 1.419 . . . . 10.0 111.096 179.614 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 38.3 mttt -114.74 179.16 4.03 Favored 'General case' 0 CA--C 1.509 -0.606 0 O-C-N 119.72 -1.862 . . . . 10.0 107.805 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 5.6 p 175.79 170.67 0.37 Allowed 'General case' 0 CA--C 1.503 -0.848 0 CA-C-O 123.288 1.518 . . . . 10.0 110.475 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -117.55 108.72 15.83 Favored 'General case' 0 N--CA 1.443 -0.824 0 N-CA-C 100.692 -3.818 . . . . 10.0 100.692 179.629 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 3.0 m -115.1 150.25 36.26 Favored 'General case' 0 CA--C 1.499 -1.019 0 N-CA-C 118.608 2.818 . . . . 10.0 118.608 -179.348 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 2.8 m -142.5 114.4 8.12 Favored 'General case' 0 CA--C 1.5 -0.967 0 CA-C-N 114.249 -1.341 . . . . 10.0 108.613 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.425 HG11 ' CD2' ' A' ' 64' ' ' PHE . 5.6 t -89.22 136.08 24.37 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 N-CA-C 101.591 -3.485 . . . . 10.0 101.591 -179.797 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 46.9 t -134.48 176.24 8.8 Favored 'General case' 0 N--CA 1.444 -0.728 0 O-C-N 124.989 1.43 . . . . 10.0 109.358 -179.772 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -125.96 92.13 3.53 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 104.495 -2.409 . . . . 10.0 104.495 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -87.52 83.56 7.25 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 100.885 -3.746 . . . . 10.0 100.885 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 62.9 -105.62 1.06 Allowed Glycine 0 C--O 1.237 0.3 0 N-CA-C 106.456 -2.658 . . . . 10.0 106.456 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -114.33 60.62 0.67 Allowed 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 114.123 -1.038 . . . . 10.0 112.133 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 7.3 mtmt -158.83 139.08 12.27 Favored 'General case' 0 C--O 1.24 0.595 0 O-C-N 120.441 -1.412 . . . . 10.0 110.191 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.477 HD12 ' CE1' ' A' ' 4' ' ' PHE . 0.2 OUTLIER -95.47 94.58 7.88 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 105.931 -1.877 . . . . 10.0 105.931 179.91 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -104.03 137.81 41.46 Favored 'General case' 0 CA--C 1.506 -0.741 0 O-C-N 126.215 2.197 . . . . 10.0 110.519 179.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 19.1 m -142.89 129.16 19.89 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 126.655 2.472 . . . . 10.0 113.678 -179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 96.2 t -116.28 122.98 70.91 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 N-CA-C 105.583 -2.006 . . . . 10.0 105.583 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -105.6 107.72 18.87 Favored 'General case' 0 C--O 1.238 0.452 0 O-C-N 125.783 1.927 . . . . 10.0 107.994 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 40.3 tttt -87.22 120.74 28.82 Favored 'General case' 0 C--O 1.221 -0.419 0 C-N-CA 120.088 -0.645 . . . . 10.0 112.453 179.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -143.22 -151.28 5.45 Favored Glycine 0 N--CA 1.447 -0.577 0 CA-C-O 123.252 1.473 . . . . 10.0 110.302 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -81.22 -1.49 45.02 Favored 'General case' 0 C--O 1.243 0.723 0 O-C-N 119.917 -1.931 . . . . 10.0 114.576 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 14.2 mttp -93.37 -166.72 1.57 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 124.599 2.142 . . . . 10.0 113.486 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -132.96 30.97 3.94 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 114.015 -1.448 . . . . 10.0 112.074 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 177.51 33.63 0.05 OUTLIER Glycine 0 N--CA 1.443 -0.861 0 CA-C-O 116.835 -2.092 . . . . 10.0 118.118 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.37 135.86 36.46 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 119.168 1.484 . . . . 10.0 109.304 179.732 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 148.17 148.16 4.69 Favored Glycine 0 N--CA 1.446 -0.686 0 N-CA-C 109.25 -1.54 . . . . 10.0 109.25 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -116.03 -178.67 3.46 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 117.538 0.669 . . . . 10.0 110.057 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.1 m -158.49 126.92 5.35 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 105.068 -2.197 . . . . 10.0 105.068 179.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -110.35 127.97 55.33 Favored 'General case' 0 C--O 1.219 -0.503 0 O-C-N 125.908 2.005 . . . . 10.0 110.306 -179.839 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 1.6 t-105 -135.54 146.39 48.0 Favored 'General case' 0 C--O 1.214 -0.801 0 N-CA-C 107.465 -1.309 . . . . 10.0 107.465 -179.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 17.7 mt -113.81 116.89 53.92 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 N-CA-C 117.662 2.468 . . . . 10.0 117.662 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -81.72 179.17 7.94 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 112.595 -2.093 . . . . 10.0 106.321 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -52.51 99.57 0.04 OUTLIER Glycine 0 C--O 1.221 -0.715 0 N-CA-C 108.375 -1.89 . . . . 10.0 108.375 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 53.75 30.64 11.52 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 123.62 1.676 . . . . 10.0 112.848 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -146.77 109.96 4.76 Favored 'General case' 0 CA--C 1.502 -0.894 0 CA-C-O 124.925 2.297 . . . . 10.0 113.409 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.442 HD12 ' CG ' ' A' ' 130' ' ' PHE . 2.6 tm? -74.92 131.19 40.51 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 104.315 -2.476 . . . . 10.0 104.315 -179.849 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 9.3 t-160 -128.41 91.11 3.18 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 107.725 -1.213 . . . . 10.0 107.725 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 6.5 tt -95.19 142.77 27.24 Favored 'General case' 0 N--CA 1.44 -0.953 0 O-C-N 124.759 1.287 . . . . 10.0 111.498 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 16.2 pm0 -128.56 133.91 48.5 Favored 'General case' 0 C--O 1.216 -0.708 0 N-CA-C 108.011 -1.107 . . . . 10.0 108.011 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 48.1 mtt -112.62 162.02 16.16 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-O 123.366 1.555 . . . . 10.0 108.164 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 2.7 mtm180 -158.65 148.5 19.47 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 113.952 -1.476 . . . . 10.0 109.49 179.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -171.17 122.34 0.56 Allowed 'General case' 0 CA--C 1.504 -0.801 0 O-C-N 123.588 0.555 . . . . 10.0 109.766 179.595 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 61.34 31.6 19.25 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 126.306 1.843 . . . . 10.0 114.486 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 97.9 -15.38 61.77 Favored Glycine 0 CA--C 1.536 1.404 0 CA-C-O 117.032 -1.982 . . . . 10.0 116.792 -179.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 19.8 m -94.73 -179.78 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 CA-C-N 119.171 1.485 . . . . 10.0 111.003 179.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 1.1 m -149.93 133.89 16.99 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 122.19 0.995 . . . . 10.0 113.213 179.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -123.12 142.39 50.93 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 105.126 -2.176 . . . . 10.0 105.126 179.911 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.26 145.86 36.09 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 114.176 1.176 . . . . 10.0 114.176 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.09 109.19 10.29 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 113.951 -1.477 . . . . 10.0 111.984 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 84.8 t -72.27 123.06 26.04 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 N-CA-C 105.142 -2.17 . . . . 10.0 105.142 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . 0.442 ' CG ' HD12 ' A' ' 115' ' ' LEU . 2.7 m-85 -103.25 161.97 13.37 Favored 'General case' 0 C--N 1.316 -0.866 0 C-N-CA 124.685 1.194 . . . . 10.0 108.73 -179.656 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -137.61 102.71 4.83 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 122.449 1.118 . . . . 10.0 108.217 -179.734 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.27 128.22 35.47 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-O 122.155 0.979 . . . . 10.0 110.253 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 1.3 t -101.38 -21.65 5.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 C-N-CA 124.641 1.176 . . . . 10.0 109.486 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 54.7 t60 . . . . . 0 C--O 1.251 1.164 0 O-C-N 124.746 1.279 . . . . 10.0 114.11 -179.985 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.24 0.571 0 CA-C-O 118.981 -0.533 . . . . 10.0 111.033 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -98.19 -20.77 17.09 Favored 'General case' 0 C--O 1.24 0.602 0 N-CA-C 115.687 1.736 . . . . 10.0 115.687 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -56.3 116.77 3.25 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 117.061 -1.447 . . . . 10.0 112.03 -179.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -132.22 -158.78 9.09 Favored Glycine 0 CA--C 1.534 1.227 0 CA-C-O 123.193 1.441 . . . . 10.0 115.681 -179.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -160.57 82.76 0.68 Allowed 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 100.377 -3.934 . . . . 10.0 100.377 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.649 ' CG ' ' N ' ' A' ' 9' ' ' LYS 0.284 0.2 OUTLIER -61.32 -160.09 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 127.106 2.163 . . . . 10.0 111.941 -179.706 . . . . . . . . 4 4 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.649 ' N ' ' CG ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER 153.09 74.4 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.611 0 O-C-N 126.295 2.247 . . . . 10.0 106.174 176.539 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 27.9 ttm -36.26 139.89 0.15 Allowed 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 112.179 -2.282 . . . . 10.0 115.379 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.3 tp -95.09 -38.66 10.52 Favored 'General case' 0 C--N 1.317 -0.832 0 O-C-N 126.708 2.505 . . . . 10.0 106.424 -179.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -178.22 162.0 1.51 Allowed 'General case' 0 C--N 1.345 0.412 0 CA-C-O 123.528 1.632 . . . . 10.0 112.977 179.776 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -121.04 165.79 14.79 Favored 'General case' 0 CA--C 1.51 -0.569 0 CA-C-N 112.651 -2.068 . . . . 10.0 106.326 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -157.91 129.89 6.97 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.823 -0.626 . . . . 10.0 111.046 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 69.73 44.1 0.9 Allowed 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 125.443 1.497 . . . . 10.0 113.469 -179.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.487 ' CE2' HD12 ' A' ' 20' ' ' LEU . 81.2 t80 -76.92 -39.92 49.09 Favored 'General case' 0 CA--C 1.55 0.96 0 O-C-N 125.453 1.721 . . . . 10.0 109.231 179.771 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -71.14 -36.89 72.25 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 114.306 -1.315 . . . . 10.0 112.118 179.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -70.29 -33.18 71.26 Favored 'General case' 0 N--CA 1.442 -0.865 0 O-C-N 125.588 1.805 . . . . 10.0 108.948 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -71.97 -38.22 69.77 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 113.758 -1.565 . . . . 10.0 110.439 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.487 HD12 ' CE2' ' A' ' 16' ' ' PHE . 80.4 mt -71.59 -25.8 62.34 Favored 'General case' 0 C--O 1.213 -0.832 0 O-C-N 121.645 -0.659 . . . . 10.0 110.583 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.26 -29.29 60.12 Favored 'General case' 0 C--O 1.243 0.714 0 CA-C-O 123.143 1.449 . . . . 10.0 107.775 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.36 -28.41 69.74 Favored 'General case' 0 C--O 1.212 -0.872 0 C-N-CA 125.463 1.505 . . . . 10.0 112.722 179.725 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.473 HD23 ' CB ' ' A' ' 121' ' ' ALA . 22.3 mt -104.92 -6.19 20.36 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.631 1.172 . . . . 10.0 111.124 179.839 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 42.9 m-20 48.71 58.97 4.72 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 125.897 1.679 . . . . 10.0 114.177 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 26.2 m -93.39 161.29 2.58 Favored 'Isoleucine or valine' 0 C--O 1.243 0.754 0 N-CA-C 106.555 -1.646 . . . . 10.0 106.555 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -41.59 142.15 0.66 Allowed 'General case' 0 CA--C 1.544 0.745 0 CA-C-O 123.817 1.77 . . . . 10.0 113.452 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 52.9 t -67.07 -26.26 36.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 N-CA-C 115.875 1.805 . . . . 10.0 115.875 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -73.89 -26.9 60.79 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 119.673 -0.811 . . . . 10.0 111.697 179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.8 -44.3 73.86 Favored 'General case' 0 C--N 1.317 -0.813 0 O-C-N 125.774 1.921 . . . . 10.0 114.646 179.743 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.07 -31.28 69.92 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-O 123.864 1.792 . . . . 10.0 112.065 -179.49 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 14.8 mttt -77.3 -33.64 55.65 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 113.465 -1.698 . . . . 10.0 110.86 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.4 mp -77.26 -39.77 28.78 Favored 'Isoleucine or valine' 0 C--O 1.243 0.759 0 CA-C-N 114.922 -1.036 . . . . 10.0 111.032 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -81.5 -19.35 42.44 Favored 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 116.069 1.877 . . . . 10.0 116.069 -179.711 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -76.37 -14.86 60.06 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 122.551 1.167 . . . . 10.0 110.63 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 14.6 mt -83.21 -9.67 59.02 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 123.793 0.837 . . . . 10.0 113.066 -179.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 21.0 mt -116.52 165.38 13.3 Favored 'General case' 0 CA--C 1.507 -0.675 0 CA-C-O 122.588 1.185 . . . . 10.0 109.066 -179.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.53 99.17 8.71 Favored Pre-proline 0 N--CA 1.481 1.099 0 N-CA-C 103.163 -2.902 . . . . 10.0 103.163 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_exo -51.16 -174.95 0.01 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.382 0 C-N-CA 124.693 3.596 . . . . 10.0 115.521 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.541 ' HB2' ' CZ2' ' A' ' 8' ' ' TRP . 0.5 OUTLIER -139.54 -174.77 3.98 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-N 113.096 -1.866 . . . . 10.0 108.222 -179.929 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.7 mttm -173.63 122.79 0.35 Allowed 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 119.109 0.868 . . . . 10.0 111.01 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -121.19 121.0 36.82 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 119.82 1.191 . . . . 10.0 108.424 179.388 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.424 ' CG2' ' HE1' ' A' ' 49' ' ' MET . 2.4 mt -97.07 142.01 14.78 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.923 0 O-C-N 124.861 1.351 . . . . 10.0 111.223 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 56.1 t -147.28 138.14 17.73 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.998 0 N-CA-C 104.964 -2.235 . . . . 10.0 104.964 -179.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -143.29 126.08 16.1 Favored 'General case' 0 C--O 1.211 -0.93 0 N-CA-C 106.058 -1.83 . . . . 10.0 106.058 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -104.24 23.87 12.4 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-O 122.965 1.364 . . . . 10.0 107.568 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 87.83 106.27 0.94 Allowed Glycine 0 C--N 1.336 0.539 0 N-CA-C 110.138 -1.185 . . . . 10.0 110.138 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 57.27 31.58 20.33 Favored 'General case' 0 C--N 1.321 -0.654 0 O-C-N 124.829 0.958 . . . . 10.0 110.088 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -162.36 92.99 0.84 Allowed 'General case' 0 C--O 1.213 -0.818 0 N-CA-C 103.189 -2.893 . . . . 10.0 103.189 179.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.424 ' HE1' ' CG2' ' A' ' 42' ' ' ILE . 4.9 ttm -105.34 142.64 34.74 Favored 'General case' 0 C--N 1.316 -0.875 0 O-C-N 126.389 2.306 . . . . 10.0 116.588 -179.592 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 6.0 mm -128.28 130.91 69.5 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.732 0 N-CA-C 106.273 -1.751 . . . . 10.0 106.273 -179.751 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.406 HD13 ' CG ' ' A' ' 49' ' ' MET . 1.3 mp -121.58 113.61 39.89 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.07 0 O-C-N 126.87 2.607 . . . . 10.0 106.059 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.8 mtp180 -111.61 98.75 7.65 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 113.924 1.083 . . . . 10.0 113.924 -179.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 32.4 m -96.25 89.3 5.06 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 104.736 -2.32 . . . . 10.0 104.736 -179.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.73 44.43 0.01 OUTLIER 'General case' 0 C--N 1.315 -0.905 1 N-CA-C 122.824 4.379 . . . . 10.0 122.824 -179.709 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 36.1 t -64.95 138.56 58.44 Favored 'General case' 0 C--O 1.242 0.695 0 N-CA-C 103.622 -2.733 . . . . 10.0 103.622 -179.735 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 15.9 p -87.39 -37.27 17.21 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 121.389 1.904 . . . . 10.0 108.401 179.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 22.0 t80 -53.46 -35.81 60.92 Favored 'General case' 0 C--O 1.242 0.688 0 O-C-N 125.979 2.049 . . . . 10.0 110.076 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -174.82 90.04 0.06 Allowed 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 115.577 -0.738 . . . . 10.0 112.243 -179.845 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -46.16 144.58 1.91 Allowed 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.61 1.194 . . . . 10.0 113.554 179.775 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -122.72 89.19 3.07 Favored 'General case' 0 CA--C 1.503 -0.859 0 N-CA-C 103.236 -2.876 . . . . 10.0 103.236 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 19.7 mm -90.13 128.38 42.1 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 O-C-N 120.217 -1.552 . . . . 10.0 110.943 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 1.7 mtm -125.65 142.6 51.43 Favored 'General case' 0 C--N 1.341 0.226 0 N-CA-C 105.303 -2.11 . . . . 10.0 105.303 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -140.95 96.56 3.02 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 100.73 -3.804 . . . . 10.0 100.73 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.469 ' CD2' HG21 ' A' ' 86' ' ' VAL . 1.5 m-30 -110.86 167.27 10.36 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 117.623 2.453 . . . . 10.0 117.623 179.772 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -126.68 99.9 5.98 Favored 'General case' 0 C--O 1.241 0.624 0 CA-C-N 111.389 -2.642 . . . . 10.0 104.223 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 33.3 t -43.8 112.4 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 CA-C-N 114.225 -1.352 . . . . 10.0 112.424 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.99 30.9 60.55 Favored Glycine 0 CA--C 1.528 0.901 0 O-C-N 126.63 2.456 . . . . 10.0 115.758 -179.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.6 tmmm? -107.79 2.38 23.56 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 115.783 1.772 . . . . 10.0 115.783 -179.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 59.6 tt0 61.84 138.04 0.01 OUTLIER 'General case' 0 C--N 1.311 -1.074 0 O-C-N 128.354 3.534 . . . . 10.0 113.526 179.505 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 56.4 m-85 -141.26 143.89 34.37 Favored 'General case' 0 C--N 1.319 -0.721 0 O-C-N 121.046 -1.034 . . . . 10.0 110.47 -179.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -109.93 90.33 3.28 Favored 'General case' 0 C--N 1.321 -0.638 0 O-C-N 126.057 2.098 . . . . 10.0 110.23 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -78.89 134.98 36.87 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 113.982 -1.463 . . . . 10.0 114.672 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -129.82 95.23 3.91 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 106.205 -1.776 . . . . 10.0 106.205 179.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -68.56 -167.23 0.09 Allowed 'General case' 0 C--N 1.322 -0.607 0 O-C-N 125.0 1.438 . . . . 10.0 112.718 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -158.61 -70.55 0.09 Allowed 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 107.809 -1.182 . . . . 10.0 107.809 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -92.28 -173.41 41.88 Favored Glycine 0 N--CA 1.434 -1.448 0 O-C-N 126.965 2.666 . . . . 10.0 111.579 -179.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 78.5 mt 75.03 -92.03 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 O-C-N 126.225 1.779 . . . . 10.0 107.704 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -115.7 -48.58 2.76 Favored 'General case' 0 C--N 1.318 -0.775 0 C-N-CA 124.287 1.035 . . . . 10.0 109.967 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.9 128.25 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 118.171 2.656 . . . . 10.0 118.171 179.785 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 6.4 ttm105 -177.81 144.49 0.36 Allowed 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 114.544 -1.207 . . . . 10.0 110.742 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 1.8 mtpp -96.18 148.78 22.35 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 104.327 -2.472 . . . . 10.0 104.327 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 1.8 p -168.23 168.72 11.39 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 107.224 -1.399 . . . . 10.0 107.224 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 7.0 mtt -115.29 92.12 3.82 Favored 'General case' 0 C--O 1.245 0.818 0 N-CA-C 102.051 -3.314 . . . . 10.0 102.051 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.2 m -88.37 115.57 25.96 Favored 'General case' 0 CA--C 1.504 -0.814 0 O-C-N 119.498 -2.001 . . . . 10.0 113.38 179.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 11.2 m -119.8 111.35 17.88 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-N 114.594 -1.184 . . . . 10.0 108.857 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.469 HG21 ' CD2' ' A' ' 64' ' ' PHE . 1.3 t -84.79 119.86 34.36 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 N-CA-C 101.296 -3.594 . . . . 10.0 101.296 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.4 p -145.03 141.93 29.32 Favored 'General case' 0 C--O 1.217 -0.621 0 CA-C-O 124.407 2.051 . . . . 10.0 114.82 -179.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -72.39 137.96 46.89 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 113.368 -1.742 . . . . 10.0 109.488 179.339 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -97.94 8.94 43.93 Favored 'General case' 0 CA--C 1.506 -0.716 0 N-CA-C 103.401 -2.815 . . . . 10.0 103.401 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 129.66 -29.8 3.72 Favored Glycine 0 CA--C 1.497 -1.062 0 N-CA-C 103.392 -3.883 . . . . 10.0 103.392 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -157.6 -51.28 0.07 Allowed 'General case' 0 C--O 1.24 0.563 0 CA-C-N 118.011 0.906 . . . . 10.0 109.857 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -61.39 160.92 10.04 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-O 117.396 -1.288 . . . . 10.0 110.442 -179.915 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 49.0 tp -104.26 116.06 31.51 Favored 'General case' 0 N--CA 1.442 -0.851 0 N-CA-C 104.757 -2.312 . . . . 10.0 104.757 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . 0.439 ' N ' HE21 ' A' ' 94' ' ' GLN . 0.0 OUTLIER -124.45 142.52 51.25 Favored 'General case' 0 CA--C 1.501 -0.942 0 N-CA-C 115.799 1.777 . . . . 10.0 115.799 -179.753 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -134.81 157.69 46.12 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 116.851 -1.547 . . . . 10.0 107.653 179.849 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 8.3 t -130.56 -67.1 0.58 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.755 0 C-N-CA 118.329 -1.348 . . . . 10.0 110.924 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 72.86 116.18 0.05 Allowed 'General case' 0 C--O 1.245 0.849 0 N-CA-C 105.506 -2.035 . . . . 10.0 105.506 -179.504 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.412 ' HA ' ' NH2' ' A' ' 104' ' ' ARG . 5.2 ptpp? -107.47 170.74 7.79 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 114.88 1.437 . . . . 10.0 114.88 -179.527 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 176.86 -124.14 0.94 Allowed Glycine 0 N--CA 1.447 -0.568 0 O-C-N 124.723 1.264 . . . . 10.0 110.653 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -130.31 22.07 5.21 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 114.977 1.473 . . . . 10.0 114.977 179.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -110.7 177.2 4.75 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 116.084 1.883 . . . . 10.0 116.084 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -90.9 120.6 32.05 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 128.625 2.77 . . . . 10.0 108.959 179.651 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 86.49 -97.49 2.24 Favored Glycine 0 C--O 1.22 -0.72 0 O-C-N 119.808 -1.807 . . . . 10.0 115.214 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.412 ' NH2' ' HA ' ' A' ' 98' ' ' LYS . 21.3 mtm-85 59.82 165.76 0.06 Allowed 'General case' 0 N--CA 1.441 -0.876 0 N-CA-C 114.896 1.443 . . . . 10.0 114.896 -179.699 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 74.43 166.52 15.59 Favored Glycine 0 N--CA 1.444 -0.792 0 CA-C-N 112.036 -2.347 . . . . 10.0 112.903 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -112.46 -173.81 2.33 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 124.565 1.146 . . . . 10.0 109.757 -179.793 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' THR . . . . . 0.404 ' HB ' ' CG ' ' A' ' 118' ' ' GLU . 55.9 m -162.35 123.34 2.57 Favored 'General case' 0 C--O 1.214 -0.814 0 CA-C-O 118.304 -0.855 . . . . 10.0 110.259 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 10.0 mt-30 -120.17 124.9 46.87 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 118.258 -0.877 . . . . 10.0 112.462 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -134.15 164.64 26.9 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 106.519 -1.66 . . . . 10.0 106.519 179.704 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 37.5 mt -129.28 136.21 59.99 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 N-CA-C 116.282 1.956 . . . . 10.0 116.282 -179.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -109.24 -162.17 0.8 Allowed 'General case' 0 CA--C 1.522 -0.117 0 C-N-CA 125.869 1.668 . . . . 10.0 107.356 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -77.48 103.11 1.8 Allowed Glycine 0 CA--C 1.528 0.868 0 O-C-N 125.741 1.901 . . . . 10.0 108.833 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 9.6 t70 50.07 17.41 0.3 Allowed 'General case' 0 C--N 1.324 -0.504 0 O-C-N 127.151 2.324 . . . . 10.0 111.812 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -137.28 88.8 2.38 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 120.5 1.5 . . . . 10.0 110.716 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.418 HD12 ' N ' ' A' ' 116' ' ' HIS . 0.9 OUTLIER -60.48 134.06 56.7 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 105.198 -2.149 . . . . 10.0 105.198 -179.946 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . 0.418 ' N ' HD12 ' A' ' 115' ' ' LEU . 3.6 t60 -119.2 99.05 6.47 Favored 'General case' 0 C--O 1.213 -0.859 0 O-C-N 118.96 -2.337 . . . . 10.0 109.156 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.417 ' HG ' ' N ' ' A' ' 118' ' ' GLU . 0.2 OUTLIER -96.29 149.15 21.99 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 114.449 -1.25 . . . . 10.0 111.197 -179.887 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.417 ' N ' ' HG ' ' A' ' 117' ' ' LEU . 16.6 pt-20 -146.01 128.56 16.05 Favored 'General case' 0 CA--C 1.505 -0.757 0 O-C-N 125.205 1.566 . . . . 10.0 108.621 179.716 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -113.51 125.73 54.53 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 114.117 -1.402 . . . . 10.0 108.026 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.425 ' HD3' ' N ' ' A' ' 120' ' ' ARG . 0.0 OUTLIER -121.43 160.8 23.38 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-O 125.584 2.611 . . . . 10.0 115.534 -179.943 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . 0.473 ' CB ' HD23 ' A' ' 23' ' ' LEU . . . -179.03 137.49 0.14 Allowed 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 112.698 -2.046 . . . . 10.0 110.579 179.798 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 46.85 31.54 1.5 Allowed 'General case' 0 C--O 1.246 0.896 0 CA-C-N 113.596 -1.638 . . . . 10.0 114.5 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 93.61 -15.38 63.17 Favored Glycine 0 N--CA 1.444 -0.78 0 C-N-CA 124.36 0.981 . . . . 10.0 115.533 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 3.0 t -94.04 131.32 41.27 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 CA-C-N 119.589 1.695 . . . . 10.0 109.983 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 36.4 m -115.43 118.84 34.34 Favored 'General case' 0 N--CA 1.445 -0.709 0 O-C-N 125.991 2.057 . . . . 10.0 113.21 179.457 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -99.58 155.02 17.81 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 105.195 -2.15 . . . . 10.0 105.195 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 25.0 mtmt -145.54 159.29 43.32 Favored 'General case' 0 CA--C 1.507 -0.677 0 O-C-N 120.999 -1.063 . . . . 10.0 110.88 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -140.19 125.36 18.68 Favored 'General case' 0 C--N 1.321 -0.636 0 O-C-N 125.45 1.719 . . . . 10.0 108.235 -179.67 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 2.5 t -85.66 108.31 17.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 N-CA-C 105.873 -1.899 . . . . 10.0 105.873 179.561 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . 0.409 ' HB2' ' HB3' ' A' ' 115' ' ' LEU . 3.9 m-85 -86.06 151.98 23.26 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 115.631 -0.713 . . . . 10.0 110.781 -179.741 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 17.6 tptt -130.31 85.72 2.32 Favored 'General case' 0 C--N 1.321 -0.651 0 O-C-N 126.854 2.596 . . . . 10.0 108.991 -179.768 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.47 104.54 0.13 Allowed 'General case' 0 C--O 1.235 0.341 0 O-C-N 125.723 1.889 . . . . 10.0 109.837 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 1.4 p -73.88 -24.67 19.76 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.492 0 C-N-CA 118.593 -1.243 . . . . 10.0 110.662 179.599 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 35.1 t-80 . . . . . 0 N--CA 1.441 -0.913 0 CA-C-O 115.871 -2.014 . . . . 10.0 110.814 -179.853 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.443 -0.793 0 N-CA-C 112.742 0.645 . . . . 10.0 112.742 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 62.8 -73.2 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 O-C-N 125.469 1.73 . . . . 10.0 111.99 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -35.32 111.17 0.12 Allowed 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.457 1.503 . . . . 10.0 113.04 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -157.23 -140.7 3.0 Favored Glycine 0 N--CA 1.445 -0.7 0 C-N-CA 118.861 -1.638 . . . . 10.0 114.069 179.56 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 93.1 m-85 -160.36 65.8 0.33 Allowed 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 104.499 -2.408 . . . . 10.0 104.499 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.589 ' CD2' ' CD1' ' A' ' 115' ' ' LEU . 8.5 m0 -68.03 105.95 2.2 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 118.34 -1.344 . . . . 10.0 108.464 179.715 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.5 pttp -81.93 12.27 4.25 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 117.196 -1.383 . . . . 10.0 110.666 -179.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.415 ' HG2' ' N ' ' A' ' 11' ' ' LEU . 0.0 OUTLIER 62.94 140.26 0.02 OUTLIER 'General case' 0 C--N 1.311 -1.084 0 CA-C-O 124.199 1.952 . . . . 10.0 116.15 179.58 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.415 ' N ' ' HG2' ' A' ' 10' ' ' MET . 4.1 tt -108.83 -50.15 3.05 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 120.306 -1.496 . . . . 10.0 108.967 -179.847 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -174.15 157.6 2.87 Favored 'General case' 0 C--O 1.241 0.632 0 C-N-CA 119.544 -0.863 . . . . 10.0 112.773 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -116.2 161.0 19.61 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 127.205 2.202 . . . . 10.0 107.402 -179.711 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 -123.39 -89.39 0.59 Allowed 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 114.218 1.192 . . . . 10.0 114.218 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -80.61 46.82 0.89 Allowed 'General case' 0 N--CA 1.469 0.512 0 O-C-N 124.572 1.17 . . . . 10.0 113.271 -179.701 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -66.36 -36.76 83.69 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 113.85 1.056 . . . . 10.0 113.85 179.555 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -76.55 -32.93 58.5 Favored 'General case' 0 CA--C 1.515 -0.397 0 O-C-N 118.783 -2.448 . . . . 10.0 111.423 179.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -79.61 -24.74 41.76 Favored 'General case' 0 C--O 1.219 -0.502 0 N-CA-C 107.165 -1.421 . . . . 10.0 107.165 179.796 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 42.4 t80 -68.16 -41.12 82.0 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-O 117.44 -1.267 . . . . 10.0 110.848 -179.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 84.5 mt -78.35 -21.89 48.8 Favored 'General case' 0 C--O 1.214 -0.769 0 CA-C-O 123.69 1.71 . . . . 10.0 112.747 -179.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.25 -42.61 88.31 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 113.66 -1.609 . . . . 10.0 108.415 -179.774 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.57 -21.54 65.43 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 126.17 1.788 . . . . 10.0 110.795 -179.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 35.3 mt -95.78 -9.55 31.39 Favored 'General case' 0 C--O 1.241 0.622 0 C-N-CA 124.746 1.218 . . . . 10.0 108.981 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 62.59 38.57 12.21 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-O 116.697 -1.62 . . . . 10.0 112.086 179.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.432 HG13 ' CD2' ' A' ' 29' ' ' LEU . 2.1 t -91.18 154.33 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.82 0 N-CA-C 107.421 -1.326 . . . . 10.0 107.421 179.547 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.26 0.0 OUTLIER -58.08 163.17 2.96 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 127.071 2.732 . . . . 10.0 116.948 -179.687 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 68.9 t -71.97 -26.32 25.21 Favored 'Isoleucine or valine' 0 C--O 1.236 0.372 0 N-CA-C 113.964 1.098 . . . . 10.0 113.964 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.88 -38.16 76.29 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 123.615 0.766 . . . . 10.0 111.105 179.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.432 ' CD2' HG13 ' A' ' 25' ' ' VAL . 8.1 tt -79.32 -24.17 42.98 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 122.373 1.082 . . . . 10.0 108.562 179.448 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -78.78 -41.92 29.27 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 114.837 -1.074 . . . . 10.0 108.881 179.787 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.4 tttt -63.76 -48.31 77.49 Favored 'General case' 0 N--CA 1.442 -0.865 0 C-N-CA 125.135 1.374 . . . . 10.0 113.504 -179.524 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 11.8 mm -72.37 -38.06 59.85 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.575 0 O-C-N 119.707 -1.871 . . . . 10.0 113.783 -179.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -68.15 -37.52 81.14 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 115.835 1.791 . . . . 10.0 115.835 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -57.98 -31.38 66.86 Favored 'General case' 0 C--O 1.216 -0.71 0 N-CA-C 115.075 1.509 . . . . 10.0 115.075 -179.806 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 40.4 mt -81.31 -25.32 36.56 Favored 'General case' 0 C--O 1.217 -0.647 0 CA-C-O 122.172 0.987 . . . . 10.0 113.553 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 11.6 mt -96.58 157.79 15.74 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.572 -0.74 . . . . 10.0 112.866 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 30.1 mttm -145.74 146.02 27.58 Favored Pre-proline 0 N--CA 1.48 1.039 0 N-CA-C 102.422 -3.177 . . . . 10.0 102.422 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 0.1 OUTLIER -100.46 -172.24 0.11 Allowed 'Trans proline' 0 CA--C 1.543 0.952 0 C-N-CA 122.636 2.224 . . . . 10.0 117.427 -179.785 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -142.96 136.69 28.78 Favored 'General case' 0 C--N 1.315 -0.921 0 O-C-N 127.54 3.025 . . . . 10.0 104.329 179.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.523 ' HB2' ' CE2' ' A' ' 130' ' ' PHE . 0.1 OUTLIER -119.58 112.13 18.95 Favored 'General case' 0 N--CA 1.438 -1.051 0 C-N-CA 119.417 -0.913 . . . . 10.0 112.503 -179.933 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -105.4 132.04 52.08 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 102.162 -3.273 . . . . 10.0 102.162 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.496 HG13 ' CH2' ' A' ' 8' ' ' TRP . 0.9 OUTLIER -115.01 161.97 13.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 118.554 0.616 . . . . 10.0 110.274 -179.918 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.6 t -144.5 123.17 6.33 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.854 0 N-CA-C 105.412 -2.07 . . . . 10.0 105.412 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -119.9 104.2 9.98 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 122.739 1.257 . . . . 10.0 111.584 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -99.69 86.16 3.27 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 104.498 -2.408 . . . . 10.0 104.498 -179.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 70.03 -112.41 4.37 Favored Glycine 0 C--N 1.34 0.803 0 N-CA-C 106.684 -2.566 . . . . 10.0 106.684 -179.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -107.17 -12.35 15.41 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 119.811 -0.756 . . . . 10.0 110.154 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 13.2 m170 -74.42 109.48 7.93 Favored 'General case' 0 N--CA 1.445 -0.723 0 O-C-N 120.88 -1.137 . . . . 10.0 109.043 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.403 ' N ' ' O ' ' A' ' 64' ' ' PHE . 2.8 ttt -87.84 140.02 29.93 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 114.395 1.257 . . . . 10.0 114.395 -179.876 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 6.9 mt -134.99 110.8 12.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 N-CA-C 102.913 -2.995 . . . . 10.0 102.913 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -100.69 132.96 45.37 Favored 'Isoleucine or valine' 0 C--O 1.241 0.612 0 N-CA-C 106.472 -1.677 . . . . 10.0 106.472 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.16 88.44 2.42 Favored 'General case' 0 N--CA 1.438 -1.025 0 O-C-N 125.377 1.673 . . . . 10.0 110.426 179.695 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 24.3 m -80.2 112.75 17.82 Favored 'General case' 0 C--N 1.318 -0.78 1 N-CA-C 99.913 -4.106 . . . . 10.0 99.913 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.1 mt -78.85 61.91 3.2 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 117.317 2.34 . . . . 10.0 117.317 -179.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.7 m -90.61 84.6 5.93 Favored 'General case' 0 C--O 1.242 0.698 0 CA-C-N 112.143 -2.299 . . . . 10.0 106.044 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -66.36 111.03 3.31 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 106.248 -1.76 . . . . 10.0 106.248 179.814 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 68.8 t80 153.89 -62.34 0.0 OUTLIER 'General case' 0 C--O 1.241 0.646 0 O-C-N 128.06 3.35 . . . . 10.0 105.14 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . 0.407 ' HA ' ' NE ' ' A' ' 58' ' ' ARG . 10.2 tpp180 -152.52 75.52 1.11 Allowed 'General case' 0 N--CA 1.444 -0.727 0 O-C-N 125.195 1.559 . . . . 10.0 110.072 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -63.13 177.84 0.56 Allowed 'General case' 0 CA--C 1.541 0.606 0 O-C-N 126.162 2.163 . . . . 10.0 114.053 -179.759 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 49.6 m-85 -102.25 -132.76 0.29 Allowed 'General case' 0 C--N 1.308 -1.196 0 O-C-N 128.613 3.696 . . . . 10.0 101.24 179.349 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 6.7 mt 108.56 122.33 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.3 -1.561 0 O-C-N 128.48 3.612 . . . . 10.0 111.306 179.548 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 4.6 mmt -150.69 170.07 20.09 Favored 'General case' 0 CA--C 1.532 0.275 0 O-C-N 127.555 3.034 . . . . 10.0 104.376 -179.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -134.62 63.85 1.61 Allowed 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 101.459 -3.534 . . . . 10.0 101.459 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.403 ' O ' ' N ' ' A' ' 49' ' ' MET . 1.5 m-30 -65.11 165.68 10.82 Favored 'General case' 0 C--N 1.342 0.256 0 N-CA-C 116.908 2.188 . . . . 10.0 116.908 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 63.3 mt-30 -136.06 125.01 24.18 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 106.208 -1.775 . . . . 10.0 106.208 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.452 ' HA ' ' CG1' ' A' ' 86' ' ' VAL . 0.9 OUTLIER -69.41 134.9 29.38 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 CA-C-O 123.092 1.425 . . . . 10.0 112.291 -179.644 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.58 -16.33 41.16 Favored Glycine 0 N--CA 1.439 -1.135 0 O-C-N 120.002 -1.686 . . . . 10.0 114.307 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 4.1 mttp -91.42 132.33 36.29 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 122.433 1.111 . . . . 10.0 111.815 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -74.55 125.26 28.24 Favored 'General case' 0 CA--C 1.53 0.179 0 O-C-N 120.977 -1.077 . . . . 10.0 109.689 -179.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -121.0 -167.11 1.43 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.187 -0.46 . . . . 10.0 110.83 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -156.75 116.41 3.49 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-O 121.877 0.846 . . . . 10.0 109.408 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -79.01 108.37 12.45 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 118.146 -1.421 . . . . 10.0 114.446 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -61.37 -29.7 70.07 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 124.889 1.368 . . . . 10.0 111.404 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 68.43 -78.38 0.04 OUTLIER 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 116.022 1.86 . . . . 10.0 116.022 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 1.7 m 15.68 82.65 0.01 OUTLIER 'General case' 0 C--N 1.313 -0.993 1 O-C-N 129.704 4.377 . . . . 10.0 111.601 -179.649 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 179.78 -57.38 0.08 OUTLIER Glycine 0 N--CA 1.438 -1.204 0 CA-C-O 117.122 -1.932 . . . . 10.0 110.37 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.1 mt -118.34 106.4 19.61 Favored 'Isoleucine or valine' 0 C--O 1.242 0.683 0 N-CA-C 104.135 -2.543 . . . . 10.0 104.135 -179.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 82.33 -51.08 0.21 Allowed 'General case' 0 CA--C 1.54 0.573 0 O-C-N 125.734 1.896 . . . . 10.0 112.293 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 74.55 102.43 0.07 Allowed 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 116.09 1.885 . . . . 10.0 116.09 179.857 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 18.0 ttp85 -163.64 121.93 1.92 Allowed 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 122.159 0.98 . . . . 10.0 109.818 179.739 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.16 152.39 30.75 Favored 'General case' 0 CA--C 1.508 -0.665 0 N-CA-C 103.424 -2.806 . . . . 10.0 103.424 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 2.8 m -143.17 -168.55 2.83 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 124.145 0.978 . . . . 10.0 108.593 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 9.1 mmm -133.14 97.56 4.03 Favored 'General case' 0 C--N 1.315 -0.9 1 N-CA-C 98.333 -4.691 . . . . 10.0 98.333 179.674 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.2 m -108.93 131.71 54.77 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 116.937 2.199 . . . . 10.0 116.937 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 3.2 m -123.85 131.49 53.59 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 104.76 -2.311 . . . . 10.0 104.76 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.452 ' CG1' ' HA ' ' A' ' 66' ' ' VAL . 0.3 OUTLIER -98.86 150.35 5.03 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.999 0 N-CA-C 101.379 -3.563 . . . . 10.0 101.379 179.778 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.3 m -157.4 160.23 38.18 Favored 'General case' 0 C--N 1.319 -0.75 0 O-C-N 125.564 1.79 . . . . 10.0 114.798 -179.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 7.6 p90 -118.3 136.23 53.82 Favored 'General case' 0 N--CA 1.465 0.311 0 O-C-N 124.083 0.864 . . . . 10.0 109.097 -179.69 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -101.33 -57.9 1.99 Allowed 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 103.075 -2.935 . . . . 10.0 103.075 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -155.3 -120.84 0.72 Allowed Glycine 0 N--CA 1.434 -1.441 0 N-CA-C 105.18 -3.168 . . . . 10.0 105.18 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -70.42 -18.37 63.01 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 118.971 1.386 . . . . 10.0 110.565 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 9.0 mtmt -88.41 -174.36 4.57 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 106.796 -1.557 . . . . 10.0 106.796 -179.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -151.18 124.83 9.03 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 104.698 -2.334 . . . . 10.0 104.698 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 8.9 mm-40 -111.52 160.68 16.93 Favored 'General case' 0 CA--C 1.502 -0.872 0 CA-C-N 113.51 -1.677 . . . . 10.0 113.914 -179.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 4.2 t -140.78 135.45 31.5 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 118.29 -0.862 . . . . 10.0 109.453 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 44.3 t -119.92 91.34 1.8 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.74 0 O-C-N 126.941 2.651 . . . . 10.0 106.919 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -91.94 72.24 5.61 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 123.901 1.81 . . . . 10.0 112.306 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 31.1 tttp -71.82 90.96 1.12 Allowed 'General case' 0 C--O 1.225 -0.23 0 O-C-N 120.194 -1.566 . . . . 10.0 109.409 179.588 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -139.83 82.17 0.25 Allowed Glycine 0 C--O 1.226 -0.396 0 N-CA-C 108.258 -1.937 . . . . 10.0 108.258 -179.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 59.12 178.36 0.08 Allowed 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 114.791 1.404 . . . . 10.0 114.791 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 37.5 mttt 55.26 175.24 0.03 OUTLIER 'General case' 0 C--O 1.24 0.563 0 N-CA-C 116.241 1.941 . . . . 10.0 116.241 179.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -107.12 116.65 32.29 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 126.383 1.873 . . . . 10.0 108.493 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 90.32 66.48 1.2 Allowed Glycine 0 C--O 1.224 -0.495 0 N-CA-C 116.22 1.248 . . . . 10.0 116.22 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.78 136.43 48.71 Favored 'General case' 0 N--CA 1.444 -0.749 0 O-C-N 124.356 0.68 . . . . 10.0 111.489 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 143.66 163.31 9.8 Favored Glycine 0 N--CA 1.441 -0.972 0 O-C-N 126.411 2.32 . . . . 10.0 108.636 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 32.0 m0 -119.81 174.37 6.48 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 119.053 1.426 . . . . 10.0 112.43 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 16.0 m -151.64 128.33 10.84 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 109.561 -0.533 . . . . 10.0 109.561 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 59.8 mm-40 -106.44 156.6 18.37 Favored 'General case' 0 C--N 1.319 -0.729 0 O-C-N 125.95 2.031 . . . . 10.0 111.346 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 1.5 t90 -171.98 119.3 0.42 Allowed 'General case' 0 N--CA 1.478 0.953 0 CA-C-O 123.297 1.523 . . . . 10.0 106.978 -179.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 60.6 mt -98.7 152.06 4.43 Favored 'Isoleucine or valine' 0 C--O 1.241 0.647 0 N-CA-C 117.367 2.358 . . . . 10.0 117.367 -179.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -130.15 -168.67 2.0 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 103.391 -2.818 . . . . 10.0 103.391 -179.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -68.0 -59.15 6.67 Favored Glycine 0 N--CA 1.469 0.856 0 O-C-N 120.678 -1.264 . . . . 10.0 110.035 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -117.8 9.63 13.01 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 119.655 1.727 . . . . 10.0 113.292 179.719 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -128.53 -159.75 0.97 Allowed 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 115.618 1.71 . . . . 10.0 115.618 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.589 ' CD1' ' CD2' ' A' ' 8' ' ' TRP . 0.4 OUTLIER -171.86 134.53 0.79 Allowed 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 106.451 -1.685 . . . . 10.0 106.451 179.904 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -117.38 86.64 2.55 Favored 'General case' 0 C--O 1.236 0.372 0 O-C-N 125.044 1.465 . . . . 10.0 109.41 -179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 1.5 tp -95.26 148.0 22.87 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.059 -1.089 . . . . 10.0 108.059 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -127.12 157.22 40.27 Favored 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 106.924 -1.51 . . . . 10.0 106.924 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 18.9 mtm -142.68 114.42 8.07 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 123.715 1.721 . . . . 10.0 108.694 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 5.9 ttp180 -104.64 129.8 52.74 Favored 'General case' 0 CA--C 1.506 -0.734 0 CA-C-O 122.37 1.081 . . . . 10.0 112.9 179.405 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -148.39 118.87 7.4 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 114.423 -1.262 . . . . 10.0 107.799 -179.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 37.68 47.45 0.82 Allowed 'General case' 0 C--O 1.243 0.76 0 O-C-N 126.626 2.454 . . . . 10.0 117.344 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 91.06 -4.26 81.15 Favored Glycine 0 C--N 1.337 0.585 0 C-N-CA 119.022 -1.561 . . . . 10.0 114.011 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -96.95 151.62 4.11 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.514 0 N-CA-C 107.624 -1.25 . . . . 10.0 107.624 179.695 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 2.9 m -134.66 102.54 5.32 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 113.954 -1.475 . . . . 10.0 111.875 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -115.1 134.41 55.19 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 105.844 -1.91 . . . . 10.0 105.844 179.892 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 14.0 mtmm -127.3 125.13 40.31 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 115.444 1.646 . . . . 10.0 115.444 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 1.2 mm100 -99.21 113.52 25.83 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-N 114.389 -1.278 . . . . 10.0 109.697 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 8.0 t -96.74 127.25 49.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 N-CA-C 104.666 -2.346 . . . . 10.0 104.666 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . 0.523 ' CE2' ' HB2' ' A' ' 40' ' ' LYS . 8.1 m-30 -110.25 144.67 38.59 Favored 'General case' 0 N--CA 1.441 -0.891 0 C-N-CA 124.188 0.995 . . . . 10.0 112.678 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 6.3 tptm -127.72 92.4 3.48 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 105.765 -1.939 . . . . 10.0 105.765 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 11.0 ptpt -53.38 129.85 33.33 Favored 'General case' 0 CA--C 1.503 -0.83 0 CA-C-O 125.736 2.684 . . . . 10.0 111.259 -179.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -83.7 -3.0 7.27 Favored 'Isoleucine or valine' 0 C--O 1.236 0.342 0 O-C-N 120.041 -1.662 . . . . 10.0 111.69 -179.92 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' HIS . . . . . 0.407 ' CD2' ' C ' ' A' ' 134' ' ' HIS . 4.5 t60 . . . . . 0 C--N 1.314 -0.937 0 O-C-N 125.47 1.731 . . . . 10.0 110.684 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 43.1 p-10 . . . . . 0 N--CA 1.47 0.551 0 CA-C-O 124.26 1.981 . . . . 10.0 109.286 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 41.9 m-85 -54.05 -13.51 0.82 Allowed 'General case' 0 C--O 1.242 0.662 0 CA-C-O 116.616 -1.659 . . . . 10.0 114.568 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -53.92 131.32 39.92 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-O 124.34 2.019 . . . . 10.0 113.793 179.623 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 155.14 165.0 13.58 Favored Glycine 0 CA--C 1.528 0.902 0 O-C-N 119.778 -1.826 . . . . 10.0 114.002 179.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . 0.475 ' N ' ' CD1' ' A' ' 7' ' ' TYR . 1.9 m-30 -104.73 121.78 44.31 Favored 'General case' 0 C--O 1.243 0.755 0 CA-C-O 116.565 -1.683 . . . . 10.0 106.756 179.61 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.651 ' CE2' ' HB2' ' A' ' 40' ' ' LYS . 1.1 p-90 -113.59 145.88 40.58 Favored 'General case' 0 N--CA 1.44 -0.955 0 CA-C-O 123.37 1.557 . . . . 10.0 115.042 179.601 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.5 ptpp? -121.85 120.0 33.24 Favored 'General case' 0 N--CA 1.437 -1.097 0 N-CA-C 105.16 -2.163 . . . . 10.0 105.16 -179.422 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.506 ' HB3' ' CZ3' ' A' ' 8' ' ' TRP . 6.7 ptm -68.66 142.14 55.16 Favored 'General case' 0 CA--C 1.506 -0.727 0 O-C-N 118.834 -2.416 . . . . 10.0 115.697 -179.596 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 12.1 tp -97.75 -33.88 11.11 Favored 'General case' 0 CA--C 1.508 -0.652 0 O-C-N 120.303 -1.498 . . . . 10.0 109.609 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -152.57 152.08 31.42 Favored 'General case' 0 CA--C 1.515 -0.399 0 N-CA-C 115.388 1.625 . . . . 10.0 115.388 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -134.9 132.6 38.7 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 106.807 -1.553 . . . . 10.0 106.807 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -132.29 162.59 30.63 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 119.249 0.931 . . . . 10.0 113.023 179.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 2.7 m120 37.65 25.81 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.472 0 O-C-N 126.918 2.636 . . . . 10.0 116.851 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -65.35 -31.99 73.4 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 118.862 -2.399 . . . . 10.0 114.218 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -65.77 -41.82 91.59 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 115.437 1.643 . . . . 10.0 115.437 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -79.82 -22.08 43.46 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 107.007 -1.479 . . . . 10.0 107.007 179.666 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.411 ' CZ ' HD12 ' A' ' 23' ' ' LEU . 2.9 t80 -66.84 -36.94 83.49 Favored 'General case' 0 CA--C 1.55 0.958 0 O-C-N 121.023 -1.048 . . . . 10.0 111.137 -179.582 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 20.5 mt -71.69 -39.18 70.38 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 125.356 1.462 . . . . 10.0 111.015 179.82 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 22.4 ttp180 -71.84 -28.18 63.38 Favored 'General case' 0 C--O 1.244 0.806 0 O-C-N 124.859 1.349 . . . . 10.0 110.704 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.36 -42.97 95.94 Favored 'General case' 0 C--O 1.212 -0.873 0 C-N-CA 124.266 1.026 . . . . 10.0 113.652 -179.814 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.411 HD12 ' CZ ' ' A' ' 19' ' ' TYR . 0.3 OUTLIER -91.84 -22.97 19.83 Favored 'General case' 0 C--N 1.345 0.374 0 CA-C-O 122.216 1.008 . . . . 10.0 113.461 -179.966 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.6 t0 66.29 70.55 0.41 Allowed 'General case' 0 N--CA 1.481 1.078 0 O-C-N 119.644 -1.91 . . . . 10.0 112.173 179.423 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -93.34 -51.35 11.31 Favored 'Isoleucine or valine' 0 C--O 1.242 0.675 0 N-CA-C 106.337 -1.727 . . . . 10.0 106.337 -179.822 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 177.92 152.26 0.27 Allowed 'General case' 0 C--O 1.243 0.749 0 N-CA-C 116.788 2.144 . . . . 10.0 116.788 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.41 ' CG1' ' N ' ' A' ' 28' ' ' ALA . 0.3 OUTLIER -74.53 -37.76 44.62 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 C-N-CA 125.464 1.505 . . . . 10.0 113.75 -179.601 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.41 ' N ' ' CG1' ' A' ' 27' ' ' VAL . . . -76.4 -31.79 58.16 Favored 'General case' 0 C--N 1.319 -0.729 0 O-C-N 126.147 2.154 . . . . 10.0 112.959 179.896 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.1 tp -68.28 -29.57 68.39 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.9 0.704 . . . . 10.0 112.9 179.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.41 -30.5 70.28 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 113.307 0.855 . . . . 10.0 113.307 -179.803 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.62 -37.89 41.12 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 113.242 -1.799 . . . . 10.0 110.289 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 48.1 mt -77.37 -48.38 24.63 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 O-C-N 119.746 -1.846 . . . . 10.0 112.821 -179.387 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -55.8 -33.91 64.84 Favored 'General case' 0 C--O 1.216 -0.692 0 CA-C-O 117.699 -1.143 . . . . 10.0 113.799 179.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -69.39 -9.57 54.11 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 115.078 1.51 . . . . 10.0 115.078 179.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.5 mt -104.57 14.17 30.39 Favored 'General case' 0 C--N 1.315 -0.907 0 O-C-N 124.973 1.421 . . . . 10.0 111.188 179.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -128.85 147.76 50.84 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.095 0.958 . . . . 10.0 110.572 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 4.6 mttt -129.88 73.35 81.51 Favored Pre-proline 0 C--O 1.218 -0.562 0 N-CA-C 106.27 -1.752 . . . . 10.0 106.27 -179.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 9.0 Cg_endo -52.93 128.52 29.15 Favored 'Trans proline' 0 N--CA 1.451 -1.004 0 O-C-N 125.418 2.272 . . . . 10.0 116.104 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -106.48 142.53 35.99 Favored 'General case' 0 C--N 1.316 -0.854 0 O-C-N 128.458 3.599 . . . . 10.0 104.724 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.651 ' HB2' ' CE2' ' A' ' 8' ' ' TRP . 1.4 ttmt -112.6 177.79 4.51 Favored 'General case' 0 C--O 1.21 -0.991 0 O-C-N 124.796 1.31 . . . . 10.0 112.262 -179.601 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -158.26 120.7 3.71 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 104.887 -2.264 . . . . 10.0 104.887 -179.479 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 19.0 mm -103.14 152.6 5.89 Favored 'Isoleucine or valine' 0 C--O 1.242 0.69 0 O-C-N 125.555 1.785 . . . . 10.0 112.622 179.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 62.4 t -154.25 98.72 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 CA-C-N 113.369 -1.741 . . . . 10.0 108.538 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -98.61 118.61 35.7 Favored 'General case' 0 C--N 1.311 -1.068 0 C-N-CA 125.056 1.342 . . . . 10.0 107.532 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -93.58 18.76 9.46 Favored 'General case' 0 C--O 1.24 0.587 0 CA-C-O 117.429 -1.272 . . . . 10.0 108.032 -179.82 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 113.77 -100.28 1.04 Allowed Glycine 0 CA--C 1.523 0.536 0 N-CA-C 107.634 -2.187 . . . . 10.0 107.634 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -86.1 -29.04 23.65 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 121.493 -1.004 . . . . 10.0 109.322 179.854 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -95.78 121.79 37.88 Favored 'General case' 0 CA--C 1.509 -0.609 0 N-CA-C 107.777 -1.194 . . . . 10.0 107.777 179.834 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 9.0 ttt -114.64 124.2 51.22 Favored 'General case' 0 CA--C 1.504 -0.827 0 CA-C-O 123.102 1.43 . . . . 10.0 112.285 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 30.7 mm -108.81 122.05 62.83 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.29 0 N-CA-C 107.393 -1.336 . . . . 10.0 107.393 -179.764 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.415 ' CG2' ' HD3' ' A' ' 40' ' ' LYS . 1.5 mm -107.87 135.97 44.78 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 N-CA-C 105.253 -2.129 . . . . 10.0 105.253 179.881 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 12.7 mtm-85 -133.7 122.58 23.6 Favored 'General case' 0 CA--C 1.51 -0.582 0 C-N-CA 119.978 -0.689 . . . . 10.0 112.361 -179.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 58.3 m -98.42 129.38 45.05 Favored 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 102.492 -3.151 . . . . 10.0 102.492 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 8.8 mt -117.71 54.24 0.91 Allowed 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 119.398 3.111 . . . . 10.0 119.398 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 60.6 p -73.54 -172.75 1.27 Allowed 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 103.864 -2.643 . . . . 10.0 103.864 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 8.0 p -120.56 -13.42 8.78 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-O 118.667 -0.682 . . . . 10.0 111.973 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -81.16 -46.38 14.97 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.36 -0.978 . . . . 10.0 108.36 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.37 143.21 16.25 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-O 123.906 1.813 . . . . 10.0 112.879 -179.856 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -87.82 142.84 27.49 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 114.067 -1.424 . . . . 10.0 107.964 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -149.87 118.48 6.54 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 126.689 2.493 . . . . 10.0 105.206 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -109.44 -175.13 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.313 -1.006 0 O-C-N 124.943 1.402 . . . . 10.0 112.598 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' MET . . . . . 0.409 ' HB2' ' HB ' ' A' ' 51' ' ' ILE . 2.3 mtm -143.21 -179.58 6.48 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 106.931 -1.507 . . . . 10.0 106.931 -179.772 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 64.7 t0 -162.12 80.92 0.55 Allowed 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 102.889 -3.004 . . . . 10.0 102.889 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 2.0 m-30 -88.67 166.15 14.29 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 125.2 1.562 . . . . 10.0 112.207 179.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.25 126.0 15.17 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 103.8 -2.667 . . . . 10.0 103.8 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.0 p -89.88 133.8 30.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 O-C-N 124.658 1.224 . . . . 10.0 108.453 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 91.1 -12.3 69.56 Favored Glycine 0 C--O 1.219 -0.811 0 C-N-CA 120.168 -1.015 . . . . 10.0 115.251 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.2 mttm -109.3 -173.19 2.21 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 117.44 0.62 . . . . 10.0 112.359 179.844 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -131.32 139.93 49.65 Favored 'General case' 0 C--N 1.314 -0.94 0 O-C-N 125.223 1.577 . . . . 10.0 107.533 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 10.5 p90 -154.5 135.33 13.68 Favored 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 118.597 -1.241 . . . . 10.0 110.173 179.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.13 155.86 22.4 Favored 'General case' 0 C--O 1.222 -0.393 0 N-CA-C 106.316 -1.735 . . . . 10.0 106.316 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -156.24 116.76 3.71 Favored 'General case' 0 N--CA 1.438 -1.071 0 N-CA-C 117.614 2.45 . . . . 10.0 117.614 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 -83.29 91.65 7.34 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 105.236 -2.135 . . . . 10.0 105.236 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 13.0 mt -62.15 3.43 0.17 Allowed 'General case' 0 N--CA 1.438 -1.068 0 N-CA-C 117.88 2.548 . . . . 10.0 117.88 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 50.8 p -41.97 109.65 0.14 Allowed 'General case' 0 C--O 1.24 0.575 0 O-C-N 125.76 1.913 . . . . 10.0 108.98 179.699 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 134.9 -30.25 2.86 Favored Glycine 0 CA--C 1.525 0.706 0 CA-C-N 113.21 -1.813 . . . . 10.0 109.8 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.5 mm -128.3 -17.1 2.36 Favored 'Isoleucine or valine' 0 C--O 1.247 0.938 0 CA-C-N 117.774 0.787 . . . . 10.0 111.43 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -144.44 -40.49 0.27 Allowed 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 117.641 -1.171 . . . . 10.0 113.195 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 93.53 -23.22 0.06 Allowed 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 126.987 2.115 . . . . 10.0 113.651 -179.824 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -94.7 166.71 11.87 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 117.367 -1.301 . . . . 10.0 112.932 -179.758 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.86 168.57 12.59 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 103.143 -2.91 . . . . 10.0 103.143 -179.919 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -153.06 -170.83 3.74 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 113.914 -1.494 . . . . 10.0 110.282 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.6 mmt -119.98 49.36 1.41 Allowed 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 101.387 -3.56 . . . . 10.0 101.387 179.772 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 42.3 m -44.93 104.23 0.04 OUTLIER 'General case' 0 N--CA 1.439 -1.003 0 N-CA-C 119.243 3.053 . . . . 10.0 119.243 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 22.7 m -102.34 133.99 46.37 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 105.359 -2.089 . . . . 10.0 105.359 -179.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -117.57 109.87 28.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 102.956 -2.979 . . . . 10.0 102.956 -179.828 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 17.3 m -104.05 166.42 10.42 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 115.888 -0.596 . . . . 10.0 111.484 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 11.5 p-90 -126.61 55.09 1.55 Allowed 'General case' 0 CA--C 1.511 -0.544 0 CA-C-O 125.027 2.346 . . . . 10.0 109.991 -179.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -66.4 109.25 2.65 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 101.343 -3.577 . . . . 10.0 101.343 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 81.93 -154.4 33.78 Favored Glycine 0 N--CA 1.446 -0.696 0 N-CA-C 108.273 -1.931 . . . . 10.0 108.273 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -103.46 42.42 1.17 Allowed 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 123.073 1.416 . . . . 10.0 109.846 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 7.2 mtmt -122.27 -166.16 1.37 Allowed 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 113.195 -1.821 . . . . 10.0 108.228 179.82 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 5.2 tt -141.33 102.57 4.25 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 105.573 -2.01 . . . . 10.0 105.573 -179.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -113.77 118.99 35.83 Favored 'General case' 0 CA--C 1.507 -0.674 0 O-C-N 120.81 -1.181 . . . . 10.0 112.84 179.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 19.9 p -127.51 148.41 50.32 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 112.828 0.677 . . . . 10.0 112.828 179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 88.9 t -126.33 125.75 68.09 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.75 0 N-CA-C 106.399 -1.704 . . . . 10.0 106.399 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 59.3 mt-30 -107.84 57.96 0.62 Allowed 'General case' 0 C--N 1.317 -0.822 0 O-C-N 126.654 2.471 . . . . 10.0 110.997 -179.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 1.5 mmmm -9.41 -92.23 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.602 0 O-C-N 128.032 3.333 . . . . 10.0 115.754 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 43.73 38.06 4.16 Favored Glycine 0 N--CA 1.44 -1.044 0 CA-C-O 118.025 -1.431 . . . . 10.0 113.054 179.551 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 68.03 -141.01 0.11 Allowed 'General case' 0 C--N 1.32 -0.698 0 O-C-N 125.723 1.484 . . . . 10.0 111.09 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 2.1 mmmm 57.32 174.1 0.05 OUTLIER 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 117.293 2.331 . . . . 10.0 117.293 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 45.8 mm-40 -82.06 -44.26 16.82 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 126.589 1.956 . . . . 10.0 109.423 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -113.26 -102.33 2.55 Favored Glycine 0 N--CA 1.444 -0.812 0 CA-C-O 122.641 1.134 . . . . 10.0 115.776 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 2.4 mtt180 63.19 91.83 0.07 Allowed 'General case' 0 CA--C 1.535 0.383 0 O-C-N 120.765 -1.432 . . . . 10.0 114.166 179.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 166.3 155.68 9.01 Favored Glycine 0 N--CA 1.447 -0.631 0 O-C-N 126.284 2.24 . . . . 10.0 108.163 -179.796 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' TRP . . . . . 0.411 ' CE3' ' HE3' ' A' ' 119' ' ' MET . 1.6 m0 -114.43 169.29 9.15 Favored 'General case' 0 CA--C 1.505 -0.75 0 O-C-N 125.314 1.244 . . . . 10.0 109.969 179.888 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 2.2 m -149.65 118.38 6.6 Favored 'General case' 0 CA--C 1.506 -0.728 0 N-CA-C 107.577 -1.268 . . . . 10.0 107.577 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -112.55 117.07 31.31 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.986 -179.719 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 1.5 p90 -137.07 140.59 42.1 Favored 'General case' 0 C--O 1.217 -0.607 0 N-CA-C 107.201 -1.407 . . . . 10.0 107.201 179.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 60.7 mt -96.18 159.76 2.92 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.004 0 N-CA-C 114.506 1.299 . . . . 10.0 114.506 179.609 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -166.97 113.32 0.79 Allowed 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 116.939 -1.505 . . . . 10.0 107.208 -179.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 53.51 40.78 62.9 Favored Glycine 0 N--CA 1.464 0.544 0 N-CA-C 106.447 -2.661 . . . . 10.0 106.447 179.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 64.0 9.41 4.59 Favored 'General case' 0 CA--C 1.552 1.054 0 CA-C-O 117.396 -1.287 . . . . 10.0 111.035 179.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -100.27 90.61 4.4 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 124.06 0.85 . . . . 10.0 110.184 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.432 ' HB3' ' HB2' ' A' ' 130' ' ' PHE . 12.1 tp -57.83 118.96 5.87 Favored 'General case' 0 N--CA 1.444 -0.764 0 N-CA-C 106.887 -1.523 . . . . 10.0 106.887 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . 0.412 ' CE1' HG13 ' A' ' 129' ' ' VAL . 1.4 m-70 -112.83 103.22 11.21 Favored 'General case' 0 CA--C 1.5 -0.968 0 O-C-N 125.772 1.92 . . . . 10.0 107.401 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 42.4 tp -93.55 143.9 25.87 Favored 'General case' 0 C--O 1.241 0.615 0 O-C-N 119.282 -2.136 . . . . 10.0 113.385 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 66.6 tt0 -130.32 123.57 30.29 Favored 'General case' 0 C--O 1.217 -0.607 0 CA-C-O 117.636 -1.173 . . . . 10.0 109.661 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.411 ' HE3' ' CE3' ' A' ' 106' ' ' TRP . 6.5 mtt -116.63 153.45 32.26 Favored 'General case' 0 C--O 1.239 0.546 0 O-C-N 124.295 0.997 . . . . 10.0 110.599 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 1.1 mmm-85 -147.6 139.99 24.52 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 117.935 -1.031 . . . . 10.0 110.644 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -153.98 117.09 4.52 Favored 'General case' 0 N--CA 1.443 -0.805 0 O-C-N 124.527 1.142 . . . . 10.0 111.342 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 56.28 39.88 30.05 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 116.953 2.205 . . . . 10.0 116.953 179.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 87.79 -6.43 83.47 Favored Glycine 0 CA--C 1.539 1.546 0 CA-C-O 118.663 -1.076 . . . . 10.0 112.272 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 2.0 t -98.9 131.92 45.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 125.213 1.405 . . . . 10.0 108.206 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 94.3 m -111.67 140.2 46.5 Favored 'General case' 0 N--CA 1.446 -0.642 0 O-C-N 125.724 1.89 . . . . 10.0 110.822 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -129.16 145.46 51.31 Favored 'General case' 0 C--O 1.221 -0.417 0 N-CA-C 106.043 -1.836 . . . . 10.0 106.043 -179.911 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 2.2 mtmm -137.44 141.83 41.61 Favored 'General case' 0 C--N 1.328 -0.343 0 O-C-N 120.431 -1.418 . . . . 10.0 114.141 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -132.99 130.46 39.52 Favored 'General case' 0 CA--C 1.503 -0.854 0 O-C-N 125.209 1.568 . . . . 10.0 109.815 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.412 HG13 ' CE1' ' A' ' 116' ' ' HIS . 0.0 OUTLIER -106.15 96.33 4.52 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.379 0 C-N-CA 124.005 0.922 . . . . 10.0 110.543 179.92 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . 0.488 ' CZ ' ' CZ2' ' A' ' 8' ' ' TRP . 5.5 m-85 -83.86 175.98 9.23 Favored 'General case' 0 C--N 1.321 -0.631 0 O-C-N 126.637 2.461 . . . . 10.0 109.054 -179.766 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 23.4 tptp -148.27 98.39 2.91 Favored 'General case' 0 N--CA 1.44 -0.935 0 N-CA-C 106.852 -1.536 . . . . 10.0 106.852 179.754 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 7.7 ttpt -63.5 122.9 17.41 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 125.636 1.835 . . . . 10.0 108.795 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 24.6 t -102.45 -57.3 4.57 Favored 'Isoleucine or valine' 0 C--O 1.244 0.809 0 N-CA-C 113.911 1.078 . . . . 10.0 113.911 179.665 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 3.3 t-80 . . . . . 0 C--O 1.244 0.8 0 C-N-CA 118.086 -1.446 . . . . 10.0 113.828 179.824 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 . . . . . 0 N--CA 1.472 0.672 0 N-CA-C 108.654 -0.869 . . . . 10.0 108.654 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 2.8 m-30 -72.41 -28.18 62.82 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 115.999 1.851 . . . . 10.0 115.999 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.4 p30 -68.13 139.32 56.16 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-N 120.921 1.691 . . . . 10.0 114.389 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -156.5 -93.12 0.09 OUTLIER Glycine 0 C--O 1.216 -1.006 0 N-CA-C 119.114 2.406 . . . . 10.0 119.114 -179.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . 0.546 ' HA ' ' CE3' ' A' ' 8' ' ' TRP . 0.8 OUTLIER 172.7 170.91 0.12 Allowed 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 103.501 -2.778 . . . . 10.0 103.501 179.362 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.63 ' CD1' ' HB2' ' A' ' 39' ' ' ASP 0.331 32.0 p90 -152.05 159.25 43.75 Favored 'General case' 0 N--CA 1.441 -0.899 0 N-CA-C 115.459 1.651 . . . . 10.0 115.459 -178.116 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.497 ' HD3' ' CG ' ' A' ' 132' ' ' LYS . 2.3 pttp -167.28 88.38 0.3 Allowed 'General case' 0 C--O 1.216 -0.709 0 O-C-N 127.879 3.237 . . . . 10.0 108.313 175.844 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.423 ' HE2' ' HD2' ' A' ' 38' ' ' PRO . 2.1 ttp -54.49 140.12 35.44 Favored 'General case' 0 CA--C 1.509 -0.616 0 N-CA-C 116.521 2.045 . . . . 10.0 116.521 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.8 tp -101.73 -42.95 6.0 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 114.448 -1.251 . . . . 10.0 108.07 179.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -162.0 161.71 28.62 Favored 'General case' 0 C--O 1.244 0.792 0 O-C-N 125.377 1.673 . . . . 10.0 115.446 179.663 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -135.43 173.25 11.93 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 105.247 -2.131 . . . . 10.0 105.247 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -162.19 151.84 16.17 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 119.889 -1.757 . . . . 10.0 115.497 179.616 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 57.51 27.46 14.07 Favored 'General case' 0 C--N 1.324 -0.541 0 O-C-N 127.084 2.74 . . . . 10.0 115.582 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.4 ' CD1' ' N ' ' A' ' 16' ' ' PHE . 0.0 OUTLIER -56.55 -29.56 62.09 Favored 'General case' 0 C--O 1.244 0.784 0 C-N-CA 126.045 1.738 . . . . 10.0 114.932 179.931 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -78.66 -43.43 26.15 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 120.414 1.461 . . . . 10.0 109.169 179.186 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.08 -21.95 63.1 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-O 117.834 -1.079 . . . . 10.0 110.884 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -72.76 -36.04 67.59 Favored 'General case' 0 CA--C 1.552 1.052 0 O-C-N 124.79 1.306 . . . . 10.0 109.783 -179.911 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 75.0 mt -74.17 -27.96 61.07 Favored 'General case' 0 C--O 1.22 -0.454 0 CA-C-N 114.022 -1.444 . . . . 10.0 111.207 -179.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.5 ttt180 -73.47 -23.48 60.08 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 114.099 -1.409 . . . . 10.0 110.057 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.24 -24.62 62.22 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 122.258 1.028 . . . . 10.0 112.205 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.5 mt -109.71 -1.28 18.1 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 114.222 -1.354 . . . . 10.0 114.444 -179.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 55.68 72.06 0.51 Allowed 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 118.884 0.766 . . . . 10.0 111.415 179.717 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.412 HG22 ' N ' ' A' ' 26' ' ' ASN . 2.2 p -94.58 -109.94 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.24 0.563 0 CA-C-O 117.084 -1.436 . . . . 10.0 107.416 179.965 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.412 ' N ' HG22 ' A' ' 25' ' ' VAL . 0.9 OUTLIER -148.37 161.99 40.46 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-N 120.437 1.471 . . . . 10.0 113.582 179.761 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -77.25 -20.0 14.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 O-C-N 125.876 1.985 . . . . 10.0 114.017 -179.6 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -77.32 -34.18 55.39 Favored 'General case' 0 C--O 1.242 0.677 0 O-C-N 125.274 1.609 . . . . 10.0 109.326 179.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.404 ' CD2' HG23 ' A' ' 25' ' ' VAL . 44.8 tp -77.91 -40.01 41.14 Favored 'General case' 0 C--O 1.222 -0.392 0 C-N-CA 118.393 -1.323 . . . . 10.0 113.487 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 8.8 mtm-85 -59.09 -23.26 61.92 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 125.65 1.58 . . . . 10.0 114.163 179.714 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.7 ttpp -76.53 -43.25 40.07 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 117.844 -1.074 . . . . 10.0 109.971 179.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -79.52 -40.94 21.91 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 O-C-N 125.709 1.881 . . . . 10.0 109.807 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -55.4 -58.6 7.06 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-O 121.83 0.824 . . . . 10.0 112.094 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -64.89 82.28 0.04 OUTLIER 'General case' 0 C--N 1.342 0.265 0 CA-C-N 113.775 -1.557 . . . . 10.0 110.247 179.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 162.77 -32.59 0.0 OUTLIER 'General case' 0 N--CA 1.444 -0.77 0 O-C-N 126.112 2.132 . . . . 10.0 111.144 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.5 mt -88.98 155.38 19.53 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 124.372 1.045 . . . . 10.0 111.096 179.562 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.1 pttt -138.35 105.64 7.82 Favored Pre-proline 0 C--N 1.319 -0.723 0 N-CA-C 103.911 -2.625 . . . . 10.0 103.911 179.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.423 ' HD2' ' HE2' ' A' ' 10' ' ' MET . 95.8 Cg_exo -51.15 -166.68 0.0 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.327 0 C-N-CA 125.04 3.827 . . . . 10.0 119.123 179.785 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.63 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 4.7 p30 -153.22 167.79 28.13 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 112.724 -2.035 . . . . 10.0 106.522 -179.555 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.454 ' HB2' ' CZ ' ' A' ' 130' ' ' PHE . 0.3 OUTLIER -149.97 121.07 7.74 Favored 'General case' 0 CA--C 1.497 -1.085 0 C-N-CA 116.994 -1.882 . . . . 10.0 112.819 -179.433 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.558 ' HA ' ' CE3' ' A' ' 8' ' ' TRP . 2.4 tt0 -110.36 103.12 11.73 Favored 'General case' 0 CA--C 1.509 -0.611 0 O-C-N 119.95 -1.719 . . . . 10.0 106.91 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 67.6 mt -93.44 130.13 42.89 Favored 'Isoleucine or valine' 0 C--O 1.243 0.737 0 CA-C-N 115.115 -0.948 . . . . 10.0 108.906 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -119.13 122.65 69.76 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.934 0 N-CA-C 107.04 -1.467 . . . . 10.0 107.04 -179.885 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -143.78 107.05 4.54 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 105.921 -1.881 . . . . 10.0 105.921 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -81.03 -51.44 8.5 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 123.281 1.515 . . . . 10.0 107.822 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -155.15 -83.93 0.04 OUTLIER Glycine 0 C--N 1.345 1.06 0 N-CA-C 108.916 -1.674 . . . . 10.0 108.916 -179.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -111.27 -1.61 16.01 Favored 'General case' 0 N--CA 1.443 -0.817 0 O-C-N 121.124 -1.221 . . . . 10.0 109.658 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 65.9 m170 -107.5 102.87 12.1 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 109.085 -0.709 . . . . 10.0 109.085 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 2.5 ttt -95.15 151.13 19.47 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 116.495 2.035 . . . . 10.0 116.495 -179.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 19.4 mt -145.64 127.42 8.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 105.939 -1.874 . . . . 10.0 105.939 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.4 mp -112.2 123.66 68.15 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 CA-C-N 114.664 -1.153 . . . . 10.0 108.328 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.409 ' HD2' HG12 ' A' ' 61' ' ' ILE . 4.9 tpt180 -114.34 86.6 2.46 Favored 'General case' 0 C--N 1.319 -0.744 0 C-N-CA 124.714 1.206 . . . . 10.0 111.581 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 93.7 m -87.63 131.47 34.42 Favored 'General case' 0 N--CA 1.444 -0.728 0 N-CA-C 103.033 -2.951 . . . . 10.0 103.033 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 3.9 mt -105.51 66.56 0.74 Allowed 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 120.497 3.517 . . . . 10.0 120.497 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 43.8 m -76.84 116.57 17.62 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 102.706 -3.072 . . . . 10.0 102.706 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -57.58 -17.87 16.6 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 108.043 -1.095 . . . . 10.0 108.043 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -117.93 105.7 12.18 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 106.86 -1.533 . . . . 10.0 106.86 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 6.0 mmt-85 61.52 92.14 0.05 Allowed 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 114.385 -1.279 . . . . 10.0 112.816 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -40.85 150.21 0.07 Allowed 'General case' 0 CA--C 1.532 0.277 0 O-C-N 126.707 2.504 . . . . 10.0 113.067 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -132.33 98.0 4.27 Favored 'General case' 0 C--N 1.311 -1.072 0 N-CA-C 103.012 -2.958 . . . . 10.0 103.012 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.409 HG12 ' HD2' ' A' ' 52' ' ' ARG . 1.7 mp -135.18 146.84 29.61 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.055 0 N-CA-C 115.164 1.542 . . . . 10.0 115.164 179.785 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' MET . . . . . 0.4 ' N ' ' CG2' ' A' ' 61' ' ' ILE . 0.0 OUTLIER -147.09 -171.49 3.79 Favored 'General case' 0 C--O 1.216 -0.689 0 N-CA-C 106.318 -1.734 . . . . 10.0 106.318 179.905 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -167.64 123.79 1.09 Allowed 'General case' 0 C--O 1.223 -0.312 0 N-CA-C 100.923 -3.732 . . . . 10.0 100.923 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.449 ' CE1' ' CE1' ' A' ' 70' ' ' PHE . 12.7 m-85 -123.42 -175.0 3.09 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 115.144 1.535 . . . . 10.0 115.144 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -133.71 95.3 3.44 Favored 'General case' 0 N--CA 1.443 -0.782 0 N-CA-C 103.729 -2.693 . . . . 10.0 103.729 179.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.522 HG11 ' CE2' ' A' ' 88' ' ' TRP . 9.4 t -53.27 137.68 13.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 O-C-N 124.971 1.419 . . . . 10.0 109.046 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 76.64 15.44 81.56 Favored Glycine 0 N--CA 1.443 -0.877 0 CA-C-O 117.462 -1.744 . . . . 10.0 113.113 -179.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 3.8 tppt? -139.41 132.32 29.33 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 125.308 1.443 . . . . 10.0 112.116 -179.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -69.83 148.95 48.42 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 118.153 -0.927 . . . . 10.0 109.474 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.449 ' CE1' ' CE1' ' A' ' 64' ' ' PHE . 3.6 p90 -155.17 161.59 41.18 Favored 'General case' 0 C--O 1.245 0.841 0 O-C-N 124.894 1.372 . . . . 10.0 107.813 -179.787 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -100.6 123.32 44.65 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.518 -0.919 . . . . 10.0 108.518 179.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -75.01 78.03 2.2 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 114.696 -1.138 . . . . 10.0 113.639 -179.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -60.92 133.56 56.22 Favored 'General case' 0 C--N 1.316 -0.891 0 C-N-CA 119.126 -1.03 . . . . 10.0 108.247 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.0 tp -147.58 99.57 3.13 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 117.67 -1.157 . . . . 10.0 113.071 179.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.4 t -127.5 78.78 1.84 Allowed 'General case' 0 N--CA 1.443 -0.797 0 O-C-N 124.723 1.265 . . . . 10.0 108.837 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 153.25 110.94 0.43 Allowed Glycine 0 C--O 1.244 0.775 0 C-N-CA 120.006 -1.092 . . . . 10.0 110.671 179.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.6 mt 69.71 106.22 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 N-CA-C 107.527 -1.286 . . . . 10.0 107.527 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 87.64 -33.95 0.03 OUTLIER 'General case' 0 C--O 1.242 0.662 0 O-C-N 127.492 2.995 . . . . 10.0 114.319 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.2 p30 35.04 97.62 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.808 0 C-N-CA 126.956 2.103 . . . . 10.0 116.286 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.469 ' CD ' ' CZ ' ' A' ' 104' ' ' ARG . 13.6 ttp180 -124.8 -65.62 1.02 Allowed 'General case' 0 CA--C 1.512 -0.493 0 O-C-N 119.629 -1.919 . . . . 10.0 115.196 -179.902 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 76.02 120.95 0.05 OUTLIER 'General case' 0 N--CA 1.439 -1.017 0 N-CA-C 103.882 -2.636 . . . . 10.0 103.882 179.658 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -155.63 -174.46 4.98 Favored 'General case' 0 CA--C 1.512 -0.486 0 N-CA-C 108.953 -0.758 . . . . 10.0 108.953 179.898 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 4.0 ptm -121.76 148.33 44.79 Favored 'General case' 0 N--CA 1.438 -1.028 0 N-CA-C 100.237 -3.986 . . . . 10.0 100.237 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.2 m -155.68 150.29 26.12 Favored 'General case' 0 CA--C 1.501 -0.914 0 N-CA-C 114.611 1.337 . . . . 10.0 114.611 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 16.4 m -133.69 106.71 7.51 Favored 'General case' 0 N--CA 1.438 -1.052 0 O-C-N 120.965 -1.085 . . . . 10.0 109.059 -179.779 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.8 m -90.01 147.06 5.46 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.61 0 N-CA-C 103.205 -2.887 . . . . 10.0 103.205 179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -163.83 169.51 18.16 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 126.479 2.362 . . . . 10.0 114.207 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . 0.522 ' CE2' HG11 ' A' ' 66' ' ' VAL . 2.6 m-90 -97.83 122.86 41.44 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 124.096 0.958 . . . . 10.0 110.467 179.693 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -99.49 -63.21 1.15 Allowed 'General case' 0 C--O 1.247 0.944 0 N-CA-C 101.93 -3.359 . . . . 10.0 101.93 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -160.53 92.92 0.12 Allowed Glycine 0 CA--C 1.498 -1.011 0 N-CA-C 108.34 -1.904 . . . . 10.0 108.34 179.769 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 57.53 30.69 19.12 Favored 'General case' 0 C--N 1.318 -0.773 0 O-C-N 124.951 1.03 . . . . 10.0 113.054 -179.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.4 mtpt -148.42 166.15 28.99 Favored 'General case' 0 C--O 1.238 0.49 0 N-CA-C 109.282 -0.636 . . . . 10.0 109.282 -179.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.2 tt -117.57 116.65 27.52 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 105.032 -2.211 . . . . 10.0 105.032 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 25.0 mm100 -106.9 156.86 18.24 Favored 'General case' 0 N--CA 1.445 -0.724 0 O-C-N 118.411 -2.681 . . . . 10.0 111.429 179.759 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -148.02 142.48 26.39 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 118.946 -1.101 . . . . 10.0 112.126 -179.676 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 57.6 t -131.68 106.92 12.42 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 CA-C-N 114.128 -1.397 . . . . 10.0 109.133 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -91.72 114.92 27.59 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 106.144 -1.799 . . . . 10.0 106.144 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.01 -85.37 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 116.651 -1.642 . . . . 10.0 113.734 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 40.66 -142.92 0.69 Allowed Glycine 0 CA--C 1.528 0.887 0 O-C-N 125.284 1.615 . . . . 10.0 112.475 -179.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.448 ' H ' ' NH1' ' A' ' 104' ' ' ARG . 3.1 mm-40 -105.19 -159.27 0.7 Allowed 'General case' 0 C--N 1.315 -0.929 0 O-C-N 126.785 2.109 . . . . 10.0 110.461 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 68.22 -166.22 0.19 Allowed 'General case' 0 C--N 1.316 -0.855 0 O-C-N 126.333 2.271 . . . . 10.0 113.636 179.875 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -135.18 12.33 3.56 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 125.249 1.419 . . . . 10.0 114.445 -179.854 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -149.76 41.7 0.81 Allowed Glycine 0 N--CA 1.467 0.701 0 N-CA-C 116.151 1.22 . . . . 10.0 116.151 179.749 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.469 ' CZ ' ' CD ' ' A' ' 80' ' ' ARG . 70.2 mtt180 -91.73 129.4 37.71 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 113.829 1.048 . . . . 10.0 113.829 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 148.41 159.72 8.64 Favored Glycine 0 N--CA 1.462 0.379 0 C-N-CA 117.369 -2.348 . . . . 10.0 110.668 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 16.2 m0 -123.41 171.19 9.63 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 124.818 1.247 . . . . 10.0 109.75 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 3.4 m -153.35 112.98 3.85 Favored 'General case' 0 C--O 1.212 -0.91 0 N-CA-C 106.466 -1.679 . . . . 10.0 106.466 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -93.81 170.64 9.41 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 122.252 1.025 . . . . 10.0 112.567 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 2.0 t90 -176.37 108.56 0.08 Allowed 'General case' 0 C--O 1.219 -0.525 0 N-CA-C 106.935 -1.506 . . . . 10.0 106.935 179.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 54.1 mt -92.6 129.63 42.9 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 CA-C-O 124.275 1.988 . . . . 10.0 111.294 -179.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -110.48 -164.26 0.91 Allowed 'General case' 0 C--O 1.242 0.659 0 N-CA-C 106.803 -1.554 . . . . 10.0 106.803 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -96.78 108.06 3.61 Favored Glycine 0 CA--C 1.522 0.506 0 N-CA-C 107.541 -2.224 . . . . 10.0 107.541 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 78.25 12.29 1.7 Allowed 'General case' 0 C--O 1.214 -0.774 0 N-CA-C 108.461 -0.94 . . . . 10.0 108.461 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -149.79 149.88 31.18 Favored 'General case' 0 CA--C 1.509 -0.632 0 CA-C-O 123.195 1.474 . . . . 10.0 110.849 179.747 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.413 ' HB3' ' HB2' ' A' ' 130' ' ' PHE . 11.9 tp -116.83 121.27 41.03 Favored 'General case' 0 C--O 1.241 0.611 0 N-CA-C 104.3 -2.481 . . . . 10.0 104.3 -179.744 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 59.7 t-80 -114.13 117.14 30.38 Favored 'General case' 0 C--O 1.213 -0.849 0 N-CA-C 106.881 -1.526 . . . . 10.0 106.881 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -128.62 154.26 46.41 Favored 'General case' 0 CA--C 1.51 -0.567 0 O-C-N 126.0 2.063 . . . . 10.0 110.704 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -143.36 126.48 16.46 Favored 'General case' 0 CA--C 1.495 -1.161 0 N-CA-C 106.747 -1.575 . . . . 10.0 106.747 179.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 28.7 mtp -107.97 126.75 53.08 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 113.68 -1.6 . . . . 10.0 113.006 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.82 142.38 51.54 Favored 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 118.725 -1.19 . . . . 10.0 110.17 -179.931 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -158.49 127.55 5.58 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.42 -0.956 . . . . 10.0 108.42 179.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 34.86 56.84 0.75 Allowed 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 117.881 2.548 . . . . 10.0 117.881 179.903 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 77.09 11.32 85.67 Favored Glycine 0 C--N 1.317 -0.482 0 N-CA-C 116.763 1.465 . . . . 10.0 116.763 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 22.5 t -124.26 130.81 73.55 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.335 0 N-CA-C 108.124 -1.065 . . . . 10.0 108.124 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 1.6 m -119.23 108.53 14.76 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 126.553 2.408 . . . . 10.0 114.152 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.51 144.59 25.45 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 106.331 -1.729 . . . . 10.0 106.331 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -144.55 179.49 7.25 Favored 'General case' 0 C--O 1.22 -0.454 0 O-C-N 125.414 1.696 . . . . 10.0 112.477 -179.947 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -169.76 145.25 3.0 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-N 114.45 -1.25 . . . . 10.0 108.402 -179.718 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -111.96 98.59 7.24 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 O-C-N 124.687 1.242 . . . . 10.0 108.007 179.769 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . 0.454 ' CZ ' ' HB2' ' A' ' 40' ' ' LYS . 5.6 m-85 -74.0 169.67 17.01 Favored 'General case' 0 C--O 1.214 -0.767 0 O-C-N 125.734 1.896 . . . . 10.0 107.435 179.894 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . 0.438 ' C ' ' HD2' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -145.15 57.72 1.27 Allowed 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 122.999 1.38 . . . . 10.0 111.068 -179.76 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . 0.564 ' HB3' ' CA ' ' A' ' 8' ' ' TRP . 0.9 OUTLIER -162.14 -144.86 0.1 Allowed 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 104.728 -2.323 . . . . 10.0 104.728 179.588 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' VAL . . . . . 0.447 ' CB ' ' O ' ' A' ' 132' ' ' LYS . 0.4 OUTLIER 97.01 30.12 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.308 -1.201 0 O-C-N 127.708 3.13 . . . . 10.0 109.284 -179.911 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 51.1 t-80 . . . . . 0 N--CA 1.441 -0.879 0 CA-C-N 112.446 -2.161 . . . . 10.0 109.831 179.666 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 CA--C 1.538 0.518 0 N-CA-C 108.885 -0.784 . . . . 10.0 108.885 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.429 ' CE2' HD13 ' A' ' 110' ' ' ILE . 3.4 m-30 -89.99 -16.9 28.89 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 117.211 2.3 . . . . 10.0 117.211 -179.905 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -39.28 146.27 0.09 Allowed 'General case' 0 C--O 1.244 0.787 0 O-C-N 126.358 2.287 . . . . 10.0 113.433 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -179.53 -138.02 3.17 Favored Glycine 0 C--O 1.227 -0.323 0 N-CA-C 118.573 2.189 . . . . 10.0 118.573 -179.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . 0.413 ' CB ' HG11 ' A' ' 133' ' ' VAL . 50.0 m-85 -144.9 -175.88 4.85 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 119.604 -2.116 . . . . 10.0 106.616 -179.655 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.54 ' CE3' ' HB3' ' A' ' 39' ' ' ASP 0.287 11.5 p-90 -158.97 -177.32 6.42 Favored 'General case' 0 C--O 1.214 -0.766 0 N-CA-C 113.883 1.068 . . . . 10.0 113.883 -179.262 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 11.5 ptmt 157.3 97.67 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.557 0 O-C-N 127.663 3.102 . . . . 10.0 107.167 178.454 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.464 ' CE ' ' HB2' ' A' ' 13' ' ' ASN . 3.8 ppp? -61.01 139.32 58.08 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-O 117.711 -1.138 . . . . 10.0 112.29 -179.536 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.1 tt -96.97 -38.27 9.86 Favored 'General case' 0 C--N 1.32 -0.68 0 O-C-N 125.876 1.985 . . . . 10.0 108.289 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -163.27 136.05 5.45 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 116.724 2.12 . . . . 10.0 116.724 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . 0.464 ' HB2' ' CE ' ' A' ' 10' ' ' MET . 29.6 t30 -134.03 152.42 51.84 Favored 'General case' 0 C--O 1.239 0.538 0 O-C-N 125.888 1.992 . . . . 10.0 107.712 -179.795 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -173.76 170.66 3.93 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 118.612 -0.709 . . . . 10.0 112.372 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 66.95 20.6 10.48 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 127.644 2.377 . . . . 10.0 113.725 179.347 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -67.04 -30.72 70.88 Favored 'General case' 0 CA--C 1.548 0.876 0 CA-C-N 114.62 -1.173 . . . . 10.0 112.418 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -71.24 -42.46 68.82 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-O 122.395 1.093 . . . . 10.0 111.891 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -75.17 -25.14 58.08 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 114.108 -1.406 . . . . 10.0 107.262 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 10.2 t80 -75.5 -43.39 49.36 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 118.335 -0.84 . . . . 10.0 111.016 -179.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 50.6 mt -72.2 -21.84 61.36 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 113.02 0.748 . . . . 10.0 113.02 -179.621 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.4 ttm-85 -74.4 -24.68 59.15 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 114.49 -1.232 . . . . 10.0 108.833 179.809 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.16 -32.53 69.04 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 122.587 1.184 . . . . 10.0 110.607 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 51.5 mt -100.5 -7.92 23.67 Favored 'General case' 0 C--O 1.236 0.379 0 O-C-N 119.669 -1.894 . . . . 10.0 110.668 179.785 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.403 ' OD1' ' N ' ' A' ' 24' ' ' ASP . 0.3 OUTLIER 51.35 62.85 2.5 Favored 'General case' 0 C--O 1.245 0.864 0 O-C-N 124.085 0.865 . . . . 10.0 111.935 179.854 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 20.8 m -94.29 39.71 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 N-CA-C 104.054 -2.572 . . . . 10.0 104.054 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 65.55 154.63 0.08 Allowed 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 115.719 1.748 . . . . 10.0 115.719 -179.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 15.5 m -72.11 -22.07 20.91 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.656 0 N-CA-C 114.886 1.439 . . . . 10.0 114.886 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -73.65 -27.08 61.06 Favored 'General case' 0 C--O 1.234 0.28 0 O-C-N 124.838 1.336 . . . . 10.0 111.468 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.27 -30.56 57.87 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 119.556 -0.858 . . . . 10.0 112.96 179.833 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.72 -22.89 61.56 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-O 124.189 1.947 . . . . 10.0 110.214 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.33 -41.51 33.42 Favored 'General case' 0 N--CA 1.444 -0.728 0 N-CA-C 107.384 -1.339 . . . . 10.0 107.384 -179.733 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.2 mp -72.58 -35.5 51.0 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.512 0 O-C-N 127.315 2.884 . . . . 10.0 110.499 -179.742 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.32 -31.05 43.09 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 113.18 -1.827 . . . . 10.0 113.22 179.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -56.97 -30.57 64.2 Favored 'General case' 0 C--N 1.318 -0.765 0 O-C-N 119.753 -1.842 . . . . 10.0 115.213 179.672 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -110.81 40.59 1.98 Allowed 'General case' 0 C--N 1.322 -0.596 0 O-C-N 124.563 1.164 . . . . 10.0 109.511 179.877 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -117.08 131.56 56.89 Favored 'General case' 0 CA--C 1.515 -0.396 0 C-N-CA 124.386 1.074 . . . . 10.0 109.686 179.952 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -143.97 100.79 4.96 Favored Pre-proline 0 N--CA 1.47 0.546 0 N-CA-C 106.776 -1.564 . . . . 10.0 106.776 179.821 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -98.94 168.47 0.56 Allowed 'Trans proline' 0 N--CA 1.447 -1.247 0 C-N-CA 124.606 3.537 . . . . 10.0 116.458 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.54 ' HB3' ' CE3' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -121.87 -174.29 2.84 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 105.723 -1.955 . . . . 10.0 105.723 -179.725 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.467 ' HB2' ' CE2' ' A' ' 130' ' ' PHE . 2.5 mttt -156.48 105.56 2.27 Favored 'General case' 0 CA--C 1.501 -0.923 0 C-N-CA 118.475 -1.29 . . . . 10.0 112.833 -179.944 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -97.64 107.86 20.45 Favored 'General case' 0 C--N 1.341 0.234 0 N-CA-C 102.682 -3.081 . . . . 10.0 102.682 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 86.0 mt -89.27 141.68 13.95 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.022 0 CA-C-O 118.845 -0.598 . . . . 10.0 110.511 -179.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -134.8 158.97 41.79 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 O-C-N 124.727 1.267 . . . . 10.0 107.677 -179.883 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.472 ' CG ' ' HB3' ' A' ' 48' ' ' HIS . 0.0 OUTLIER -129.41 136.93 50.57 Favored 'General case' 0 C--N 1.323 -0.584 0 O-C-N 125.961 2.038 . . . . 10.0 111.566 -179.653 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -133.8 -143.94 0.22 Allowed 'General case' 0 C--O 1.243 0.739 0 CA-C-O 114.776 -2.535 . . . . 10.0 107.791 -179.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . 0.423 ' O ' ' NE2' ' A' ' 65' ' ' GLN . . . -42.1 138.28 2.59 Favored Glycine 0 CA--C 1.534 1.237 0 N-CA-C 104.587 -3.405 . . . . 10.0 104.587 179.959 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.487 ' CB ' ' HB3' ' A' ' 65' ' ' GLN . 11.3 m-20 59.19 -115.2 0.76 Allowed 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 102.595 -3.113 . . . . 10.0 102.595 -176.82 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . 0.54 ' CD2' ' HB ' ' A' ' 66' ' ' VAL . 0.1 OUTLIER 164.27 85.04 0.0 OUTLIER 'General case' 0 CA--C 1.5 -0.97 0 O-C-N 126.487 2.367 . . . . 10.0 112.611 175.31 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.44 ' HB3' ' HB3' ' A' ' 64' ' ' PHE . 36.4 ttm -169.38 83.07 0.13 Allowed 'General case' 0 N--CA 1.435 -1.22 0 N-CA-C 115.771 1.767 . . . . 10.0 115.771 175.416 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 1.3 mp -117.46 107.22 21.64 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.172 0 N-CA-C 102.208 -3.256 . . . . 10.0 102.208 179.533 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.432 ' N ' ' CD1' ' A' ' 51' ' ' ILE . 0.2 OUTLIER -106.3 108.12 24.35 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.952 0 N-CA-C 109.243 -0.651 . . . . 10.0 109.243 -179.999 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.4 ' HG3' HD12 ' A' ' 61' ' ' ILE . 19.9 ttp180 -101.55 110.24 22.2 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.694 -1.139 . . . . 10.0 113.519 -179.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 20.7 m -97.77 122.93 41.45 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 102.24 -3.244 . . . . 10.0 102.24 -179.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -125.83 61.62 1.25 Allowed 'General case' 0 C--N 1.324 -0.51 1 N-CA-C 121.917 4.043 . . . . 10.0 121.917 -179.795 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.0 m -65.5 -175.94 0.3 Allowed 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 125.908 1.683 . . . . 10.0 107.976 -179.755 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 58.7 p -105.15 -20.93 13.36 Favored 'General case' 0 C--O 1.242 0.69 0 CA-C-O 117.388 -1.291 . . . . 10.0 109.927 179.698 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -73.48 -56.64 4.78 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 122.892 1.329 . . . . 10.0 108.609 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.42 -165.06 1.9 Allowed 'General case' 0 C--O 1.244 0.814 0 CA-C-N 114.183 -1.371 . . . . 10.0 110.089 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -156.84 133.28 9.94 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-O 123.965 1.841 . . . . 10.0 111.849 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -109.9 125.48 52.85 Favored 'General case' 0 CA--C 1.501 -0.929 0 N-CA-C 102.398 -3.186 . . . . 10.0 102.398 179.751 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.4 HD12 ' HG3' ' A' ' 52' ' ' ARG . 1.1 mt -132.73 158.46 43.28 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.706 0 O-C-N 118.237 -2.789 . . . . 10.0 116.102 -179.663 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -141.23 155.23 46.05 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 104.406 -2.442 . . . . 10.0 104.406 -179.911 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -131.67 69.61 1.47 Allowed 'General case' 0 C--N 1.311 -1.066 1 N-CA-C 99.436 -4.283 . . . . 10.0 99.436 179.884 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.44 ' HB3' ' HB3' ' A' ' 49' ' ' MET . 2.2 m-85 -69.78 -172.91 0.55 Allowed 'General case' 0 C--O 1.241 0.657 0 CA-C-N 113.383 -1.735 . . . . 10.0 113.546 179.772 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.487 ' HB3' ' CB ' ' A' ' 47' ' ' ASP . 22.6 mt-30 -171.58 121.32 0.5 Allowed 'General case' 0 C--N 1.317 -0.838 0 C-N-CA 128.001 2.52 . . . . 10.0 107.092 -179.404 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.54 ' HB ' ' CD2' ' A' ' 48' ' ' HIS . 24.8 t -58.89 156.32 2.29 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 C-N-CA 125.961 1.704 . . . . 10.0 113.231 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.453 ' N ' ' CG1' ' A' ' 66' ' ' VAL . . . 63.58 11.26 41.02 Favored Glycine 0 C--O 1.218 -0.889 0 N-CA-C 118.38 2.112 . . . . 10.0 118.38 179.791 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.4 ' HG2' ' CE1' ' A' ' 70' ' ' PHE . 9.0 tttp -124.26 148.63 47.23 Favored 'General case' 0 C--O 1.22 -0.459 0 CA-C-N 118.105 0.953 . . . . 10.0 112.241 179.901 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 53.4 tt0 -91.12 136.58 32.99 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 125.402 1.688 . . . . 10.0 109.076 -179.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.4 ' CE1' ' HG2' ' A' ' 68' ' ' LYS . 6.7 m-85 -122.53 179.02 4.74 Favored 'General case' 0 C--N 1.318 -0.797 0 C-N-CA 124.566 1.146 . . . . 10.0 108.358 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -154.03 67.98 0.75 Allowed 'General case' 0 C--N 1.317 -0.811 0 O-C-N 127.205 2.815 . . . . 10.0 111.198 -179.754 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -51.71 126.7 18.52 Favored 'General case' 0 N--CA 1.442 -0.847 0 N-CA-C 112.355 0.502 . . . . 10.0 112.355 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -70.68 -20.02 62.73 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.785 0.802 . . . . 10.0 110.227 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.481 ' HB2' ' CB ' ' A' ' 79' ' ' ASP . 0.0 OUTLIER -156.75 127.46 6.69 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 116.395 1.998 . . . . 10.0 116.395 -179.959 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.455 ' N ' ' HA ' ' A' ' 79' ' ' ASP . 18.3 m -96.43 123.59 40.14 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-O 124.116 1.913 . . . . 10.0 111.194 -179.591 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 52.48 -133.22 39.05 Favored Glycine 0 N--CA 1.441 -0.994 0 N-CA-C 107.172 -2.371 . . . . 10.0 107.172 179.797 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -107.38 -11.85 10.48 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 N-CA-C 106.843 -1.54 . . . . 10.0 106.843 179.374 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -82.17 -4.97 58.09 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-N 113.67 -1.604 . . . . 10.0 109.262 179.848 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . 0.481 ' CB ' ' HB2' ' A' ' 74' ' ' LEU . 4.0 m-20 39.68 -128.15 0.35 Allowed 'General case' 0 C--N 1.316 -0.88 0 C-N-CA 128.314 2.646 . . . . 10.0 115.953 -179.596 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 16.9 ttt85 84.8 114.37 0.05 Allowed 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 120.481 1.491 . . . . 10.0 107.231 -179.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 5.4 mmtp -57.19 141.84 44.96 Favored 'General case' 0 C--N 1.316 -0.873 0 O-C-N 127.156 2.785 . . . . 10.0 105.583 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 72.8 m -152.12 149.66 29.04 Favored 'General case' 0 C--O 1.213 -0.86 0 O-C-N 125.412 1.695 . . . . 10.0 109.601 -179.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.6 mtm -100.69 114.54 28.36 Favored 'General case' 0 C--O 1.241 0.617 1 N-CA-C 100.163 -4.014 . . . . 10.0 100.163 179.869 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 98.8 m -112.12 135.53 52.66 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 115.844 1.794 . . . . 10.0 115.844 179.734 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -131.3 145.22 51.79 Favored 'General case' 0 C--N 1.343 0.287 0 N-CA-C 108.134 -1.061 . . . . 10.0 108.134 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 1.2 t -113.23 172.88 3.1 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.986 0 N-CA-C 104.02 -2.585 . . . . 10.0 104.02 179.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -169.49 169.11 9.05 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 120.526 1.512 . . . . 10.0 113.96 179.783 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -106.81 122.62 46.76 Favored 'General case' 0 C--O 1.224 -0.24 0 O-C-N 125.844 1.965 . . . . 10.0 106.905 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.419 ' HB3' ' HB2' ' A' ' 92' ' ' LYS . 24.5 t0 -107.69 3.89 25.15 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 101.381 -3.563 . . . . 10.0 101.381 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 111.47 -96.46 0.88 Allowed Glycine 0 C--O 1.24 0.51 0 N-CA-C 104.066 -3.614 . . . . 10.0 104.066 -179.719 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 8.9 p30 -84.83 -35.78 22.06 Favored 'General case' 0 C--O 1.222 -0.373 0 C-N-CA 119.641 -0.824 . . . . 10.0 109.657 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.419 ' HB2' ' HB3' ' A' ' 89' ' ' ASP . 1.6 mtmm -82.17 142.6 32.07 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 124.009 0.924 . . . . 10.0 111.843 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.418 HD21 ' HE1' ' A' ' 49' ' ' MET . 9.8 tp -119.22 100.72 7.5 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 104.254 -2.499 . . . . 10.0 104.254 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -123.92 168.07 13.28 Favored 'General case' 0 CA--C 1.497 -1.073 0 N-CA-C 114.985 1.476 . . . . 10.0 114.985 179.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 19.9 p -131.67 -173.03 3.01 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-N 113.547 -1.66 . . . . 10.0 110.026 179.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 7.0 t -134.76 -74.08 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.744 0 C-N-CA 125.062 1.345 . . . . 10.0 109.475 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 87.78 118.45 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.569 0 O-C-N 127.273 2.858 . . . . 10.0 110.423 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.8 mmtt -88.96 114.2 25.32 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 125.386 1.474 . . . . 10.0 114.247 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . 0.483 ' N ' HH22 ' A' ' 104' ' ' ARG . . . -153.32 -160.05 9.47 Favored Glycine 0 CA--C 1.523 0.573 0 N-CA-C 108.753 -1.739 . . . . 10.0 108.753 -179.911 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 14.4 tm-20 -86.63 -14.51 42.5 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 116.645 2.091 . . . . 10.0 116.645 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 15.3 mmtt -81.78 178.44 8.32 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 113.273 0.842 . . . . 10.0 113.273 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 3.7 pm0 -121.71 28.89 7.42 Favored 'General case' 0 CA--C 1.509 -0.6 0 C-N-CA 125.933 1.693 . . . . 10.0 110.517 179.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -159.19 -18.4 0.03 OUTLIER Glycine 0 N--CA 1.462 0.383 0 CA-C-O 116.554 -2.248 . . . . 10.0 118.481 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.483 HH22 ' N ' ' A' ' 99' ' ' GLY . 24.0 mtm-85 -47.4 144.82 2.75 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 120.209 2.004 . . . . 10.0 109.017 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 129.65 152.11 7.47 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 107.592 -2.203 . . . . 10.0 107.592 -179.786 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -124.95 -170.97 2.26 Favored 'General case' 0 C--O 1.239 0.531 0 C-N-CA 125.223 1.409 . . . . 10.0 109.916 179.713 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 3.1 m -161.39 117.75 2.18 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-O 117.307 -1.33 . . . . 10.0 109.55 179.724 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 -93.45 128.17 39.42 Favored 'General case' 0 C--N 1.318 -0.772 0 O-C-N 126.796 2.56 . . . . 10.0 107.287 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 4.5 t90 -139.55 101.47 4.23 Favored 'General case' 0 CA--C 1.511 -0.521 0 O-C-N 120.505 -1.372 . . . . 10.0 112.271 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.429 HD13 ' CE2' ' A' ' 4' ' ' PHE . 72.2 mt -85.64 119.4 34.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 O-C-N 126.405 2.316 . . . . 10.0 114.069 179.689 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -132.25 148.09 52.44 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 104.301 -2.481 . . . . 10.0 104.301 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 26.73 -103.16 0.01 OUTLIER Glycine 0 N--CA 1.445 -0.737 0 O-C-N 128.161 3.413 . . . . 10.0 111.926 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -116.05 24.77 11.19 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 125.766 1.509 . . . . 10.0 112.251 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -139.99 163.19 33.33 Favored 'General case' 0 CA--C 1.501 -0.912 0 CA-C-O 123.502 1.62 . . . . 10.0 114.13 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 4.5 mt -124.6 108.78 12.42 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 104.781 -2.303 . . . . 10.0 104.781 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -94.85 73.95 3.57 Favored 'General case' 0 C--N 1.313 -1.006 0 C-N-CA 119.332 -0.947 . . . . 10.0 109.33 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 8.9 tt -66.89 153.68 42.88 Favored 'General case' 0 N--CA 1.45 -0.456 0 O-C-N 126.355 2.285 . . . . 10.0 112.71 179.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -141.51 138.49 32.81 Favored 'General case' 0 C--O 1.214 -0.807 0 O-C-N 125.037 1.461 . . . . 10.0 109.986 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -136.21 121.44 19.12 Favored 'General case' 0 C--N 1.322 -0.596 0 O-C-N 124.738 1.274 . . . . 10.0 111.013 179.781 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -123.19 152.99 40.69 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 114.842 -1.072 . . . . 10.0 111.161 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -165.07 130.38 2.62 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 104.829 -2.286 . . . . 10.0 104.829 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 47.22 30.27 1.4 Allowed 'General case' 0 C--N 1.321 -0.672 0 O-C-N 125.345 1.653 . . . . 10.0 111.977 -179.884 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 86.58 -8.41 75.21 Favored Glycine 0 CA--C 1.535 1.335 0 C-N-CA 119.604 -1.284 . . . . 10.0 114.497 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 22.1 t -86.08 124.24 40.12 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 CA-C-N 118.723 1.262 . . . . 10.0 108.517 -179.787 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 5.4 m -103.42 120.6 41.14 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-O 123.943 1.83 . . . . 10.0 114.39 -179.813 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -124.92 129.4 50.29 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 112.443 -2.162 . . . . 10.0 105.272 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -115.46 173.77 6.35 Favored 'General case' 0 C--O 1.24 0.597 0 N-CA-C 115.319 1.6 . . . . 10.0 115.319 179.784 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -151.87 88.71 1.41 Allowed 'General case' 0 CA--C 1.512 -0.519 0 CA-C-N 113.012 -1.904 . . . . 10.0 110.3 179.832 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 38.5 t -70.17 119.13 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 N-CA-C 104.874 -2.269 . . . . 10.0 104.874 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . 0.467 ' CE2' ' HB2' ' A' ' 40' ' ' LYS . 0.3 OUTLIER -101.03 174.86 5.81 Favored 'General case' 0 C--O 1.218 -0.562 0 CA-C-O 123.687 1.708 . . . . 10.0 108.94 179.758 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 2.3 tptm -143.22 88.88 2.05 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 113.578 -1.646 . . . . 10.0 106.616 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 22.9 ttpt -65.08 98.0 0.28 Allowed 'General case' 0 CA--C 1.504 -0.796 0 C-N-CA 118.008 -1.477 . . . . 10.0 107.709 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' VAL . . . . . 0.447 ' CG1' ' N ' ' A' ' 134' ' ' HIS . 7.1 p -53.66 -37.25 31.0 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.353 0 CA-C-N 114.417 -1.265 . . . . 10.0 110.209 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' HIS . . . . . 0.447 ' N ' ' CG1' ' A' ' 133' ' ' VAL . 1.9 t-160 . . . . . 0 N--CA 1.438 -1.064 0 O-C-N 126.049 2.093 . . . . 10.0 111.511 -179.981 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.217 -0.611 0 CA-C-O 118.0 -1.0 . . . . 10.0 111.751 . . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.412 ' CE2' ' CD1' ' A' ' 93' ' ' LEU . 19.8 m-30 -90.11 -9.67 47.49 Favored 'General case' 0 C--N 1.319 -0.74 0 O-C-N 127.881 3.238 . . . . 10.0 116.326 -179.906 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 71.8 m-20 -43.57 143.8 0.9 Allowed 'General case' 0 N--CA 1.471 0.619 0 O-C-N 127.253 2.845 . . . . 10.0 111.905 179.97 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . 0.435 ' HA2' ' HA ' ' A' ' 134' ' ' HIS . . . -146.58 -177.49 21.23 Favored Glycine 0 C--N 1.346 1.12 0 N-CA-C 119.669 2.628 . . . . 10.0 119.669 -179.569 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -151.48 46.44 0.8 Allowed 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 103.839 -2.652 . . . . 10.0 103.839 -179.582 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.618 ' CZ3' ' CB ' ' A' ' 39' ' ' ASP 0.397 30.2 p-90 -37.61 169.61 0.0 OUTLIER 'General case' 0 C--O 1.211 -0.931 0 C-N-CA 127.19 2.196 . . . . 10.0 115.272 179.331 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.455 ' HE3' ' HB2' ' A' ' 132' ' ' LYS . 0.0 OUTLIER -157.55 150.49 23.26 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 111.633 -2.531 . . . . 10.0 104.473 174.976 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.3 ppp? -106.4 168.37 9.2 Favored 'General case' 0 C--O 1.24 0.561 0 O-C-N 119.834 -1.791 . . . . 10.0 112.67 -179.777 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -137.3 -59.9 0.68 Allowed 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 105.719 -1.956 . . . . 10.0 105.719 -179.902 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 61.8 p -161.85 173.68 14.21 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 124.689 2.185 . . . . 10.0 112.623 179.771 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . 0.42 ' OD1' ' N ' ' A' ' 13' ' ' ASN . 3.1 p-10 -126.16 161.35 27.87 Favored 'General case' 0 CA--C 1.513 -0.481 0 CA-C-N 112.67 -2.059 . . . . 10.0 108.088 -179.597 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 35.9 tp10 -149.0 134.8 18.86 Favored 'General case' 0 C--O 1.215 -0.722 0 O-C-N 119.539 -1.975 . . . . 10.0 113.519 179.676 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 61.25 27.84 17.49 Favored 'General case' 0 C--O 1.244 0.78 0 C-N-CA 125.015 1.326 . . . . 10.0 111.846 -179.958 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.526 ' CD2' HD13 ' A' ' 20' ' ' LEU . 40.2 t80 -69.16 -27.62 65.69 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 114.797 1.406 . . . . 10.0 114.797 -179.399 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -76.61 -29.07 56.37 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 120.205 -1.559 . . . . 10.0 112.778 179.916 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -79.37 -28.18 41.94 Favored 'General case' 0 C--O 1.219 -0.505 0 CA-C-N 114.512 -1.222 . . . . 10.0 109.445 -179.948 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.502 ' CE1' HD13 ' A' ' 23' ' ' LEU . 0.2 OUTLIER -65.9 -43.67 87.55 Favored 'General case' 0 CA--C 1.555 1.172 0 O-C-N 125.489 1.743 . . . . 10.0 108.978 -179.998 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.526 HD13 ' CD2' ' A' ' 16' ' ' PHE . 0.7 OUTLIER -76.82 -23.22 52.8 Favored 'General case' 0 C--O 1.22 -0.462 0 O-C-N 126.146 2.154 . . . . 10.0 112.609 179.707 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.89 -26.01 40.39 Favored 'General case' 0 C--N 1.321 -0.662 0 O-C-N 126.224 2.202 . . . . 10.0 108.816 179.531 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.89 -27.64 64.97 Favored 'General case' 0 C--O 1.218 -0.57 0 C-N-CA 125.976 1.711 . . . . 10.0 112.984 179.781 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.502 HD13 ' CE1' ' A' ' 19' ' ' TYR . 0.0 OUTLIER -113.27 9.64 18.37 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 114.197 -1.365 . . . . 10.0 109.886 179.567 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 38.41 72.19 0.14 Allowed 'General case' 0 C--N 1.322 -0.6 0 O-C-N 126.697 2.498 . . . . 10.0 114.957 179.466 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 3.8 m -88.78 170.05 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-O 117.027 -1.463 . . . . 10.0 108.841 -179.661 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 9.0 m120 -53.98 152.63 5.58 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 117.913 -1.042 . . . . 10.0 111.502 179.48 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 2.5 p -71.6 -23.1 22.29 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.855 0 N-CA-C 117.284 2.327 . . . . 10.0 117.284 -179.632 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -79.82 -32.04 40.67 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 114.43 -1.259 . . . . 10.0 109.919 -179.806 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 54.3 tp -70.75 -44.72 66.18 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 114.64 1.348 . . . . 10.0 114.64 -179.732 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.468 ' HG3' ' CD1' ' A' ' 20' ' ' LEU . 18.4 ttp180 -56.86 -36.72 70.37 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 126.254 1.822 . . . . 10.0 114.377 179.813 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.87 -32.66 61.93 Favored 'General case' 0 C--O 1.218 -0.585 0 O-C-N 126.274 2.234 . . . . 10.0 110.588 179.806 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 20.7 mm -77.41 -41.04 29.52 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.453 0 O-C-N 125.489 1.743 . . . . 10.0 109.261 -179.739 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -80.35 -6.25 57.69 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.785 -0.643 . . . . 10.0 112.399 179.828 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -93.46 -30.42 15.06 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 115.294 1.59 . . . . 10.0 115.294 -179.785 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.423 HD11 ' N ' ' A' ' 36' ' ' LEU . 0.3 OUTLIER -92.33 -14.06 29.32 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 120.017 1.281 . . . . 10.0 110.456 179.893 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.423 ' N ' HD11 ' A' ' 35' ' ' LEU . 0.0 OUTLIER -80.42 118.26 21.89 Favored 'General case' 0 CA--C 1.514 -0.423 0 C-N-CA 125.677 1.591 . . . . 10.0 109.468 -179.735 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.7 135.75 19.7 Favored Pre-proline 0 C--N 1.318 -0.783 0 N-CA-C 106.495 -1.668 . . . . 10.0 106.495 -179.975 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_exo -90.7 179.18 1.83 Allowed 'Trans proline' 0 N--CA 1.447 -1.258 0 C-N-CA 124.268 3.312 . . . . 10.0 119.545 -179.443 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.618 ' CB ' ' CZ3' ' A' ' 8' ' ' TRP . 0.3 OUTLIER -149.39 143.84 26.0 Favored 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 127.636 2.375 . . . . 10.0 104.724 179.72 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.573 ' C ' ' CD1' ' A' ' 8' ' ' TRP . 1.2 tptt -97.56 -143.22 0.3 Allowed 'General case' 0 C--N 1.305 -1.335 0 CA-C-O 114.672 -2.585 . . . . 10.0 106.905 -179.42 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.452 ' N ' ' CD1' ' A' ' 8' ' ' TRP . 0.2 OUTLIER 152.92 117.32 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.938 0 O-C-N 127.728 3.143 . . . . 10.0 102.77 178.586 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 6.3 mm -121.86 145.76 28.01 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.981 0 O-C-N 124.701 1.251 . . . . 10.0 113.602 179.451 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 67.0 t -147.48 100.36 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 O-C-N 125.911 2.007 . . . . 10.0 106.35 179.898 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -112.01 116.91 31.33 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 124.668 1.187 . . . . 10.0 108.665 179.862 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -118.86 125.73 50.18 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 104.799 -2.297 . . . . 10.0 104.799 -179.942 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 61.32 -115.29 7.68 Favored Glycine 0 C--O 1.223 -0.532 0 N-CA-C 108.951 -1.66 . . . . 10.0 108.951 -179.723 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -112.58 -20.84 11.57 Favored 'General case' 0 C--N 1.321 -0.652 0 O-C-N 121.693 -0.887 . . . . 10.0 110.609 -179.854 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 46.1 m170 -82.45 119.08 23.74 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 107.802 -1.184 . . . . 10.0 107.802 -179.954 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 17.5 ttp -104.21 155.18 18.95 Favored 'General case' 0 C--N 1.32 -0.684 0 O-C-N 126.664 2.478 . . . . 10.0 114.454 179.961 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 4.8 mt -145.7 122.8 4.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 106.419 -1.697 . . . . 10.0 106.419 -179.937 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.5 mp -119.23 131.41 72.0 Favored 'Isoleucine or valine' 0 C--O 1.242 0.699 0 N-CA-C 104.683 -2.34 . . . . 10.0 104.683 179.823 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.84 98.66 6.01 Favored 'General case' 0 N--CA 1.442 -0.872 0 CA-C-N 114.971 -1.013 . . . . 10.0 111.571 -179.76 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 89.2 m -72.33 139.88 48.2 Favored 'General case' 0 C--O 1.219 -0.538 0 N-CA-C 101.784 -3.413 . . . . 10.0 101.784 179.983 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.2 mt -113.11 54.74 0.72 Allowed 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 119.902 3.297 . . . . 10.0 119.902 -179.886 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 64.8 m -93.38 131.01 38.95 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 104.04 -2.578 . . . . 10.0 104.04 -179.757 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -69.51 -13.34 62.29 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 123.236 1.493 . . . . 10.0 107.727 -179.848 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -95.22 84.17 4.02 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 106.799 -1.556 . . . . 10.0 106.799 179.954 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . 0.419 ' CZ ' ' HB3' ' A' ' 58' ' ' ARG . 0.0 OUTLIER 50.95 80.11 0.08 Allowed 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 114.471 1.286 . . . . 10.0 114.471 -179.822 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . 0.401 ' OD1' ' N ' ' A' ' 59' ' ' ASN . 4.8 p-10 -71.94 90.62 1.15 Allowed 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 113.747 -1.57 . . . . 10.0 112.206 179.787 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 25.6 p90 -75.32 130.1 38.5 Favored 'General case' 0 C--N 1.321 -0.648 0 O-C-N 126.638 2.461 . . . . 10.0 105.483 -179.854 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 6.2 mm -104.34 164.28 3.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 O-C-N 121.409 -0.807 . . . . 10.0 111.277 -179.716 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 27.7 mmm -144.78 150.98 38.13 Favored 'General case' 0 N--CA 1.442 -0.827 0 N-CA-C 107.291 -1.374 . . . . 10.0 107.291 179.992 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -133.52 88.5 2.49 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 103.684 -2.71 . . . . 10.0 103.684 179.953 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -76.34 178.47 6.49 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 119.619 -1.926 . . . . 10.0 114.474 179.961 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 10.5 mt-30 -147.35 113.98 6.03 Favored 'General case' 0 C--N 1.315 -0.893 0 O-C-N 128.764 3.79 . . . . 10.0 103.187 -179.86 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -62.05 137.52 23.88 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 O-C-N 124.38 1.05 . . . . 10.0 113.721 -179.846 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.99 -25.16 0.67 Allowed Glycine 0 C--O 1.218 -0.869 0 CA-C-O 117.025 -1.986 . . . . 10.0 116.281 179.804 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 15.2 mttp -91.78 160.33 15.38 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 120.492 2.146 . . . . 10.0 116.7 -179.777 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -69.05 158.74 34.2 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 107.947 -1.131 . . . . 10.0 107.947 -179.955 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 45.9 t80 -165.95 113.11 0.91 Allowed 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 113.994 -1.457 . . . . 10.0 113.24 -179.583 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -79.73 145.84 32.7 Favored 'General case' 0 C--N 1.314 -0.955 0 O-C-N 125.181 1.551 . . . . 10.0 107.525 -179.79 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 13.8 tt0 -107.1 -42.24 4.93 Favored 'General case' 0 C--O 1.24 0.591 0 N-CA-C 117.193 2.294 . . . . 10.0 117.193 -179.922 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 6.3 t70 53.08 35.95 20.97 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.467 0.651 . . . . 10.0 110.695 179.777 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -46.28 117.54 1.61 Allowed 'General case' 0 C--N 1.32 -0.708 0 O-C-N 120.555 -1.341 . . . . 10.0 114.167 179.894 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -129.32 8.24 5.48 Favored 'General case' 0 CA--C 1.514 -0.418 0 O-C-N 121.61 -0.681 . . . . 10.0 109.909 179.956 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -78.94 -43.54 10.95 Favored Glycine 0 CA--C 1.5 -0.902 0 CA-C-O 117.505 -1.719 . . . . 10.0 110.453 -179.749 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.7 pp -142.44 142.2 27.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 CA-C-N 118.775 1.287 . . . . 10.0 107.917 179.848 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 75.34 -59.02 0.55 Allowed 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.639 0.733 . . . . 10.0 111.632 179.709 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 87.06 82.77 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 115.44 1.645 . . . . 10.0 115.44 179.926 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 3.4 ptt85 -155.32 143.29 19.99 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 113.985 -1.462 . . . . 10.0 111.026 179.767 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 4.3 ptpp? -95.21 175.81 6.46 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 103.731 -2.692 . . . . 10.0 103.731 179.894 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 6.0 p -177.84 158.72 1.32 Allowed 'General case' 0 C--O 1.213 -0.82 0 N-CA-C 106.344 -1.725 . . . . 10.0 106.344 179.824 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.6 ttm -105.57 117.83 35.01 Favored 'General case' 0 C--N 1.329 -0.323 1 N-CA-C 98.683 -4.562 . . . . 10.0 98.683 179.998 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 43.0 m -121.24 124.09 43.81 Favored 'General case' 0 C--O 1.215 -0.745 0 CA-C-N 112.068 -2.333 . . . . 10.0 117.113 -179.743 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.53 121.52 36.73 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 114.397 -1.274 . . . . 10.0 108.065 179.919 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 13.8 t -98.01 104.89 16.49 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.875 0 N-CA-C 105.488 -2.041 . . . . 10.0 105.488 -179.819 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -110.59 -178.65 3.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 122.238 1.018 . . . . 10.0 113.358 179.956 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 19.0 m0 -111.91 134.24 53.6 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 112.883 -1.962 . . . . 10.0 107.446 179.75 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -102.95 -58.94 1.79 Allowed 'General case' 0 C--O 1.246 0.892 0 N-CA-C 102.879 -3.008 . . . . 10.0 102.879 179.954 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 157.73 90.01 0.07 OUTLIER Glycine 0 CA--C 1.504 -0.614 0 N-CA-C 105.96 -2.856 . . . . 10.0 105.96 179.819 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 65.9 47.0 2.12 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 108.084 -1.08 . . . . 10.0 108.084 -179.904 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 25.6 mtmt -169.37 124.63 0.85 Allowed 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 125.51 1.524 . . . . 10.0 108.724 -179.991 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.412 ' CD1' ' CE2' ' A' ' 4' ' ' PHE . 0.3 OUTLIER -82.71 77.56 9.45 Favored 'General case' 0 CA--C 1.515 -0.394 0 O-C-N 126.451 2.344 . . . . 10.0 107.576 179.934 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.59 105.88 7.91 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 114.561 -1.199 . . . . 10.0 112.487 -179.982 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -108.45 138.48 44.68 Favored 'General case' 0 C--N 1.341 0.23 0 O-C-N 125.129 1.518 . . . . 10.0 112.598 -179.912 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 40.9 t -125.57 131.93 71.52 Favored 'Isoleucine or valine' 0 C--O 1.242 0.67 0 CA-C-O 124.457 2.075 . . . . 10.0 109.367 179.711 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.452 ' CG ' ' HA2' ' A' ' 105' ' ' GLY . 0.0 OUTLIER -134.95 141.2 46.21 Favored 'General case' 0 C--O 1.242 0.678 0 O-C-N 120.231 -1.543 . . . . 10.0 107.159 179.876 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 9.9 pttp -149.33 110.89 4.49 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 122.586 1.184 . . . . 10.0 111.08 179.988 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -163.37 74.49 0.18 Allowed Glycine 0 C--O 1.221 -0.691 0 O-C-N 119.653 -1.904 . . . . 10.0 112.135 -179.958 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 94.6 23.33 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.579 0 O-C-N 127.458 2.505 . . . . 10.0 115.024 179.791 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.468 ' CE ' ' HA ' ' A' ' 101' ' ' LYS . 0.0 OUTLIER -139.33 -155.49 0.6 Allowed 'General case' 0 N--CA 1.471 0.585 0 O-C-N 126.379 2.3 . . . . 10.0 110.982 -179.948 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -136.77 -57.24 0.73 Allowed 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 125.309 1.443 . . . . 10.0 113.564 -179.979 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -109.31 42.5 1.94 Allowed Glycine 0 N--CA 1.449 -0.436 0 N-CA-C 119.333 2.493 . . . . 10.0 119.333 -179.808 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 3.1 mtm180 -88.18 168.02 13.11 Favored 'General case' 0 C--O 1.244 0.805 0 O-C-N 120.71 -1.465 . . . . 10.0 110.805 -179.961 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . 0.452 ' HA2' ' CG ' ' A' ' 97' ' ' GLN . . . 120.96 139.02 5.63 Favored Glycine 0 N--CA 1.45 -0.426 0 N-CA-C 108.638 -1.785 . . . . 10.0 108.638 -179.819 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 106' ' ' TRP . . . . . 0.48 ' CD1' ' CG ' ' A' ' 119' ' ' MET . 3.1 m0 -104.93 176.5 5.14 Favored 'General case' 0 C--N 1.316 -0.87 0 O-C-N 119.959 -1.906 . . . . 10.0 109.096 -179.754 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 4.5 m -140.62 120.31 13.38 Favored 'General case' 0 C--O 1.222 -0.347 0 O-C-N 126.69 2.493 . . . . 10.0 107.074 179.915 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -108.65 133.31 52.93 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 114.342 -1.299 . . . . 10.0 109.676 -179.979 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 2.0 t90 -138.8 113.27 8.9 Favored 'General case' 0 CA--C 1.502 -0.882 0 O-C-N 125.783 1.927 . . . . 10.0 109.19 179.645 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -82.97 128.51 38.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 121.994 0.902 . . . . 10.0 111.651 -179.981 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -127.05 88.16 2.77 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 122.883 1.325 . . . . 10.0 108.044 179.991 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 53.27 -103.6 0.15 Allowed Glycine 0 C--N 1.346 1.134 0 O-C-N 119.21 -2.181 . . . . 10.0 111.16 -179.79 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . 0.407 ' N ' ' OD1' ' A' ' 113' ' ' ASP . 0.5 OUTLIER -102.17 28.88 5.47 Favored 'General case' 0 N--CA 1.463 0.199 0 C-N-CA 124.378 1.071 . . . . 10.0 113.692 -179.967 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -146.12 145.21 30.43 Favored 'General case' 0 C--N 1.321 -0.669 0 O-C-N 119.73 -1.856 . . . . 10.0 109.68 179.989 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.495 ' HG ' ' CG1' ' A' ' 133' ' ' VAL . 0.1 OUTLIER -107.75 133.96 51.39 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 104.593 -2.373 . . . . 10.0 104.593 -179.559 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -120.72 95.78 4.85 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 106.022 -1.844 . . . . 10.0 106.022 -179.969 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 5.0 tp -101.29 134.0 45.01 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 113.811 -1.54 . . . . 10.0 108.907 179.929 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -133.61 100.83 4.91 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 105.059 -2.2 . . . . 10.0 105.059 179.685 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.48 ' CG ' ' CD1' ' A' ' 106' ' ' TRP . 2.2 ttm -96.39 139.4 32.57 Favored 'General case' 0 CA--C 1.504 -0.821 0 O-C-N 126.449 2.343 . . . . 10.0 113.435 -179.907 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 3.2 ptt180 -131.27 177.92 7.1 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 114.004 1.113 . . . . 10.0 114.004 -179.998 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 174.19 132.07 0.03 OUTLIER 'General case' 0 C--N 1.319 -0.755 0 O-C-N 124.526 1.142 . . . . 10.0 108.908 179.647 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 44.97 51.82 8.52 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 116.272 1.953 . . . . 10.0 116.272 -179.918 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 66.19 24.12 71.79 Favored Glycine 0 CA--C 1.534 1.243 0 CA-C-N 114.316 -1.311 . . . . 10.0 114.854 -179.77 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 1.6 t -136.86 118.85 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 CA-C-O 123.796 1.76 . . . . 10.0 107.326 179.962 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 18.7 m -94.55 159.05 15.26 Favored 'General case' 0 C--N 1.314 -0.937 0 C-N-CA 125.507 1.523 . . . . 10.0 110.575 -179.977 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -149.52 153.64 37.52 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 127.829 3.206 . . . . 10.0 105.218 -179.816 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 25.3 mttp -151.5 123.44 8.1 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 113.719 1.007 . . . . 10.0 113.719 179.728 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . 0.408 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 3.0 tt0 -109.89 118.72 37.23 Favored 'General case' 0 C--N 1.319 -0.747 0 O-C-N 126.658 2.474 . . . . 10.0 109.432 -179.866 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 90.7 t -83.3 118.75 31.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 119.218 -0.993 . . . . 10.0 110.635 -179.741 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . 0.436 ' HB3' ' HB2' ' A' ' 115' ' ' LEU . 0.4 OUTLIER -103.3 133.3 48.59 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 114.147 -1.388 . . . . 10.0 109.095 -179.915 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.15 130.68 55.5 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 105.076 -2.194 . . . . 10.0 105.076 179.577 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . 0.455 ' HB2' ' HE3' ' A' ' 9' ' ' LYS . 25.7 tptt 74.84 161.18 0.24 Allowed 'General case' 0 C--O 1.211 -0.923 0 CA-C-O 116.743 -1.599 . . . . 10.0 107.03 -178.766 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 133' ' ' VAL . . . . . 0.495 ' CG1' ' HG ' ' A' ' 115' ' ' LEU . 7.6 p 146.25 57.77 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.31 -1.113 1 O-C-N 130.125 4.641 . . . . 10.0 109.298 -179.529 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 134' ' ' HIS . . . . . 0.435 ' HA ' ' HA2' ' A' ' 6' ' ' GLY . 8.2 t60 . . . . . 0 C--N 1.314 -0.966 1 O-C-N 129.245 4.091 . . . . 10.0 108.989 179.825 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.2 t0 . . . . . 0 C--O 1.218 -0.556 0 CA-C-O 123.432 1.586 . . . . 10.0 111.765 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 55.7 m-85 -78.22 -43.57 28.04 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 116.428 2.01 . . . . 10.0 116.428 -179.952 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 10.1 m-20 -43.23 125.18 3.63 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-O 116.954 -1.498 . . . . 10.0 114.796 179.798 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 160.58 -99.25 0.18 Allowed Glycine 0 CA--C 1.531 1.083 0 O-C-N 125.5 1.75 . . . . 10.0 116.899 179.96 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -175.04 128.69 0.29 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 101.579 -3.489 . . . . 10.0 101.579 -179.823 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.537 ' CZ3' ' HB2' ' A' ' 132' ' ' LYS . 82.0 m95 -127.16 114.1 17.25 Favored 'General case' 0 C--N 1.322 -0.608 0 O-C-N 126.78 2.55 . . . . 10.0 111.824 179.727 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.1 175.33 7.78 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 107.306 -1.368 . . . . 10.0 107.306 179.81 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -114.9 149.34 37.35 Favored 'General case' 0 C--O 1.241 0.606 0 N-CA-C 116.306 1.965 . . . . 10.0 116.306 -179.893 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.1 tt -114.84 -0.74 13.39 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 114.212 -1.358 . . . . 10.0 109.582 -179.88 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.1 t 173.83 156.32 0.12 Allowed 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 117.287 2.329 . . . . 10.0 117.287 -179.389 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -146.78 122.31 10.41 Favored 'General case' 0 C--N 1.322 -0.624 0 O-C-N 126.158 2.161 . . . . 10.0 105.289 -179.883 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.2 tt0 -135.81 144.01 45.48 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 115.991 1.849 . . . . 10.0 115.991 179.489 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 62.0 29.36 17.69 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 125.036 1.46 . . . . 10.0 111.799 179.832 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.467 ' CZ ' ' HA ' ' A' ' 34' ' ' ASN . 1.7 p90 -76.18 -26.26 56.01 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-O 118.527 -0.749 . . . . 10.0 112.281 179.892 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.42 ' HG3' ' CE1' ' A' ' 16' ' ' PHE . 5.0 mt-10 -71.25 -32.14 68.39 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 122.848 1.308 . . . . 10.0 111.968 179.932 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -78.91 -29.18 44.09 Favored 'General case' 0 C--O 1.215 -0.74 0 CA-C-N 113.37 -1.741 . . . . 10.0 108.103 -179.832 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.92 -35.81 81.65 Favored 'General case' 0 C--O 1.247 0.956 0 O-C-N 124.213 0.946 . . . . 10.0 110.12 -179.934 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.402 HD23 HG13 ' A' ' 25' ' ' VAL . 4.2 mt -77.02 -33.47 57.44 Favored 'General case' 0 C--O 1.22 -0.48 0 CA-C-O 121.692 0.758 . . . . 10.0 109.598 -179.858 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.31 -23.93 60.33 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 107.672 -1.233 . . . . 10.0 107.672 -179.877 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.14 -34.69 66.23 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 126.016 2.073 . . . . 10.0 111.968 -179.699 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -119.28 7.81 11.33 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 119.23 0.923 . . . . 10.0 113.439 179.883 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 t0 55.53 78.16 0.2 Allowed 'General case' 0 N--CA 1.475 0.808 0 O-C-N 124.92 1.387 . . . . 10.0 112.34 -179.831 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.449 HG21 ' CD2' ' A' ' 29' ' ' LEU . 2.9 p -118.74 54.29 0.25 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.506 0 CA-C-O 124.057 1.884 . . . . 10.0 107.464 179.737 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.432 ' ND2' ' N ' ' A' ' 26' ' ' ASN . 0.0 OUTLIER 60.14 146.08 0.01 OUTLIER 'General case' 0 C--O 1.225 -0.185 0 N-CA-C 118.655 2.835 . . . . 10.0 118.655 179.328 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 33.7 m -76.04 -30.77 20.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 113.417 -1.719 . . . . 10.0 113.237 179.892 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.27 -28.64 67.38 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 119.885 -1.759 . . . . 10.0 111.576 179.861 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.449 ' CD2' HG21 ' A' ' 25' ' ' VAL . 7.8 tp -77.87 -32.74 52.13 Favored 'General case' 0 N--CA 1.447 -0.595 0 O-C-N 123.847 0.717 . . . . 10.0 112.486 179.83 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 15.8 ttp85 -64.54 -32.87 74.7 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 124.446 2.07 . . . . 10.0 113.065 179.825 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -74.16 -41.16 61.96 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 113.794 -1.548 . . . . 10.0 111.058 -179.829 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 4.8 mm -74.89 -49.27 29.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 C-N-CA 125.136 1.375 . . . . 10.0 111.488 179.709 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -58.18 -40.51 81.68 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 117.643 -1.17 . . . . 10.0 112.746 -179.906 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.467 ' HA ' ' CZ ' ' A' ' 16' ' ' PHE . 0.1 OUTLIER -52.37 -29.88 26.1 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 120.41 1.459 . . . . 10.0 111.993 -179.486 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -109.0 23.99 13.76 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 119.481 1.037 . . . . 10.0 109.703 -179.777 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 2.3 tt -123.76 132.66 53.85 Favored 'General case' 0 CA--C 1.522 -0.122 0 O-C-N 125.21 1.568 . . . . 10.0 108.925 179.93 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 4.4 mmtp -119.66 106.02 42.62 Favored Pre-proline 0 N--CA 1.477 0.895 0 N-CA-C 104.644 -2.354 . . . . 10.0 104.644 179.66 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -66.6 -145.84 0.02 OUTLIER 'Trans proline' 0 C--N 1.356 0.95 0 C-N-CA 123.962 3.108 . . . . 10.0 117.522 -179.84 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 179.68 113.27 0.04 OUTLIER 'General case' 0 C--O 1.238 0.455 0 N-CA-C 106.236 -1.765 . . . . 10.0 106.236 -179.797 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.6 mmtp -80.08 168.56 18.99 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 117.401 -1.285 . . . . 10.0 111.825 -179.879 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -164.63 149.94 9.98 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 104.796 -2.298 . . . . 10.0 104.796 179.912 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 3.6 mm -133.69 154.58 38.79 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.632 0 N-CA-C 113.343 0.868 . . . . 10.0 113.343 -179.684 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.42 ' CG2' ' HD3' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -148.02 129.66 6.15 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 N-CA-C 105.7 -1.963 . . . . 10.0 105.7 179.576 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.459 ' HG2' ' HA ' ' A' ' 48' ' ' HIS . 0.8 OUTLIER -109.71 122.85 48.42 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-O 122.863 1.316 . . . . 10.0 111.029 -179.93 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -166.04 146.68 6.56 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 116.055 -1.926 . . . . 10.0 108.493 -179.941 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 74.19 -109.54 2.82 Favored Glycine 0 CA--C 1.537 1.417 0 O-C-N 126.119 2.137 . . . . 10.0 109.7 179.946 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.53 ' CB ' ' HB3' ' A' ' 65' ' ' GLN 0.256 2.8 m-20 -96.79 26.03 4.84 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 113.853 -1.174 . . . . 10.0 108.843 179.228 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . 0.459 ' HA ' ' HG2' ' A' ' 44' ' ' GLN . 8.3 m-70 77.01 -163.46 0.04 OUTLIER 'General case' 0 N--CA 1.434 -1.24 0 C-N-CA 126.695 1.998 . . . . 10.0 111.409 176.465 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.481 ' HG2' ' CD1' ' A' ' 51' ' ' ILE . 4.9 ttm 10.01 123.06 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.057 0 O-C-N 129.046 3.966 . . . . 10.0 119.261 -177.879 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 11.8 mt -144.53 106.46 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.865 0 N-CA-C 102.408 -3.182 . . . . 10.0 102.408 179.104 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.481 ' CD1' ' HG2' ' A' ' 49' ' ' MET . 1.2 mp -96.08 131.85 41.82 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.054 0 CA-C-O 124.846 2.26 . . . . 10.0 112.123 -178.795 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.42 ' HD3' ' CG2' ' A' ' 43' ' ' VAL . 0.0 OUTLIER -120.14 139.86 51.98 Favored 'General case' 0 N--CA 1.43 -1.466 0 CA-C-N 112.392 -2.186 . . . . 10.0 110.139 179.264 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 92.2 m -120.35 145.7 46.88 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 102.501 -3.148 . . . . 10.0 102.501 -179.86 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 97.0 mt -139.22 150.45 45.55 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 121.256 3.799 . . . . 10.0 121.256 179.909 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 78.4 p -179.27 174.84 0.99 Allowed 'General case' 0 C--O 1.24 0.577 0 CA-C-N 112.714 -2.039 . . . . 10.0 106.128 179.996 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 16.5 p -71.8 -22.02 61.63 Favored 'General case' 0 C--O 1.241 0.615 0 O-C-N 124.414 1.071 . . . . 10.0 109.892 179.308 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -86.11 173.96 9.49 Favored 'General case' 0 C--O 1.245 0.865 0 C-N-CA 125.795 1.638 . . . . 10.0 109.908 -179.919 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -47.35 127.14 10.54 Favored 'General case' 0 C--O 1.241 0.653 0 O-C-N 125.9 2.0 . . . . 10.0 114.159 -179.948 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 10.9 p-10 -100.04 177.31 5.13 Favored 'General case' 0 C--O 1.237 0.421 0 O-C-N 125.683 1.864 . . . . 10.0 108.857 179.794 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.473 ' CD1' ' HE1' ' A' ' 62' ' ' MET . 9.8 p90 -159.24 143.08 14.99 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 103.269 -2.863 . . . . 10.0 103.269 179.732 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -115.83 153.43 17.42 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.797 0 CA-C-O 123.679 1.704 . . . . 10.0 110.307 -179.87 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 62' ' ' MET . . . . . 0.473 ' HE1' ' CD1' ' A' ' 60' ' ' TYR . 0.3 OUTLIER -136.09 -178.63 5.23 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 104.195 -2.521 . . . . 10.0 104.195 179.964 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 34.1 t0 -150.33 122.24 8.17 Favored 'General case' 0 N--CA 1.437 -1.125 0 CA-C-N 113.003 -1.908 . . . . 10.0 106.508 179.888 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.482 ' HA ' ' CZ ' ' A' ' 70' ' ' PHE . 4.8 m-85 -93.67 -96.09 0.15 Allowed 'General case' 0 N--CA 1.44 -0.947 0 C-N-CA 125.629 1.572 . . . . 10.0 114.607 179.429 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.53 ' HB3' ' CB ' ' A' ' 47' ' ' ASP . 86.6 mt-30 84.33 114.01 0.05 Allowed 'General case' 0 C--N 1.298 -1.634 1 O-C-N 131.622 5.576 . . . . 10.0 108.393 -179.679 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 3.2 t -53.56 135.13 15.86 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.726 0 CA-C-N 113.023 -1.899 . . . . 10.0 107.369 179.573 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 63.04 70.5 1.03 Allowed Glycine 0 CA--C 1.53 1.014 0 CA-C-O 117.724 -1.598 . . . . 10.0 116.677 -179.756 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 5.6 tttp -179.43 148.45 0.35 Allowed 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 123.724 1.726 . . . . 10.0 113.715 179.617 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -97.18 133.37 41.91 Favored 'General case' 0 C--O 1.24 0.555 0 CA-C-N 113.129 -1.85 . . . . 10.0 109.662 -179.882 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.482 ' CZ ' ' HA ' ' A' ' 64' ' ' PHE . 1.0 OUTLIER -146.27 103.29 3.69 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 119.205 0.911 . . . . 10.0 111.345 -179.5 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.12 126.09 26.17 Favored 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 106.325 -1.731 . . . . 10.0 106.325 -179.77 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -109.72 96.07 6.02 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 112.407 0.521 . . . . 10.0 112.407 179.93 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -76.65 81.07 3.3 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 105.48 -2.044 . . . . 10.0 105.48 179.992 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.5 mp -67.43 120.94 14.74 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-N 112.479 -2.146 . . . . 10.0 113.248 179.946 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 1.2 t -159.83 100.18 1.42 Allowed 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 105.619 -1.993 . . . . 10.0 105.619 -179.924 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -167.69 -46.26 0.03 OUTLIER Glycine 0 N--CA 1.443 -0.884 0 O-C-N 127.277 2.86 . . . . 10.0 111.384 179.932 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 16.0 mt -137.97 -71.53 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 N-CA-C 107.517 -1.29 . . . . 10.0 107.517 -179.994 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -76.41 -22.14 55.09 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 125.585 1.803 . . . . 10.0 113.063 -179.981 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 60.16 -162.63 0.26 Allowed 'General case' 0 N--CA 1.478 0.937 0 CA-C-O 116.903 -1.522 . . . . 10.0 112.136 179.984 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 12.4 ttm105 74.89 137.07 0.06 Allowed 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 121.023 1.738 . . . . 10.0 109.394 -179.678 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.51 164.22 12.35 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 107.874 -1.158 . . . . 10.0 107.874 -179.874 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -162.33 159.47 25.48 Favored 'General case' 0 C--O 1.218 -0.581 0 N-CA-C 105.561 -2.014 . . . . 10.0 105.561 -179.984 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 2.6 ttp -122.24 124.92 44.92 Favored 'General case' 0 N--CA 1.448 -0.554 1 N-CA-C 99.066 -4.42 . . . . 10.0 99.066 -179.838 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 84' ' ' THR . . . . . 0.48 HG21 ' CZ ' ' A' ' 70' ' ' PHE . 1.1 m -124.77 137.66 54.31 Favored 'General case' 0 C--O 1.214 -0.77 0 N-CA-C 118.828 2.899 . . . . 10.0 118.828 -179.411 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -124.47 143.63 50.54 Favored 'General case' 0 CA--C 1.502 -0.9 0 N-CA-C 104.793 -2.299 . . . . 10.0 104.793 -179.754 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 3.0 m -123.55 146.62 28.66 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 N-CA-C 102.279 -3.23 . . . . 10.0 102.279 179.932 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 6.0 p -143.91 104.24 4.13 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 113.942 -1.481 . . . . 10.0 111.01 179.965 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 13.8 p-90 -61.74 137.75 58.27 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 104.987 -2.227 . . . . 10.0 104.987 -179.876 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -102.63 -54.91 2.55 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 102.624 -3.102 . . . . 10.0 102.624 179.794 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -168.94 -86.2 0.06 OUTLIER Glycine 0 CA--C 1.501 -0.836 0 N-CA-C 107.023 -2.431 . . . . 10.0 107.023 -179.912 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -102.49 14.0 33.08 Favored 'General case' 0 N--CA 1.446 -0.634 0 O-C-N 124.748 0.911 . . . . 10.0 112.566 -179.884 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -136.65 174.29 10.78 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 123.627 1.679 . . . . 10.0 108.633 -179.86 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -144.85 136.75 25.77 Favored 'General case' 0 C--O 1.216 -0.658 0 CA-C-N 114.549 -1.205 . . . . 10.0 107.949 179.847 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -126.18 149.23 49.15 Favored 'General case' 0 C--O 1.212 -0.906 0 CA-C-N 115.446 -0.797 . . . . 10.0 113.101 179.993 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -139.2 122.83 17.43 Favored 'General case' 0 C--N 1.321 -0.658 0 O-C-N 125.594 1.809 . . . . 10.0 113.219 179.85 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 14.1 t -111.68 113.93 45.6 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 N-CA-C 106.212 -1.773 . . . . 10.0 106.212 179.727 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -90.81 79.96 5.91 Favored 'General case' 0 C--O 1.245 0.826 0 O-C-N 125.118 1.511 . . . . 10.0 108.002 -179.949 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 24.5 ttpp -75.94 89.12 2.93 Favored 'General case' 0 CA--C 1.521 -0.159 0 C-N-CA 124.98 1.312 . . . . 10.0 113.352 -179.919 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -119.91 -65.28 0.27 Allowed Glycine 0 N--CA 1.436 -1.304 0 C-N-CA 125.498 1.523 . . . . 10.0 110.881 179.968 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -148.41 -32.18 0.25 Allowed 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 115.693 1.738 . . . . 10.0 115.693 -179.892 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 61.3 mmtt -80.1 -175.82 5.22 Favored 'General case' 0 C--O 1.215 -0.722 0 N-CA-C 115.115 1.524 . . . . 10.0 115.115 -179.856 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -105.88 -29.48 9.97 Favored 'General case' 0 N--CA 1.452 -0.358 0 O-C-N 125.833 1.958 . . . . 10.0 114.628 179.961 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -113.2 -18.62 7.12 Favored Glycine 0 N--CA 1.465 0.63 0 CA-C-O 118.411 -1.216 . . . . 10.0 115.825 -179.911 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -48.16 109.14 0.2 Allowed 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 120.329 2.065 . . . . 10.0 113.216 -179.918 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 177.55 149.13 7.69 Favored Glycine 0 N--CA 1.448 -0.554 0 N-CA-C 109.539 -1.424 . . . . 10.0 109.539 -179.688 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 9.3 m0 -111.21 121.18 44.62 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 118.708 1.254 . . . . 10.0 109.949 -179.987 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 60.2 m -104.59 108.9 20.58 Favored 'General case' 0 CA--C 1.499 -1.005 0 O-C-N 123.924 0.765 . . . . 10.0 109.259 179.586 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 -88.37 156.52 19.1 Favored 'General case' 0 C--O 1.245 0.835 0 C-N-CA 124.909 1.284 . . . . 10.0 108.237 179.719 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 109' ' ' TRP . . . . . 0.428 ' CD1' ' C ' ' A' ' 109' ' ' TRP . 2.4 t90 -175.46 104.65 0.08 Allowed 'General case' 0 C--O 1.215 -0.741 0 O-C-N 121.306 -0.872 . . . . 10.0 109.141 179.771 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 5.1 mt -78.49 146.47 8.08 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 125.799 2.714 . . . . 10.0 114.519 179.79 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -133.68 78.77 1.79 Allowed 'General case' 0 C--O 1.222 -0.366 0 CA-C-N 113.579 -1.646 . . . . 10.0 108.226 -179.779 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 73.62 -101.89 1.23 Allowed Glycine 0 N--CA 1.449 -0.443 0 N-CA-C 108.22 -1.952 . . . . 10.0 108.22 179.889 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -112.88 21.98 14.92 Favored 'General case' 0 C--O 1.214 -0.797 0 O-C-N 124.928 1.016 . . . . 10.0 109.596 179.889 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -127.71 139.92 52.39 Favored 'General case' 0 C--O 1.216 -0.683 0 CA-C-O 122.64 1.209 . . . . 10.0 110.131 -179.829 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.494 HD13 ' CE2' ' A' ' 8' ' ' TRP . 0.2 OUTLIER -105.58 125.18 50.69 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 114.402 -1.272 . . . . 10.0 109.135 -179.988 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 40.1 t-80 -111.44 101.69 10.12 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 106.491 -1.67 . . . . 10.0 106.491 179.684 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 2.0 tt -112.7 126.3 55.24 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 122.415 1.102 . . . . 10.0 113.075 179.989 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -112.59 103.75 11.82 Favored 'General case' 0 CA--C 1.505 -0.781 0 O-C-N 119.891 -1.755 . . . . 10.0 108.272 179.951 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 1.4 ttm -94.23 161.29 14.32 Favored 'General case' 0 CA--C 1.509 -0.601 0 N-CA-C 108.184 -1.043 . . . . 10.0 108.184 -179.923 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 49.9 mtm180 -150.13 -177.37 5.89 Favored 'General case' 0 C--N 1.316 -0.874 0 C-N-CA 125.135 1.374 . . . . 10.0 114.348 179.915 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 165.67 129.92 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.493 0 O-C-N 128.141 3.401 . . . . 10.0 107.985 -179.989 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 53.51 36.21 22.7 Favored 'General case' 0 C--O 1.244 0.787 0 N-CA-C 114.813 1.412 . . . . 10.0 114.813 179.853 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 81.3 -6.69 63.01 Favored Glycine 0 CA--C 1.529 0.914 0 CA-C-O 116.052 -2.527 . . . . 10.0 114.671 -179.818 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -82.02 157.08 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 CA-C-N 119.041 1.421 . . . . 10.0 109.573 -179.854 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 3.5 m -127.5 114.17 17.1 Favored 'General case' 0 C--O 1.239 0.522 0 O-C-N 126.367 2.292 . . . . 10.0 113.074 179.781 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -120.57 151.86 38.86 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 105.908 -1.886 . . . . 10.0 105.908 -179.779 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.61 154.87 51.29 Favored 'General case' 0 C--O 1.224 -0.26 0 O-C-N 125.271 1.607 . . . . 10.0 113.114 -179.905 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -145.63 109.63 4.86 Favored 'General case' 0 C--N 1.323 -0.546 0 O-C-N 126.267 2.229 . . . . 10.0 108.378 179.662 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 16.9 t -91.22 140.37 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 N-CA-C 107.935 -1.135 . . . . 10.0 107.935 -179.613 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . 0.41 ' HB2' ' HB2' ' A' ' 115' ' ' LEU . 74.7 m-85 -123.84 169.44 11.57 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 119.221 -0.418 . . . . 10.0 111.008 179.721 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -141.48 124.74 16.48 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 105.789 -1.93 . . . . 10.0 105.789 -179.988 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . 0.537 ' HB2' ' CZ3' ' A' ' 8' ' ' TRP . 13.7 tttt -78.4 132.0 37.18 Favored 'General case' 0 C--N 1.324 -0.533 0 O-C-N 121.365 -0.834 . . . . 10.0 110.495 -179.893 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 2.2 t -107.31 -54.7 5.78 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 N-CA-C 115.009 1.485 . . . . 10.0 115.009 179.94 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 6.1 t-160 . . . . . 0 C--O 1.252 1.216 0 CA-C-O 117.143 -1.408 . . . . 10.0 113.37 -179.907 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo . . . . . 0 C--O 1.231 0.129 0 CA-C-O 118.308 -0.788 . . . . 10.0 110.952 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 2.1 t -102.37 -14.24 8.26 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.898 0 O-C-N 126.98 2.675 . . . . 10.0 112.406 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 25.62 89.46 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.967 0 O-C-N 128.616 3.698 . . . . 10.0 113.569 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 26.5 m-85 -40.14 -22.56 0.01 OUTLIER 'General case' 0 C--O 1.245 0.819 0 N-CA-C 117.844 2.535 . . . . 10.0 117.844 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -49.05 104.77 0.07 Allowed 'General case' 0 N--CA 1.475 0.775 0 O-C-N 125.738 1.899 . . . . 10.0 111.248 179.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -152.21 -163.44 11.57 Favored Glycine 0 N--CA 1.449 -0.458 0 N-CA-C 118.194 2.038 . . . . 10.0 118.194 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -135.31 110.85 9.17 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 100.843 -3.762 . . . . 10.0 100.843 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.515 ' CZ2' HD23 ' A' ' 115' ' ' LEU . 46.5 m0 -112.63 116.43 30.17 Favored 'General case' 0 CA--C 1.506 -0.747 0 O-C-N 124.095 0.872 . . . . 10.0 112.373 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.78 148.63 22.42 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 117.658 -1.163 . . . . 10.0 107.946 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 2.6 mtt -86.03 128.66 34.9 Favored 'General case' 0 C--N 1.314 -0.942 0 O-C-N 126.671 2.482 . . . . 10.0 111.411 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -104.5 -53.12 2.77 Favored 'General case' 0 C--N 1.317 -0.813 0 O-C-N 124.914 1.384 . . . . 10.0 108.053 179.809 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -118.09 -172.36 2.24 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 113.53 0.937 . . . . 10.0 113.53 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 177.43 104.97 0.02 OUTLIER 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 106.655 -1.609 . . . . 10.0 106.655 179.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -107.2 151.13 25.83 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 116.551 2.056 . . . . 10.0 116.551 -179.793 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 34.03 34.33 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 116.647 2.091 . . . . 10.0 116.647 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -71.04 -29.99 66.05 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 115.554 1.687 . . . . 10.0 115.554 -179.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -75.38 -36.38 60.91 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 121.197 -0.939 . . . . 10.0 111.641 179.721 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -74.49 -23.45 58.86 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 107.785 -1.191 . . . . 10.0 107.785 -179.693 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -69.36 -34.81 75.13 Favored 'General case' 0 CA--C 1.552 1.054 0 N-CA-C 108.492 -0.929 . . . . 10.0 108.492 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 34.6 mt -79.0 -28.84 43.44 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 108.821 -0.807 . . . . 10.0 108.821 179.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.6 ttt180 -73.83 -35.96 64.87 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 114.312 -1.313 . . . . 10.0 108.65 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.29 -33.65 71.81 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 126.695 2.497 . . . . 10.0 110.879 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.7 mt -91.32 5.38 49.46 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 115.179 -0.919 . . . . 10.0 109.124 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 52.72 38.09 25.4 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 116.707 2.114 . . . . 10.0 116.707 -179.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 1.4 m -79.79 179.11 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 N-CA-C 106.036 -1.839 . . . . 10.0 106.036 179.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -72.35 159.49 33.94 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 117.462 2.393 . . . . 10.0 117.462 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.0 m -72.64 -35.46 50.61 Favored 'Isoleucine or valine' 0 C--O 1.242 0.668 0 C-N-CA 125.735 1.614 . . . . 10.0 112.836 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.72 -28.19 64.55 Favored 'General case' 0 N--CA 1.445 -0.724 0 O-C-N 120.286 -1.509 . . . . 10.0 111.558 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 22.9 tp -69.32 -45.23 70.02 Favored 'General case' 0 C--O 1.216 -0.705 0 CA-C-N 114.477 -1.238 . . . . 10.0 110.392 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.17 -20.44 61.59 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-N 113.107 -1.86 . . . . 10.0 112.333 179.854 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.75 -47.4 47.14 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 118.894 -2.379 . . . . 10.0 109.534 -179.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.1 mm -78.95 -44.7 24.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 O-C-N 126.803 2.564 . . . . 10.0 111.21 -179.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -55.88 -35.16 66.21 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 116.486 2.032 . . . . 10.0 116.486 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -67.51 -55.4 13.68 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 121.845 2.111 . . . . 10.0 115.668 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -54.57 -21.11 9.35 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-O 117.329 -1.319 . . . . 10.0 112.872 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 25.2 mt -90.55 161.32 15.52 Favored 'General case' 0 CA--C 1.503 -0.861 0 CA-C-O 123.204 1.478 . . . . 10.0 114.841 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.1 mttp -154.29 109.79 2.43 Favored Pre-proline 0 N--CA 1.472 0.646 0 N-CA-C 104.408 -2.441 . . . . 10.0 104.408 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -81.29 136.92 10.29 Favored 'Trans proline' 0 CA--C 1.535 0.568 0 C-N-CA 123.044 2.496 . . . . 10.0 116.802 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -91.01 121.79 33.12 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 118.019 -1.472 . . . . 10.0 107.701 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.1 ttpt -84.44 158.78 20.95 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-O 118.654 -0.689 . . . . 10.0 110.399 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -153.87 125.2 7.47 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 105.586 -2.005 . . . . 10.0 105.586 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.409 ' CD1' ' CH2' ' A' ' 8' ' ' TRP . 7.9 mt -103.88 143.52 15.6 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.013 0 CA-C-N 120.076 1.307 . . . . 10.0 114.099 -179.761 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 35.7 t -136.97 138.16 46.17 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 N-CA-C 104.672 -2.344 . . . . 10.0 104.672 179.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -152.85 117.3 4.97 Favored 'General case' 0 C--N 1.312 -1.052 0 C-N-CA 124.784 1.234 . . . . 10.0 110.13 -179.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.58 -41.56 26.89 Favored 'General case' 0 C--N 1.321 -0.661 0 O-C-N 119.691 -1.881 . . . . 10.0 108.199 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -174.66 -92.11 0.08 OUTLIER Glycine 0 C--O 1.24 0.522 0 N-CA-C 106.76 -2.536 . . . . 10.0 106.76 -179.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -98.33 17.95 17.56 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 119.299 1.549 . . . . 10.0 109.935 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . 0.401 ' CE1' ' CG1' ' A' ' 50' ' ' ILE . 0.7 OUTLIER -129.15 121.73 28.34 Favored 'General case' 0 C--O 1.214 -0.766 0 N-CA-C 105.439 -2.06 . . . . 10.0 105.439 179.721 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 7.2 ttp -121.03 133.44 55.25 Favored 'General case' 0 N--CA 1.443 -0.8 0 O-C-N 126.033 2.083 . . . . 10.0 112.759 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.401 ' CG1' ' CE1' ' A' ' 48' ' ' HIS . 19.3 mt -116.3 120.41 64.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 107.661 -1.237 . . . . 10.0 107.661 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -98.28 109.49 23.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 104.75 -2.315 . . . . 10.0 104.75 179.726 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 4.2 mtt180 -106.54 128.95 54.52 Favored 'General case' 0 N--CA 1.434 -1.265 0 C-N-CA 123.397 0.679 . . . . 10.0 112.112 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -125.39 137.91 54.02 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 100.563 -3.865 . . . . 10.0 100.563 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.3 mp -125.92 92.64 3.63 Favored 'General case' 0 N--CA 1.449 -0.482 1 N-CA-C 123.409 4.596 . . . . 10.0 123.409 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 3.4 p -123.19 144.02 49.64 Favored 'General case' 0 C--N 1.315 -0.931 0 O-C-N 125.958 2.036 . . . . 10.0 105.531 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -69.35 -16.48 63.54 Favored 'General case' 0 C--O 1.22 -0.48 0 CA-C-O 123.209 1.48 . . . . 10.0 107.571 179.742 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -93.36 108.79 20.38 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 107.255 -1.387 . . . . 10.0 107.255 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 15.4 tpp180 36.64 91.87 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 O-C-N 126.074 2.109 . . . . 10.0 114.742 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -48.79 122.12 5.35 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-O 123.64 1.686 . . . . 10.0 110.631 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -102.01 78.13 1.76 Allowed 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 112.87 -1.968 . . . . 10.0 107.959 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 1.4 mm -106.77 133.5 51.15 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 C-N-CA 120.424 -0.51 . . . . 10.0 109.993 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -129.99 151.46 50.52 Favored 'General case' 0 C--N 1.317 -0.834 0 C-N-CA 125.742 1.617 . . . . 10.0 108.378 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -127.33 152.81 46.97 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 101.363 -3.569 . . . . 10.0 101.363 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 4.9 m-30 -146.39 167.89 22.49 Favored 'General case' 0 C--O 1.246 0.911 0 N-CA-C 116.062 1.875 . . . . 10.0 116.062 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 40.2 mm-40 -137.01 117.14 13.39 Favored 'General case' 0 N--CA 1.437 -1.118 0 N-CA-C 104.412 -2.44 . . . . 10.0 104.412 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 47.1 t -73.73 132.25 33.68 Favored 'Isoleucine or valine' 0 C--O 1.241 0.639 0 CA-C-N 115.133 -0.939 . . . . 10.0 112.021 -179.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 77.86 -10.42 25.74 Favored Glycine 0 N--CA 1.437 -1.263 0 C-N-CA 125.299 1.428 . . . . 10.0 116.032 -179.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.6 tmtt? -113.25 126.48 55.45 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 114.514 -0.843 . . . . 10.0 112.218 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -41.82 141.15 0.87 Allowed 'General case' 0 C--N 1.32 -0.681 0 O-C-N 127.604 3.065 . . . . 10.0 112.789 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -124.15 151.34 44.1 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 113.912 -1.494 . . . . 10.0 113.248 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -126.49 151.81 47.31 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 105.994 -1.854 . . . . 10.0 105.994 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -143.32 145.5 32.75 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 117.201 2.297 . . . . 10.0 117.201 -179.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -129.81 124.05 32.4 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 121.487 0.661 . . . . 10.0 109.372 -179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 80.5 mt -121.52 139.86 52.95 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 123.906 0.882 . . . . 10.0 111.751 -179.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.91 4.46 4.16 Favored 'General case' 0 N--CA 1.443 -0.8 0 O-C-N 120.649 -1.282 . . . . 10.0 109.631 -179.762 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -121.48 -21.23 3.07 Favored Glycine 0 CA--C 1.53 0.986 0 CA-C-O 117.892 -1.504 . . . . 10.0 110.858 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.44 ' N ' ' CD1' ' A' ' 77' ' ' ILE . 0.0 OUTLIER -124.43 120.17 58.37 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.687 0 CA-C-O 116.4 -1.762 . . . . 10.0 108.011 -179.868 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 3.4 p30 28.5 34.34 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.86 0 O-C-N 126.646 2.466 . . . . 10.0 114.027 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -4.56 81.13 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 127.68 2.392 . . . . 10.0 116.367 -179.592 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.9 158.23 44.91 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 113.095 -1.866 . . . . 10.0 110.265 -179.688 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -120.18 137.59 54.09 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 103.815 -2.661 . . . . 10.0 103.815 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 7.2 p -140.57 166.71 24.0 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.408 -1.269 . . . . 10.0 109.656 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -110.38 116.42 31.4 Favored 'General case' 0 N--CA 1.439 -0.995 1 N-CA-C 99.047 -4.427 . . . . 10.0 99.047 179.878 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 31.9 m -117.49 138.28 51.98 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 123.266 1.508 . . . . 10.0 114.329 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 20.7 m -127.51 123.49 36.01 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 106.238 -1.764 . . . . 10.0 106.238 -179.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 2.6 m -104.63 123.36 58.55 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.661 0 N-CA-C 102.647 -3.094 . . . . 10.0 102.647 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -137.97 178.37 7.17 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 122.724 1.25 . . . . 10.0 110.603 -179.834 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 4.0 p-90 -123.45 109.33 13.71 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 104.288 -2.486 . . . . 10.0 104.288 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -72.55 -55.09 7.47 Favored 'General case' 0 C--N 1.314 -0.974 1 N-CA-C 99.014 -4.439 . . . . 10.0 99.014 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -149.13 -117.57 0.89 Allowed Glycine 0 C--O 1.246 0.849 0 N-CA-C 105.505 -3.038 . . . . 10.0 105.505 -179.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -97.99 49.77 1.02 Allowed 'General case' 0 N--CA 1.461 0.115 0 C-N-CA 118.447 -1.301 . . . . 10.0 111.374 179.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.3 mtmm -147.14 -168.95 3.18 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 124.436 1.094 . . . . 10.0 109.181 -179.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -142.58 151.3 41.4 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 105.819 -1.919 . . . . 10.0 105.819 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 17.5 mt-30 -147.23 150.2 34.39 Favored 'General case' 0 C--O 1.215 -0.743 0 C-N-CA 124.595 1.158 . . . . 10.0 112.256 179.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -138.85 127.95 23.97 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-N 114.517 -1.22 . . . . 10.0 112.882 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 9.1 p -110.11 97.66 6.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 C-N-CA 123.992 0.917 . . . . 10.0 108.955 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -73.89 81.99 1.67 Allowed 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 105.675 -1.972 . . . . 10.0 105.675 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -71.64 97.45 1.73 Allowed 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 114.3 1.222 . . . . 10.0 114.3 -179.601 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -162.16 -155.26 7.89 Favored Glycine 0 C--N 1.315 -0.604 0 O-C-N 126.104 2.128 . . . . 10.0 110.621 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -64.96 -171.68 0.07 Allowed 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 120.639 0.256 . . . . 10.0 111.657 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 15.2 mmtm 74.97 162.49 0.25 Allowed 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 114.774 1.398 . . . . 10.0 114.774 -179.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -93.41 -32.84 14.08 Favored 'General case' 0 C--O 1.213 -0.824 0 CA-C-O 122.95 1.357 . . . . 10.0 112.446 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -130.78 80.86 0.34 Allowed Glycine 0 C--O 1.221 -0.719 0 C-N-CA 125.391 1.472 . . . . 10.0 115.392 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.49 126.11 46.13 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-O 123.571 1.653 . . . . 10.0 108.681 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 145.0 154.97 6.29 Favored Glycine 0 C--N 1.336 0.528 0 CA-C-O 117.834 -1.537 . . . . 10.0 109.709 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' TRP . . . . . 0.503 ' CD1' ' HG2' ' A' ' 119' ' ' MET . 2.9 m0 -115.81 161.19 19.11 Favored 'General case' 0 C--N 1.314 -0.968 0 O-C-N 127.118 2.305 . . . . 10.0 108.952 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 51.1 m -133.54 130.5 38.54 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 104.974 -2.232 . . . . 10.0 104.974 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -118.09 162.48 18.13 Favored 'General case' 0 C--N 1.318 -0.784 0 O-C-N 127.257 2.848 . . . . 10.0 111.6 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' TRP . . . . . 0.46 ' CD1' ' C ' ' A' ' 109' ' ' TRP . 0.0 OUTLIER 176.99 157.53 0.31 Allowed 'General case' 0 CA--C 1.5 -0.947 0 CA-C-N 114.354 -1.294 . . . . 10.0 107.613 -179.995 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 66.8 mt -121.62 130.88 74.21 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 CA-C-N 115.857 -0.61 . . . . 10.0 111.429 -179.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -111.12 58.99 0.61 Allowed 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 124.136 1.922 . . . . 10.0 107.93 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 77.22 -94.45 1.13 Allowed Glycine 0 CA--C 1.504 -0.634 0 O-C-N 120.478 -1.389 . . . . 10.0 110.739 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -102.93 4.75 37.89 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 114.271 1.211 . . . . 10.0 114.271 -179.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -142.45 139.83 31.73 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 124.013 1.863 . . . . 10.0 115.041 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.515 HD23 ' CZ2' ' A' ' 8' ' ' TRP . 4.3 mm? -83.32 144.51 29.64 Favored 'General case' 0 N--CA 1.441 -0.905 0 CA-C-N 112.718 -2.037 . . . . 10.0 109.684 -179.751 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 8.4 m-70 -131.67 67.66 1.51 Allowed 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 113.319 -1.764 . . . . 10.0 107.375 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.93 154.07 20.8 Favored 'General case' 0 C--N 1.317 -0.82 0 O-C-N 125.06 1.475 . . . . 10.0 113.441 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -135.99 135.63 39.67 Favored 'General case' 0 CA--C 1.502 -0.896 0 N-CA-C 107.352 -1.351 . . . . 10.0 107.352 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.503 ' HG2' ' CD1' ' A' ' 106' ' ' TRP . 3.6 mtt -125.61 123.11 38.3 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-O 123.391 1.567 . . . . 10.0 111.784 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.09 158.29 23.4 Favored 'General case' 0 N--CA 1.443 -0.791 0 O-C-N 119.958 -1.714 . . . . 10.0 112.834 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -169.34 103.69 0.36 Allowed 'General case' 0 CA--C 1.515 -0.368 0 O-C-N 120.935 -1.103 . . . . 10.0 108.382 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 73.47 13.21 4.57 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.397 1.879 . . . . 10.0 116.029 -179.855 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 107.81 13.75 19.27 Favored Glycine 0 CA--C 1.535 1.301 0 CA-C-O 116.144 -2.476 . . . . 10.0 116.326 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 2.7 m -112.91 93.97 2.85 Favored 'Isoleucine or valine' 0 C--O 1.242 0.679 0 CA-C-N 119.869 1.834 . . . . 10.0 113.554 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -78.91 109.94 13.66 Favored 'General case' 0 C--N 1.317 -0.811 0 O-C-N 125.852 1.97 . . . . 10.0 113.809 -179.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -106.57 151.52 24.91 Favored 'General case' 0 N--CA 1.463 0.202 0 N-CA-C 105.02 -2.215 . . . . 10.0 105.02 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 9.0 mtpp -132.84 150.44 52.16 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 119.111 -1.035 . . . . 10.0 111.949 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -138.61 106.66 5.71 Favored 'General case' 0 C--N 1.316 -0.876 0 O-C-N 121.759 -0.588 . . . . 10.0 110.9 -179.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 1.1 t -89.64 127.54 42.21 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 C-N-CA 118.611 -1.236 . . . . 10.0 109.126 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -108.38 167.06 10.3 Favored 'General case' 0 N--CA 1.445 -0.716 0 C-N-CA 125.309 1.443 . . . . 10.0 110.199 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -127.23 107.56 10.11 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 106.785 -1.561 . . . . 10.0 106.785 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . 0.484 ' HG3' ' CD1' ' A' ' 8' ' ' TRP . 21.3 tttt -56.26 109.88 0.67 Allowed 'General case' 0 C--O 1.221 -0.396 0 CA-C-N 119.726 1.148 . . . . 10.0 108.155 179.811 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 16.1 m -103.42 50.58 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.506 -0.724 0 C-N-CA 124.964 1.306 . . . . 10.0 110.94 179.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 2.1 t60 . . . . . 0 C--N 1.315 -0.922 0 O-C-N 121.569 -0.707 . . . . 10.0 109.767 179.96 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo . . . . . 0 C--O 1.233 0.232 0 N-CA-C 109.851 -0.865 . . . . 10.0 109.851 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.445 ' CG1' ' N ' ' A' ' 3' ' ' ASP . 0.8 OUTLIER -111.08 -156.42 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.281 0 C-N-CA 123.995 0.918 . . . . 10.0 109.634 -179.578 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.445 ' N ' ' CG1' ' A' ' 2' ' ' VAL . 14.5 m-20 -101.33 -33.73 9.91 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 116.54 -1.695 . . . . 10.0 112.972 -179.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.481 ' CD1' HD13 ' A' ' 110' ' ' ILE . 0.7 OUTLIER -20.52 -52.49 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.779 0 O-C-N 126.313 2.258 . . . . 10.0 116.606 179.681 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -53.12 110.56 0.55 Allowed 'General case' 0 N--CA 1.484 1.25 0 O-C-N 125.2 1.562 . . . . 10.0 112.404 179.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -152.75 171.08 31.87 Favored Glycine 0 N--CA 1.464 0.503 0 C-N-CA 118.507 -1.806 . . . . 10.0 115.748 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -92.65 87.45 5.91 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 101.355 -3.572 . . . . 10.0 101.355 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.507 ' HB3' ' CD1' ' A' ' 130' ' ' PHE . 38.7 m0 -89.55 112.63 23.88 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 123.282 1.515 . . . . 10.0 114.24 179.816 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 18.8 pttp -98.05 138.62 35.08 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 103.908 -2.627 . . . . 10.0 103.908 179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.4 ' HE2' ' HD2' ' A' ' 38' ' ' PRO . 0.0 OUTLIER -89.27 150.23 22.71 Favored 'General case' 0 C--N 1.313 -0.981 0 N-CA-C 114.115 1.154 . . . . 10.0 114.115 -179.941 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.2 tt -113.34 -55.15 2.55 Favored 'General case' 0 C--O 1.242 0.696 0 CA-C-O 118.293 -0.86 . . . . 10.0 109.666 -179.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.4 p -167.99 133.09 1.83 Allowed 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 116.33 1.974 . . . . 10.0 116.33 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -90.4 165.89 13.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 111.173 -2.74 . . . . 10.0 105.715 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -124.13 -57.26 1.61 Allowed 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 120.549 1.522 . . . . 10.0 111.293 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -112.4 51.07 0.83 Allowed 'General case' 0 C--N 1.328 -0.342 0 O-C-N 126.592 2.432 . . . . 10.0 113.148 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 6.4 t80 -76.3 -28.57 57.04 Favored 'General case' 0 CA--C 1.546 0.799 0 O-C-N 118.889 -2.382 . . . . 10.0 110.133 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -79.26 -42.4 25.96 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 125.799 1.937 . . . . 10.0 112.0 179.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -74.79 -20.56 59.74 Favored 'General case' 0 C--O 1.22 -0.478 0 O-C-N 121.418 -0.801 . . . . 10.0 108.85 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 14.2 t80 -67.1 -39.86 86.81 Favored 'General case' 0 CA--C 1.548 0.88 0 CA-C-O 122.583 1.183 . . . . 10.0 110.074 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 34.9 mt -75.33 -40.33 58.49 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 122.385 1.088 . . . . 10.0 109.643 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.4 ttm180 -68.41 -27.2 65.99 Favored 'General case' 0 C--O 1.241 0.657 0 C-N-CA 125.415 1.486 . . . . 10.0 109.231 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.56 -26.36 59.9 Favored 'General case' 0 C--O 1.221 -0.432 0 O-C-N 124.664 1.228 . . . . 10.0 109.239 -179.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 79.0 mt -99.12 -15.26 19.05 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 124.756 1.223 . . . . 10.0 109.514 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 61.67 61.74 1.4 Allowed 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 116.424 2.009 . . . . 10.0 116.424 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -88.33 -150.11 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.245 0.838 0 N-CA-C 104.892 -2.262 . . . . 10.0 104.892 -179.7 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.551 ' ND2' ' N ' ' A' ' 26' ' ' ASN . 0.0 OUTLIER -96.27 162.37 13.54 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 120.639 1.563 . . . . 10.0 113.786 -179.908 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.9 t -70.36 -39.33 76.41 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 O-C-N 125.735 1.897 . . . . 10.0 114.261 -179.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -71.56 -29.99 65.36 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 113.473 0.916 . . . . 10.0 113.473 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.74 -29.25 58.8 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 124.903 1.281 . . . . 10.0 111.455 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.05 -33.42 67.95 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 113.252 0.834 . . . . 10.0 113.252 179.726 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -72.21 -41.42 66.95 Favored 'General case' 0 N--CA 1.451 -0.423 0 O-C-N 125.813 1.946 . . . . 10.0 109.387 -179.402 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.517 HG21 ' CZ ' ' A' ' 57' ' ' PHE . 46.5 mm -73.58 -60.03 2.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 O-C-N 120.879 -1.138 . . . . 10.0 108.175 -179.556 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -46.32 -26.77 0.88 Allowed 'General case' 0 C--N 1.318 -0.771 0 O-C-N 125.026 1.454 . . . . 10.0 114.79 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -81.96 -16.98 48.6 Favored 'General case' 0 C--N 1.327 -0.37 0 O-C-N 124.448 1.092 . . . . 10.0 111.061 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -87.6 -15.83 36.24 Favored 'General case' 0 N--CA 1.441 -0.877 0 O-C-N 121.064 -1.023 . . . . 10.0 110.744 -179.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.67 172.97 8.41 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.518 -0.919 . . . . 10.0 108.518 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.5 ptpt -152.37 135.52 9.43 Favored Pre-proline 0 N--CA 1.474 0.77 0 N-CA-C 106.292 -1.744 . . . . 10.0 106.292 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.4 ' HD2' ' HE2' ' A' ' 10' ' ' MET . 50.6 Cg_endo -74.29 107.28 2.41 Favored 'Trans proline' 0 N--CA 1.448 -1.151 1 C-N-CA 126.532 4.822 . . . . 10.0 119.064 -179.758 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -82.38 149.02 27.92 Favored 'General case' 0 C--O 1.239 0.526 0 N-CA-C 105.778 -1.934 . . . . 10.0 105.778 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 28.6 mttp -121.36 155.91 33.76 Favored 'General case' 0 C--O 1.214 -0.811 0 O-C-N 120.48 -1.388 . . . . 10.0 109.671 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -143.37 105.01 4.32 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 102.907 -2.997 . . . . 10.0 102.907 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.3 mt -100.41 149.29 6.13 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.921 0 C-N-CA 117.679 -1.608 . . . . 10.0 111.525 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 45.4 t -138.34 145.42 28.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 113.594 -1.639 . . . . 10.0 107.694 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -139.01 128.08 23.83 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 113.538 -1.664 . . . . 10.0 112.005 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -103.55 -49.8 3.6 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 104.202 -2.518 . . . . 10.0 104.202 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -164.18 -113.15 0.28 Allowed Glycine 0 C--O 1.246 0.893 0 N-CA-C 106.466 -2.653 . . . . 10.0 106.466 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -75.17 -20.22 59.45 Favored 'General case' 0 C--O 1.215 -0.722 0 O-C-N 120.317 -1.696 . . . . 10.0 110.816 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.4 m170 -91.7 130.78 37.43 Favored 'General case' 0 N--CA 1.439 -0.982 0 CA-C-N 114.99 -1.005 . . . . 10.0 110.017 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.455 ' HG2' ' CD1' ' A' ' 51' ' ' ILE . 2.5 ttp -121.42 149.54 42.86 Favored 'General case' 0 N--CA 1.435 -1.181 0 O-C-N 125.761 1.913 . . . . 10.0 111.568 -179.659 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 19.9 mt -130.16 123.64 56.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 105.835 -1.913 . . . . 10.0 105.835 -179.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.455 ' CD1' ' HG2' ' A' ' 49' ' ' MET . 1.6 mp -110.05 128.18 66.4 Favored 'Isoleucine or valine' 0 C--O 1.24 0.578 0 N-CA-C 106.07 -1.826 . . . . 10.0 106.07 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.6 mmm180 -116.32 106.56 13.79 Favored 'General case' 0 N--CA 1.435 -1.221 0 CA-C-O 118.533 -0.746 . . . . 10.0 110.59 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 65.3 m -91.52 129.87 37.43 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 102.126 -3.287 . . . . 10.0 102.126 -179.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 6.0 mp -127.37 86.5 2.5 Favored 'General case' 0 N--CA 1.441 -0.881 0 N-CA-C 119.353 3.094 . . . . 10.0 119.353 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 7.1 m -108.42 132.67 53.53 Favored 'General case' 0 N--CA 1.443 -0.782 0 C-N-CA 125.491 1.517 . . . . 10.0 107.504 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.7 p -56.83 -24.73 53.2 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-O 123.021 1.391 . . . . 10.0 107.753 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.517 ' CZ ' HG21 ' A' ' 32' ' ' ILE . 1.2 t80 -87.0 -135.07 0.08 Allowed 'General case' 0 C--O 1.239 0.545 0 N-CA-C 106.782 -1.562 . . . . 10.0 106.782 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.69 140.21 44.02 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 118.868 -1.133 . . . . 10.0 113.723 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -138.14 144.06 40.62 Favored 'General case' 0 N--CA 1.466 0.367 0 O-C-N 125.851 1.97 . . . . 10.0 111.714 179.719 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 1.5 p90 -129.34 134.57 47.97 Favored 'General case' 0 C--O 1.217 -0.643 0 N-CA-C 105.449 -2.056 . . . . 10.0 105.449 -179.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 1.4 mp -97.28 119.5 45.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 124.327 2.013 . . . . 10.0 109.286 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -118.39 144.4 45.95 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-N 112.497 -2.138 . . . . 10.0 106.654 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -132.11 114.3 14.35 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 100.467 -3.901 . . . . 10.0 100.467 -179.834 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -102.55 177.38 4.88 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 117.429 2.381 . . . . 10.0 117.429 -179.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 15.9 mm-40 -144.1 105.58 4.27 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 103.095 -2.928 . . . . 10.0 103.095 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 47.8 t -62.81 119.43 6.78 Favored 'Isoleucine or valine' 0 C--O 1.243 0.744 0 CA-C-O 122.738 1.256 . . . . 10.0 113.106 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.12 37.28 63.89 Favored Glycine 0 CA--C 1.533 1.188 0 N-CA-C 117.117 1.607 . . . . 10.0 117.117 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.21 13.84 3.54 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 119.426 -0.91 . . . . 10.0 112.473 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 65.85 150.61 0.05 OUTLIER 'General case' 0 C--N 1.32 -0.706 0 O-C-N 125.656 1.847 . . . . 10.0 112.338 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -149.63 114.92 5.48 Favored 'General case' 0 C--O 1.243 0.714 0 CA-C-O 121.18 0.514 . . . . 10.0 111.665 179.76 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -87.07 89.93 8.18 Favored 'General case' 0 C--O 1.217 -0.612 0 N-CA-C 107.688 -1.227 . . . . 10.0 107.688 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -68.52 170.65 8.71 Favored 'General case' 0 C--N 1.319 -0.723 0 O-C-N 126.328 2.267 . . . . 10.0 115.625 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -150.02 62.66 0.98 Allowed 'General case' 0 N--CA 1.441 -0.91 0 N-CA-C 106.475 -1.676 . . . . 10.0 106.475 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.404 HD12 HG21 ' A' ' 77' ' ' ILE . 3.5 mm? -50.0 145.91 5.24 Favored 'General case' 0 N--CA 1.438 -1.034 0 N-CA-C 113.267 0.84 . . . . 10.0 113.267 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 62.2 m -156.1 92.67 1.36 Allowed 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.368 -0.833 . . . . 10.0 109.08 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 144.54 -43.85 0.94 Allowed Glycine 0 N--CA 1.434 -1.47 0 CA-C-O 117.072 -1.96 . . . . 10.0 112.097 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.404 HG21 HD12 ' A' ' 74' ' ' LEU . 0.3 OUTLIER -99.59 66.74 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.467 0 CA-C-N 118.961 1.38 . . . . 10.0 108.66 179.976 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 9.0 t70 83.24 -11.0 0.96 Allowed 'General case' 0 N--CA 1.443 -0.798 0 O-C-N 125.523 1.764 . . . . 10.0 109.744 -179.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 50.45 100.26 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 116.593 2.072 . . . . 10.0 116.593 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.42 124.11 4.01 Favored 'General case' 0 C--N 1.317 -0.818 0 O-C-N 120.688 -1.258 . . . . 10.0 112.178 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 10.3 mttt -63.05 149.21 45.62 Favored 'General case' 0 C--O 1.221 -0.447 0 N-CA-C 105.87 -1.9 . . . . 10.0 105.87 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 1.6 p -158.28 171.06 20.88 Favored 'General case' 0 C--O 1.215 -0.741 0 N-CA-C 105.652 -1.981 . . . . 10.0 105.652 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 30.1 mtp -120.56 96.38 5.11 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 102.664 -3.087 . . . . 10.0 102.664 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 27.7 m -107.24 117.52 34.28 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 116.977 2.214 . . . . 10.0 116.977 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 51.6 m -109.09 118.44 36.78 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 106.004 -1.85 . . . . 10.0 106.004 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 53.4 t -99.77 139.09 22.16 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 N-CA-C 105.714 -1.958 . . . . 10.0 105.714 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -154.41 -174.0 4.8 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 113.867 -1.515 . . . . 10.0 113.188 179.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 64.4 p-90 -133.93 130.48 37.79 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 121.787 0.804 . . . . 10.0 108.835 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 14.8 t0 -149.31 119.35 7.18 Favored 'General case' 0 C--O 1.242 0.666 0 N-CA-C 103.444 -2.798 . . . . 10.0 103.444 179.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 88.08 13.27 64.44 Favored Glycine 0 CA--C 1.503 -0.702 0 N-CA-C 106.979 -2.449 . . . . 10.0 106.979 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 20.9 t0 72.11 5.39 5.3 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 119.269 1.535 . . . . 10.0 111.859 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.44 168.85 9.48 Favored 'General case' 0 CA--C 1.504 -0.79 0 N-CA-C 106.499 -1.667 . . . . 10.0 106.499 179.782 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -112.96 92.22 3.93 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 123.808 1.766 . . . . 10.0 106.425 179.586 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -104.45 155.87 18.42 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 114.72 -1.127 . . . . 10.0 110.446 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -145.3 170.59 16.01 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 117.601 -1.64 . . . . 10.0 108.461 -179.835 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 81.3 t -145.94 128.07 8.63 Favored 'Isoleucine or valine' 0 C--O 1.241 0.639 0 O-C-N 125.291 1.619 . . . . 10.0 107.574 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -110.89 118.94 37.47 Favored 'General case' 0 C--N 1.32 -0.695 0 O-C-N 125.041 1.463 . . . . 10.0 109.136 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 2.7 mmmt -96.17 80.58 3.26 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 122.655 1.217 . . . . 10.0 110.373 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -143.27 74.96 0.32 Allowed Glycine 0 C--N 1.338 0.652 0 CA-C-N 114.101 -1.409 . . . . 10.0 110.481 179.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 58.72 -176.12 0.08 Allowed 'General case' 0 C--O 1.234 0.241 0 N-CA-C 116.125 1.898 . . . . 10.0 116.125 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 24.9 mmtt 60.81 175.58 0.1 Allowed 'General case' 0 CA--C 1.544 0.747 0 O-C-N 125.244 1.59 . . . . 10.0 114.822 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 75.2 mt-10 -123.68 88.3 2.89 Favored 'General case' 0 C--O 1.232 0.134 0 O-C-N 125.568 1.792 . . . . 10.0 113.512 179.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 142.46 -23.39 2.36 Favored Glycine 0 C--O 1.217 -0.953 0 CA-C-O 118.258 -1.301 . . . . 10.0 116.263 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 7.0 mtp180 -47.94 130.89 15.45 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.869 0.982 . . . . 10.0 112.347 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 142.99 148.96 5.03 Favored Glycine 0 N--CA 1.439 -1.111 0 O-C-N 125.874 1.984 . . . . 10.0 109.952 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' TRP . . . . . 0.498 ' CE2' ' HE1' ' A' ' 119' ' ' MET . 2.6 m0 -112.26 171.54 7.45 Favored 'General case' 0 N--CA 1.455 -0.22 0 O-C-N 121.789 -0.83 . . . . 10.0 109.727 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 4.0 m -153.54 88.98 1.3 Allowed 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 104.106 -2.553 . . . . 10.0 104.106 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 -79.76 98.23 6.94 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 125.156 1.535 . . . . 10.0 112.9 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -105.15 130.71 53.26 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 107.218 -1.401 . . . . 10.0 107.218 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.481 HD13 ' CD1' ' A' ' 4' ' ' PHE . 15.6 mt -93.18 119.64 41.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 116.679 2.103 . . . . 10.0 116.679 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -101.5 71.85 1.37 Allowed 'General case' 0 C--O 1.223 -0.303 0 CA-C-O 123.337 1.541 . . . . 10.0 108.243 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 59.52 -103.6 0.44 Allowed Glycine 0 C--N 1.341 0.826 0 N-CA-C 109.419 -1.473 . . . . 10.0 109.419 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 17.9 p-10 -87.12 16.79 4.74 Favored 'General case' 0 N--CA 1.476 0.842 0 O-C-N 121.392 -1.063 . . . . 10.0 112.54 179.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 13.4 mt-10 -138.92 158.33 44.4 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 125.166 2.412 . . . . 10.0 110.304 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.449 HD13 ' CH2' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -118.75 121.1 39.3 Favored 'General case' 0 C--O 1.24 0.582 0 N-CA-C 105.629 -1.989 . . . . 10.0 105.629 -179.931 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 48.0 t-80 -115.18 68.03 0.7 Allowed 'General case' 0 N--CA 1.444 -0.739 0 CA-C-O 123.327 1.537 . . . . 10.0 110.828 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 9.0 tt -69.48 126.28 29.27 Favored 'General case' 0 N--CA 1.441 -0.889 0 CA-C-N 113.206 -1.815 . . . . 10.0 108.796 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -128.38 98.19 4.98 Favored 'General case' 0 CA--C 1.498 -1.047 0 CA-C-O 124.31 2.005 . . . . 10.0 107.494 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.498 ' HE1' ' CE2' ' A' ' 106' ' ' TRP . 3.1 ptp -95.09 133.64 38.68 Favored 'General case' 0 CA--C 1.515 -0.396 0 O-C-N 120.663 -1.273 . . . . 10.0 112.346 -179.904 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.97 169.1 9.25 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 117.613 -1.184 . . . . 10.0 112.388 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -177.58 116.6 0.09 Allowed 'General case' 0 C--O 1.237 0.433 0 O-C-N 125.43 1.706 . . . . 10.0 106.604 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 67.91 31.56 5.61 Favored 'General case' 0 C--O 1.245 0.865 0 CA-C-O 123.354 1.55 . . . . 10.0 114.344 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 78.83 -3.81 63.3 Favored Glycine 0 CA--C 1.526 0.747 0 O-C-N 120.049 -1.657 . . . . 10.0 113.178 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 49.1 t -95.85 121.68 46.63 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 N-CA-C 105.924 -1.88 . . . . 10.0 105.924 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 4.9 m -104.4 117.47 34.26 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-O 122.407 1.099 . . . . 10.0 112.164 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 4.2 t -103.4 128.03 50.62 Favored 'General case' 0 C--O 1.214 -0.777 0 C-N-CA 126.039 1.736 . . . . 10.0 107.538 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.42 155.08 47.94 Favored 'General case' 0 C--O 1.218 -0.572 0 C-N-CA 119.098 -1.041 . . . . 10.0 111.457 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -136.22 135.54 39.16 Favored 'General case' 0 N--CA 1.439 -1.02 0 N-CA-C 113.146 0.795 . . . . 10.0 113.146 179.869 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -86.23 103.19 12.58 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 CA-C-N 114.2 -1.364 . . . . 10.0 107.676 179.601 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . 0.507 ' CD1' ' HB3' ' A' ' 8' ' ' TRP . 0.7 OUTLIER -93.52 165.58 12.68 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 118.109 -0.948 . . . . 10.0 109.096 -179.86 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 13.5 tptp -133.02 134.87 45.0 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 125.94 2.025 . . . . 10.0 108.543 179.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 15.4 tptm -88.49 131.46 34.89 Favored 'General case' 0 CA--C 1.512 -0.493 0 CA-C-N 114.603 -1.181 . . . . 10.0 109.487 -179.677 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 28.3 t -109.8 -48.42 6.94 Favored 'Isoleucine or valine' 0 C--O 1.243 0.75 0 O-C-N 125.876 1.985 . . . . 10.0 109.075 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 6.2 t-80 . . . . . 0 N--CA 1.438 -1.05 0 CA-C-N 112.84 -1.982 . . . . 10.0 114.17 -179.806 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.484 0.938 0 CA-C-O 124.09 1.621 . . . . 10.0 113.289 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 14.4 m -106.21 67.21 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 114.383 -1.28 . . . . 10.0 111.722 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -128.95 51.46 2.04 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 123.512 1.625 . . . . 10.0 109.983 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 63.21 -43.32 0.21 Allowed 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 117.11 2.263 . . . . 10.0 117.11 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 42.7 t-20 -40.25 106.39 0.05 Allowed 'General case' 0 C--N 1.319 -0.744 0 C-N-CA 125.455 1.502 . . . . 10.0 114.916 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -165.45 -127.17 0.87 Allowed Glycine 0 N--CA 1.468 0.796 0 N-CA-C 116.61 1.404 . . . . 10.0 116.61 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -167.15 122.98 1.11 Allowed 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 102.664 -3.087 . . . . 10.0 102.664 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.418 ' HB3' ' CD1' ' A' ' 130' ' ' PHE . 40.9 m0 -106.77 107.69 18.83 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 117.75 -1.119 . . . . 10.0 109.345 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 20.0 pttt -97.4 108.34 21.05 Favored 'General case' 0 C--O 1.216 -0.683 0 N-CA-C 105.589 -2.004 . . . . 10.0 105.589 179.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.17 166.84 0.09 Allowed 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 115.602 1.704 . . . . 10.0 115.602 -179.868 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.3 tt -126.12 -63.88 1.08 Allowed 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 105.18 -2.156 . . . . 10.0 105.18 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 77.4 p -144.64 155.89 43.84 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 124.654 1.182 . . . . 10.0 113.891 179.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -129.35 155.7 45.21 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 125.392 1.682 . . . . 10.0 106.647 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.8 pm0 -144.81 146.88 32.31 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 116.821 2.156 . . . . 10.0 116.821 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.1 m120 54.85 16.47 1.45 Allowed 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 114.571 1.323 . . . . 10.0 114.571 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -59.17 -36.79 75.92 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 116.015 1.858 . . . . 10.0 116.015 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.38 -34.77 61.14 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-N 119.419 1.009 . . . . 10.0 111.62 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -73.55 -27.39 61.31 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 107.846 -1.168 . . . . 10.0 107.846 179.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -65.15 -42.52 93.72 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 124.994 1.317 . . . . 10.0 111.024 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.449 HD13 ' CB ' ' A' ' 33' ' ' ALA . 24.4 mt -75.11 -25.52 58.56 Favored 'General case' 0 N--CA 1.478 0.946 0 O-C-N 121.797 -0.564 . . . . 10.0 109.576 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 57.1 ttt180 -67.79 -27.66 66.93 Favored 'General case' 0 C--O 1.242 0.708 0 C-N-CA 124.582 1.153 . . . . 10.0 110.735 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.51 -42.33 71.43 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.08 1.352 . . . . 10.0 110.096 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 32.6 mt -76.99 -13.47 59.96 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 122.312 1.053 . . . . 10.0 109.741 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 29.7 m-20 45.46 39.67 4.86 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.575 1.15 . . . . 10.0 111.483 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.448 ' CG2' ' HA ' ' A' ' 78' ' ' ASP . 1.2 t -57.15 -63.54 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 O-C-N 127.428 2.955 . . . . 10.0 104.692 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -167.75 161.35 13.25 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.303 0.853 . . . . 10.0 113.303 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 2.9 t -78.51 -33.14 16.85 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 N-CA-C 114.633 1.345 . . . . 10.0 114.633 -179.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -74.67 -32.34 62.19 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.003 -0.999 . . . . 10.0 112.634 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.5 tp -78.84 -21.47 47.57 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 122.021 0.915 . . . . 10.0 113.306 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 15.7 ttm180 -74.46 -31.31 62.19 Favored 'General case' 0 C--O 1.22 -0.491 0 O-C-N 119.605 -1.935 . . . . 10.0 111.311 -179.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.2 tttp -77.95 -39.03 43.95 Favored 'General case' 0 C--O 1.225 -0.19 0 CA-C-N 114.137 -1.392 . . . . 10.0 110.209 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 10.7 mm -75.29 -46.41 38.54 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 CA-C-N 114.278 -1.328 . . . . 10.0 109.913 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.449 ' CB ' HD13 ' A' ' 20' ' ' LEU . . . -67.21 -21.07 65.78 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 115.623 1.712 . . . . 10.0 115.623 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -71.1 -45.69 63.19 Favored 'General case' 0 N--CA 1.443 -0.819 0 N-CA-C 114.886 1.439 . . . . 10.0 114.886 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.3 pp -59.04 -21.84 59.74 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 113.627 0.973 . . . . 10.0 113.627 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -69.23 159.03 33.8 Favored 'General case' 0 C--O 1.217 -0.63 0 O-C-N 124.116 0.885 . . . . 10.0 112.348 -179.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 7.6 mttp -146.28 107.29 4.16 Favored Pre-proline 0 C--N 1.322 -0.593 0 N-CA-C 103.662 -2.718 . . . . 10.0 103.662 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -89.13 104.35 0.39 Allowed 'Trans proline' 0 C--N 1.354 0.868 0 N-CA-C 118.8 2.577 . . . . 10.0 118.8 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -81.28 136.01 35.76 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 103.536 -2.764 . . . . 10.0 103.536 178.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 12.0 mtpp -118.66 142.51 47.59 Favored 'General case' 0 C--N 1.31 -1.141 0 C-N-CA 118.846 -1.142 . . . . 10.0 112.153 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -120.98 116.77 25.72 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 102.706 -3.072 . . . . 10.0 102.706 179.76 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 29.9 mt -110.66 136.26 47.22 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.058 0 CA-C-O 124.653 2.168 . . . . 10.0 111.062 -179.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 83.7 t -131.53 124.35 54.29 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.875 0 N-CA-C 105.095 -2.187 . . . . 10.0 105.095 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 -108.86 165.13 11.79 Favored 'General case' 0 C--O 1.215 -0.733 0 CA-C-N 114.733 -1.121 . . . . 10.0 109.596 179.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -145.4 -146.81 0.2 Allowed 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 104.525 -2.398 . . . . 10.0 104.525 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -84.81 91.85 1.71 Allowed Glycine 0 CA--C 1.527 0.8 0 N-CA-C 105.993 -2.843 . . . . 10.0 105.993 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 62.02 20.34 11.51 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 124.481 0.754 . . . . 10.0 112.311 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 4.9 t-160 -125.75 103.52 7.85 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 105.413 -2.069 . . . . 10.0 105.413 -179.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 2.8 ttp -109.87 107.21 17.07 Favored 'General case' 0 C--O 1.216 -0.686 0 CA-C-N 112.723 -2.035 . . . . 10.0 116.028 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 3.3 mp -88.97 146.8 5.73 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 C-N-CA 125.824 1.65 . . . . 10.0 107.858 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.8 mp -133.87 133.12 56.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 O-C-N 124.582 1.176 . . . . 10.0 108.065 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 21.1 mtt-85 -124.14 127.58 48.0 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-O 117.798 -1.096 . . . . 10.0 113.199 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 12.7 m -114.63 94.85 4.96 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 102.814 -3.032 . . . . 10.0 102.814 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 58.0 mt -82.87 100.06 10.12 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 120.554 3.539 . . . . 10.0 120.554 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 48.9 p -122.82 -139.88 0.31 Allowed 'General case' 0 C--N 1.319 -0.759 0 O-C-N 126.168 2.167 . . . . 10.0 108.028 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -139.1 -38.36 0.5 Allowed 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 119.212 0.915 . . . . 10.0 111.86 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -54.76 -81.16 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 123.048 1.404 . . . . 10.0 110.507 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 3.2 mmp_? -110.47 -25.67 9.92 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 116.767 -1.587 . . . . 10.0 113.847 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 5.2 m120 56.83 85.31 0.08 Allowed 'General case' 0 CA--C 1.537 0.477 0 O-C-N 126.41 2.319 . . . . 10.0 108.352 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -56.16 117.83 4.12 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 107.007 -1.479 . . . . 10.0 107.007 -179.548 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.6 mt -128.1 114.29 34.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 CA-C-N 113.798 -1.546 . . . . 10.0 111.454 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 3.2 mtm -121.27 172.39 8.04 Favored 'General case' 0 C--O 1.214 -0.795 0 N-CA-C 104.716 -2.327 . . . . 10.0 104.716 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -163.23 128.6 3.11 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 104.904 -2.258 . . . . 10.0 104.904 179.553 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 -135.02 178.63 6.88 Favored 'General case' 0 CA--C 1.515 -0.366 0 N-CA-C 114.142 1.164 . . . . 10.0 114.142 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -129.44 100.51 5.58 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 126.868 2.605 . . . . 10.0 105.457 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.1 t -43.95 146.59 0.32 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.594 0 O-C-N 125.879 1.987 . . . . 10.0 110.419 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 56.42 63.74 5.04 Favored Glycine 0 CA--C 1.526 0.78 0 CA-C-N 114.077 -1.42 . . . . 10.0 113.03 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.12 166.57 2.4 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 125.011 2.338 . . . . 10.0 116.22 -179.758 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -87.5 133.96 33.68 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 113.444 -1.707 . . . . 10.0 110.783 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -145.69 112.51 5.99 Favored 'General case' 0 C--N 1.318 -0.777 0 O-C-N 125.301 1.625 . . . . 10.0 114.1 -179.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 17.9 pt-20 -76.6 135.66 39.21 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 105.13 -2.174 . . . . 10.0 105.13 -179.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -99.9 -34.92 9.92 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 122.44 1.114 . . . . 10.0 112.511 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 75.83 -60.48 0.49 Allowed 'General case' 0 C--O 1.221 -0.418 0 CA-C-N 114.235 -1.348 . . . . 10.0 108.614 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 61.77 33.57 17.77 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 116.689 2.107 . . . . 10.0 116.689 179.807 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -59.44 125.2 22.67 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-O 123.144 1.45 . . . . 10.0 109.158 -179.863 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 75.33 133.41 0.36 Allowed Glycine 0 C--O 1.223 -0.554 0 CA-C-O 118.336 -1.258 . . . . 10.0 110.413 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.8 mt 92.02 20.49 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 O-C-N 126.448 1.911 . . . . 10.0 108.711 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.448 ' HA ' ' CG2' ' A' ' 25' ' ' VAL . 18.4 t70 143.32 -33.84 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.74 0 O-C-N 128.659 3.724 . . . . 10.0 114.098 179.826 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 50.48 52.85 14.0 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 124.121 0.968 . . . . 10.0 112.967 -179.648 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.5 -67.65 0.57 Allowed 'General case' 0 N--CA 1.467 0.407 0 O-C-N 119.49 -2.006 . . . . 10.0 114.094 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 88.56 118.74 0.03 OUTLIER 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 102.876 -3.009 . . . . 10.0 102.876 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 4.6 p -147.4 171.25 15.77 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 123.433 1.587 . . . . 10.0 110.246 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.09 71.75 0.87 Allowed 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 100.287 -3.968 . . . . 10.0 100.287 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' THR . . . . . 0.408 HG22 ' N ' ' A' ' 85' ' ' THR . 6.3 m -76.77 139.53 40.43 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 118.315 2.709 . . . . 10.0 118.315 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.408 ' N ' HG22 ' A' ' 84' ' ' THR . 1.9 m -124.97 129.27 50.01 Favored 'General case' 0 C--O 1.244 0.77 0 O-C-N 125.475 1.734 . . . . 10.0 107.421 -179.857 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -101.86 159.19 4.24 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.989 0 N-CA-C 104.773 -2.306 . . . . 10.0 104.773 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.4 t -145.99 167.76 22.54 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 122.75 1.262 . . . . 10.0 110.837 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 11.1 p90 -124.32 122.61 38.18 Favored 'General case' 0 C--O 1.239 0.534 0 CA-C-N 112.815 -1.993 . . . . 10.0 107.177 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -88.97 172.52 9.07 Favored 'General case' 0 C--N 1.312 -1.053 1 N-CA-C 98.593 -4.595 . . . . 10.0 98.593 179.985 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -65.87 -27.78 73.07 Favored Glycine 0 CA--C 1.496 -1.156 0 N-CA-C 108.448 -1.861 . . . . 10.0 108.448 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 44.0 p-10 -145.66 25.88 1.3 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 118.89 1.345 . . . . 10.0 111.897 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 2.1 mtmt -153.03 -157.11 0.76 Allowed 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 108.3 -1.0 . . . . 10.0 108.3 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 4.4 tp -165.27 136.48 3.99 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 106.257 -1.757 . . . . 10.0 106.257 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -132.38 156.72 46.15 Favored 'General case' 0 CA--C 1.508 -0.655 0 N-CA-C 114.623 1.342 . . . . 10.0 114.623 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -133.72 145.25 49.7 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 123.129 1.442 . . . . 10.0 111.439 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 3.8 t -138.52 153.57 26.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 114.132 -1.395 . . . . 10.0 108.908 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -148.5 152.76 37.44 Favored 'General case' 0 C--O 1.246 0.878 0 CA-C-O 122.355 1.074 . . . . 10.0 108.365 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 2.8 mttp -117.62 83.54 2.01 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 114.61 -1.177 . . . . 10.0 110.122 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -152.96 87.07 0.13 Allowed Glycine 0 C--N 1.315 -0.604 0 C-N-CA 119.174 -1.489 . . . . 10.0 110.133 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 42.61 -154.81 0.02 OUTLIER 'General case' 0 C--O 1.246 0.888 0 N-CA-C 116.968 2.21 . . . . 10.0 116.968 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.401 ' N ' ' CD ' ' A' ' 101' ' ' LYS . 0.0 OUTLIER 62.66 166.65 0.12 Allowed 'General case' 0 C--O 1.217 -0.642 0 CA-C-O 124.089 1.899 . . . . 10.0 112.552 179.759 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -100.13 4.9 44.8 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-N 112.646 -2.07 . . . . 10.0 114.451 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 170.48 58.13 0.04 OUTLIER Glycine 0 C--N 1.319 -0.373 0 N-CA-C 120.02 2.768 . . . . 10.0 120.02 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.464 ' H ' ' NE ' ' A' ' 104' ' ' ARG . 0.0 OUTLIER -86.59 161.88 18.28 Favored 'General case' 0 N--CA 1.441 -0.88 0 O-C-N 125.034 1.079 . . . . 10.0 109.44 -179.943 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 127.55 154.94 8.62 Favored Glycine 0 N--CA 1.435 -1.402 0 C-N-CA 120.624 -0.798 . . . . 10.0 111.457 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -118.77 154.64 32.48 Favored 'General case' 0 CA--C 1.506 -0.734 0 C-N-CA 124.442 1.097 . . . . 10.0 110.502 -179.776 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.1 m -131.88 139.79 48.89 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-O 123.697 1.713 . . . . 10.0 107.864 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -120.94 125.31 47.1 Favored 'General case' 0 C--O 1.246 0.917 0 CA-C-N 113.249 -1.796 . . . . 10.0 108.608 -179.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 5.5 t-105 -132.27 137.03 47.34 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 106.839 -1.541 . . . . 10.0 106.839 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 2.1 mt -111.26 140.85 28.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 O-C-N 126.352 2.283 . . . . 10.0 117.022 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -123.82 170.56 10.42 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 104.103 -2.554 . . . . 10.0 104.103 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -33.95 -80.0 0.02 OUTLIER Glycine 0 C--O 1.241 0.59 0 O-C-N 128.152 3.407 . . . . 10.0 111.159 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -115.42 15.53 16.77 Favored 'General case' 0 CA--C 1.555 1.143 0 CA-C-N 120.157 1.978 . . . . 10.0 108.776 179.737 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -126.9 154.51 44.35 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 124.547 2.117 . . . . 10.0 112.516 -179.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.443 ' CB ' ' HB2' ' A' ' 130' ' ' PHE . 0.2 OUTLIER -113.42 127.55 56.15 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 111.715 -2.493 . . . . 10.0 106.525 179.863 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -110.87 79.64 1.22 Allowed 'General case' 0 C--O 1.217 -0.656 0 CA-C-O 122.305 1.05 . . . . 10.0 111.785 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 1.7 tp -80.27 148.24 30.85 Favored 'General case' 0 C--O 1.218 -0.582 0 CA-C-O 124.417 2.056 . . . . 10.0 113.493 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.441 ' HA ' ' HB3' ' A' ' 127' ' ' LYS . 0.0 OUTLIER -142.89 136.33 28.53 Favored 'General case' 0 C--O 1.219 -0.54 0 O-C-N 119.594 -1.941 . . . . 10.0 107.264 -179.835 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 7.5 mtp -138.48 151.08 47.07 Favored 'General case' 0 CA--C 1.51 -0.589 0 CA-C-O 122.941 1.353 . . . . 10.0 108.111 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 2.8 mtt-85 -143.58 166.48 24.71 Favored 'General case' 0 CA--C 1.512 -0.512 0 O-C-N 119.852 -1.78 . . . . 10.0 112.338 -179.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 178.57 122.66 0.05 OUTLIER 'General case' 0 CA--C 1.503 -0.848 0 CA-C-N 114.418 -1.264 . . . . 10.0 109.212 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 50.92 41.19 26.68 Favored 'General case' 0 C--O 1.244 0.791 0 O-C-N 125.96 2.037 . . . . 10.0 115.947 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 84.12 -7.37 71.55 Favored Glycine 0 C--N 1.341 0.811 0 O-C-N 124.646 1.216 . . . . 10.0 115.165 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 12.7 t -91.31 126.85 43.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 CA-C-O 117.642 -1.17 . . . . 10.0 111.409 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 85.6 m -111.86 111.35 22.24 Favored 'General case' 0 N--CA 1.441 -0.904 0 O-C-N 126.725 2.516 . . . . 10.0 115.83 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 1.4 t -110.07 156.39 20.61 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 104.996 -2.224 . . . . 10.0 104.996 -179.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . 0.441 ' HB3' ' HA ' ' A' ' 118' ' ' GLU . 0.0 OUTLIER -168.07 177.92 5.32 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 123.306 1.527 . . . . 10.0 110.163 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -149.83 150.42 31.95 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 112.789 -2.005 . . . . 10.0 114.092 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 28.1 t -111.32 115.66 50.45 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.788 0 N-CA-C 105.199 -2.149 . . . . 10.0 105.199 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . 0.443 ' HB2' ' CB ' ' A' ' 115' ' ' LEU . 55.1 m-85 -110.39 162.55 14.55 Favored 'General case' 0 CA--C 1.51 -0.573 0 O-C-N 125.584 1.802 . . . . 10.0 111.809 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.45 115.22 17.18 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 105.879 -1.897 . . . . 10.0 105.879 179.866 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 9.9 tttp -76.45 116.78 17.46 Favored 'General case' 0 C--O 1.216 -0.675 0 O-C-N 125.524 1.765 . . . . 10.0 108.506 -179.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.63 -37.39 77.55 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.678 0 CA-C-N 114.127 -1.397 . . . . 10.0 112.117 -179.741 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 . . . . . 0 N--CA 1.446 -0.641 0 CA-C-O 117.195 -1.384 . . . . 10.0 107.86 179.849 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo . . . . . 0 CA--C 1.538 0.675 0 CA-C-O 123.116 1.215 . . . . 10.0 112.714 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -109.3 17.14 7.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 C-N-CA 124.297 1.039 . . . . 10.0 110.017 -179.901 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -72.04 145.45 48.26 Favored 'General case' 0 C--O 1.238 0.497 0 CA-C-O 123.167 1.46 . . . . 10.0 111.419 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.498 ' CE1' HD13 ' A' ' 110' ' ' ILE . 57.0 m-85 -96.5 -28.23 14.5 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 116.899 2.185 . . . . 10.0 116.899 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 47.0 p-10 -64.48 139.79 58.8 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 117.985 2.587 . . . . 10.0 117.985 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -174.23 -130.57 1.3 Allowed Glycine 0 N--CA 1.452 -0.267 0 N-CA-C 117.179 1.632 . . . . 10.0 117.179 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -160.84 98.15 1.19 Allowed 'General case' 0 C--O 1.239 0.533 0 N-CA-C 105.709 -1.96 . . . . 10.0 105.709 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.508 ' CZ3' ' HG2' ' A' ' 132' ' ' LYS . 0.8 OUTLIER -90.15 139.64 30.43 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 116.253 -1.832 . . . . 10.0 107.697 179.9 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -123.04 8.88 9.28 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 125.09 1.494 . . . . 10.0 111.481 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.402 ' HE3' ' HB3' ' A' ' 13' ' ' ASN . 0.0 OUTLIER 61.77 135.09 0.01 OUTLIER 'General case' 0 C--N 1.309 -1.163 0 O-C-N 126.718 2.511 . . . . 10.0 117.527 179.101 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.5 tp -113.05 -56.08 2.45 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 107.854 -1.165 . . . . 10.0 107.854 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.1 p -154.01 -178.25 6.96 Favored 'General case' 0 C--O 1.242 0.679 0 N-CA-C 115.522 1.675 . . . . 10.0 115.522 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . 0.402 ' HB3' ' HE3' ' A' ' 10' ' ' MET . 8.4 p30 -154.17 164.02 39.18 Favored 'General case' 0 C--O 1.238 0.457 0 N-CA-C 105.002 -2.222 . . . . 10.0 105.002 -179.484 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -156.02 18.6 0.37 Allowed 'General case' 0 C--O 1.234 0.237 0 O-C-N 118.545 -2.597 . . . . 10.0 114.658 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -163.01 26.52 0.09 Allowed 'General case' 0 C--O 1.241 0.651 0 O-C-N 125.34 1.65 . . . . 10.0 114.332 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -62.75 -52.59 62.61 Favored 'General case' 0 C--O 1.243 0.718 0 C-N-CA 124.627 1.171 . . . . 10.0 113.71 -179.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.0 tm-20 -69.01 -34.13 74.77 Favored 'General case' 0 CA--C 1.511 -0.557 0 N-CA-C 115.151 1.537 . . . . 10.0 115.151 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -77.0 -23.3 52.25 Favored 'General case' 0 C--N 1.32 -0.715 0 O-C-N 124.91 1.381 . . . . 10.0 108.034 -179.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -78.1 -32.59 50.63 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 107.994 -1.113 . . . . 10.0 107.994 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 81.8 mt -75.9 -30.4 58.77 Favored 'General case' 0 C--O 1.217 -0.656 0 O-C-N 119.926 -1.733 . . . . 10.0 111.876 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.2 ttm180 -68.96 -27.09 65.42 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 124.11 0.964 . . . . 10.0 110.245 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.26 -49.01 54.24 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.189 1.795 . . . . 10.0 109.308 -179.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.6 mt -74.9 -15.47 60.7 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 125.915 2.009 . . . . 10.0 111.793 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 69.15 28.94 4.84 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 115.396 1.628 . . . . 10.0 115.396 -179.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 6.1 m -62.0 178.12 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 N-CA-C 107.675 -1.231 . . . . 10.0 107.675 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -62.32 152.07 34.83 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 116.327 1.973 . . . . 10.0 116.327 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 14.8 p -70.74 -32.29 48.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 N-CA-C 115.072 1.508 . . . . 10.0 115.072 179.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -73.72 -25.04 60.01 Favored 'General case' 0 C--O 1.243 0.725 0 O-C-N 124.989 1.431 . . . . 10.0 109.171 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -73.99 -50.48 19.69 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-N 114.024 -1.444 . . . . 10.0 108.826 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.49 -25.37 68.23 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 125.145 1.378 . . . . 10.0 113.491 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -73.92 -44.84 53.78 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 113.166 -1.833 . . . . 10.0 112.12 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.7 mm -69.31 -54.85 17.67 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 O-C-N 120.093 -1.629 . . . . 10.0 110.755 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -45.57 -28.13 0.89 Allowed 'General case' 0 C--O 1.216 -0.696 0 N-CA-C 115.874 1.805 . . . . 10.0 115.874 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 13.9 t-20 -86.15 -2.47 58.38 Favored 'General case' 0 N--CA 1.44 -0.968 0 O-C-N 119.995 -1.691 . . . . 10.0 113.908 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 15.7 mt -104.43 -20.15 13.81 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 108.942 -0.762 . . . . 10.0 108.942 179.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -128.29 173.66 9.96 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 113.422 0.897 . . . . 10.0 113.422 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 6.5 ptpt -151.32 155.19 34.46 Favored Pre-proline 0 N--CA 1.478 0.949 0 N-CA-C 104.236 -2.505 . . . . 10.0 104.236 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo -101.74 162.56 0.35 Allowed 'Trans proline' 0 N--CA 1.459 -0.547 1 C-N-CA 126.799 4.999 . . . . 10.0 116.672 -179.803 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -110.42 -175.86 2.83 Favored 'General case' 0 C--O 1.239 0.55 0 N-CA-C 104.927 -2.249 . . . . 10.0 104.927 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.76 140.78 11.1 Favored 'General case' 0 C--N 1.309 -1.153 0 O-C-N 120.517 -1.364 . . . . 10.0 111.73 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -132.16 135.84 46.66 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 105.225 -2.139 . . . . 10.0 105.225 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.419 HG13 ' NE1' ' A' ' 8' ' ' TRP . 0.9 OUTLIER -121.52 141.21 42.92 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.026 0 N-CA-C 109.265 -0.642 . . . . 10.0 109.265 -179.926 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.5 t -137.86 135.35 45.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 105.791 -1.929 . . . . 10.0 105.791 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -126.47 113.3 16.65 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 121.482 0.658 . . . . 10.0 109.85 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -82.08 -17.57 46.09 Favored 'General case' 0 C--O 1.219 -0.543 0 N-CA-C 106.757 -1.572 . . . . 10.0 106.757 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 140.44 -110.67 0.69 Allowed Glycine 0 CA--C 1.521 0.451 0 N-CA-C 107.619 -2.192 . . . . 10.0 107.619 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 60.0 m-20 -71.24 -13.54 61.94 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 119.299 -2.294 . . . . 10.0 108.541 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 31.7 m170 -109.78 144.83 37.66 Favored 'General case' 0 N--CA 1.439 -0.997 0 N-CA-C 105.372 -2.084 . . . . 10.0 105.372 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 16.5 ttt -133.14 154.95 50.13 Favored 'General case' 0 C--N 1.317 -0.812 0 O-C-N 125.807 1.942 . . . . 10.0 111.592 179.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.405 ' N ' HD12 ' A' ' 50' ' ' ILE . 4.6 mp -142.26 132.11 23.49 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.058 0 N-CA-C 107.161 -1.422 . . . . 10.0 107.161 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -120.24 125.56 74.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 CA-C-O 117.355 -1.307 . . . . 10.0 108.785 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.5 ptp180 -115.83 128.59 55.94 Favored 'General case' 0 C--O 1.221 -0.413 0 O-C-N 126.058 2.099 . . . . 10.0 108.27 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.467 ' HB ' ' CB ' ' A' ' 60' ' ' TYR . 76.9 m -123.99 113.07 17.95 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 104.861 -2.274 . . . . 10.0 104.861 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.407 HD22 ' N ' ' A' ' 54' ' ' LEU . 2.5 mm? -119.51 140.3 50.71 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 119.52 3.156 . . . . 10.0 119.52 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -165.29 28.16 0.06 Allowed 'General case' 0 N--CA 1.445 -0.704 0 N-CA-C 109.273 -0.64 . . . . 10.0 109.273 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 9.0 m 44.14 48.21 7.58 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 112.647 0.61 . . . . 10.0 112.647 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -159.98 -70.89 0.07 Allowed 'General case' 0 C--O 1.247 0.946 0 N-CA-C 105.849 -1.908 . . . . 10.0 105.849 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.11 118.26 34.25 Favored 'General case' 0 C--O 1.245 0.836 0 CA-C-N 113.628 -1.624 . . . . 10.0 109.74 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -102.53 102.34 12.6 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.745 0.784 . . . . 10.0 109.914 179.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.467 ' CB ' ' HB ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -87.34 107.76 18.67 Favored 'General case' 0 C--O 1.212 -0.88 0 N-CA-C 105.33 -2.1 . . . . 10.0 105.33 -179.698 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 5.2 mt -135.84 141.48 41.82 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 CA-C-O 122.463 1.125 . . . . 10.0 111.312 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 28.3 mmt -149.57 178.16 9.09 Favored 'General case' 0 CA--C 1.505 -0.76 0 N-CA-C 104.549 -2.389 . . . . 10.0 104.549 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 58.6 m-20 -142.16 69.46 1.32 Allowed 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 102.638 -3.097 . . . . 10.0 102.638 -179.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.413 ' CD2' HG13 ' A' ' 86' ' ' VAL . 6.0 m-30 -70.58 146.12 50.31 Favored 'General case' 0 C--O 1.243 0.732 0 N-CA-C 115.398 1.629 . . . . 10.0 115.398 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -116.93 120.79 39.53 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 107.046 -1.465 . . . . 10.0 107.046 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 43.9 t -65.04 100.95 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.723 0 C-N-CA 123.942 0.897 . . . . 10.0 110.871 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 94.61 68.3 1.04 Allowed Glycine 0 C--O 1.221 -0.695 0 O-C-N 127.868 3.23 . . . . 10.0 112.027 -179.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -167.3 136.46 2.73 Favored 'General case' 0 C--O 1.231 0.091 0 O-C-N 119.472 -2.193 . . . . 10.0 114.851 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -84.57 136.06 33.94 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 118.485 -1.286 . . . . 10.0 111.311 179.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 44.2 p90 -158.62 128.37 5.79 Favored 'General case' 0 C--N 1.322 -0.617 0 O-C-N 120.612 -1.305 . . . . 10.0 109.268 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -61.9 155.14 24.21 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 123.719 1.723 . . . . 10.0 110.902 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 14.8 tp10 -120.95 67.49 0.86 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 113.139 -1.846 . . . . 10.0 113.564 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -68.97 71.82 0.24 Allowed 'General case' 0 C--N 1.316 -0.85 0 C-N-CA 125.395 1.478 . . . . 10.0 107.107 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -76.58 137.16 39.35 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 114.082 -1.417 . . . . 10.0 113.721 -179.807 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 51.0 p -152.78 50.91 0.75 Allowed 'General case' 0 C--O 1.242 0.707 0 N-CA-C 106.165 -1.791 . . . . 10.0 106.165 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -128.91 -59.18 0.11 Allowed Glycine 0 N--CA 1.435 -1.425 0 O-C-N 125.266 1.604 . . . . 10.0 112.417 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 46.3 mt -112.46 -87.15 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.539 0 O-C-N 124.667 0.863 . . . . 10.0 109.692 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -81.26 3.82 22.61 Favored 'General case' 0 CA--C 1.51 -0.566 0 N-CA-C 115.298 1.592 . . . . 10.0 115.298 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.8 p30 44.68 -155.76 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 114.545 1.313 . . . . 10.0 114.545 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 72.84 130.77 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 119.477 1.035 . . . . 10.0 111.841 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 6.3 ttpm? -87.73 122.45 31.41 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 104.783 -2.303 . . . . 10.0 104.783 -179.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -121.59 172.4 8.13 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 107.601 -1.259 . . . . 10.0 107.601 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' MET . . . . . 0.413 ' CB ' ' HB2' ' A' ' 98' ' ' LYS . 0.0 OUTLIER -116.48 126.6 53.6 Favored 'General case' 0 CA--C 1.512 -0.498 1 N-CA-C 98.902 -4.481 . . . . 10.0 98.902 -179.954 . . . . . . . . 4 4 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 33.9 m -127.1 140.11 52.5 Favored 'General case' 0 C--N 1.311 -1.097 0 O-C-N 121.189 -0.945 . . . . 10.0 113.513 -179.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 2.1 m -126.82 101.54 6.64 Favored 'General case' 0 C--N 1.316 -0.872 0 O-C-N 125.052 1.47 . . . . 10.0 109.345 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.413 HG13 ' CD2' ' A' ' 64' ' ' PHE . 1.3 m -81.97 138.13 20.01 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.954 0 N-CA-C 101.332 -3.581 . . . . 10.0 101.332 179.864 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 13.7 t -145.89 167.13 24.0 Favored 'General case' 0 C--N 1.317 -0.84 0 C-N-CA 119.364 -0.935 . . . . 10.0 111.037 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 5.7 t90 -97.28 129.23 44.61 Favored 'General case' 0 C--N 1.314 -0.956 0 O-C-N 125.707 1.879 . . . . 10.0 106.554 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -139.85 98.0 3.37 Favored 'General case' 0 CA--C 1.505 -0.771 0 N-CA-C 101.519 -3.512 . . . . 10.0 101.519 -179.773 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 52.19 -130.77 37.43 Favored Glycine 0 N--CA 1.437 -1.29 0 N-CA-C 104.762 -3.335 . . . . 10.0 104.762 179.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -89.37 24.23 2.29 Favored 'General case' 0 N--CA 1.446 -0.628 0 O-C-N 124.288 0.64 . . . . 10.0 112.205 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.7 167.42 12.07 Favored 'General case' 0 CA--C 1.508 -0.641 0 CA-C-O 121.601 0.715 . . . . 10.0 110.651 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -125.05 99.64 6.21 Favored 'General case' 0 C--O 1.241 0.635 0 N-CA-C 102.85 -3.018 . . . . 10.0 102.85 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 18.4 mm-40 -85.76 137.0 33.1 Favored 'General case' 0 CA--C 1.503 -0.851 0 O-C-N 124.756 1.285 . . . . 10.0 113.188 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 7.1 t -137.94 123.86 20.11 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 108.33 -0.989 . . . . 10.0 108.33 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 16.1 t -133.93 117.12 25.03 Favored 'Isoleucine or valine' 0 C--O 1.245 0.84 0 CA-C-N 112.939 -1.937 . . . . 10.0 109.256 -179.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 17.3 mt-30 -90.54 143.23 26.95 Favored 'General case' 0 C--O 1.243 0.758 0 N-CA-C 107.235 -1.394 . . . . 10.0 107.235 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.413 ' HB2' ' CB ' ' A' ' 83' ' ' MET . 0.6 OUTLIER -85.18 17.07 3.17 Favored 'General case' 0 CA--C 1.508 -0.643 0 O-C-N 124.249 0.968 . . . . 10.0 113.255 179.973 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -77.79 -178.08 48.05 Favored Glycine 0 N--CA 1.435 -1.37 0 C-N-CA 118.231 -1.937 . . . . 10.0 109.816 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -70.76 164.06 25.95 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 113.681 0.993 . . . . 10.0 113.681 -179.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 15.0 mttm 82.95 -179.91 0.05 Allowed 'General case' 0 CA--C 1.54 0.575 0 O-C-N 125.773 1.921 . . . . 10.0 112.401 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -108.17 130.76 55.11 Favored 'General case' 0 C--O 1.223 -0.301 0 O-C-N 124.76 1.288 . . . . 10.0 112.306 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 106.09 -20.55 35.47 Favored Glycine 0 C--O 1.215 -1.057 0 N-CA-C 118.338 2.095 . . . . 10.0 118.338 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 10.2 mtt180 -40.98 116.35 0.71 Allowed 'General case' 0 C--N 1.327 -0.407 0 O-C-N 125.956 1.621 . . . . 10.0 110.999 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 125.74 170.95 13.11 Favored Glycine 0 C--O 1.218 -0.898 0 N-CA-C 107.933 -2.067 . . . . 10.0 107.933 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -130.92 174.72 9.71 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 123.036 1.398 . . . . 10.0 110.038 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 48.6 m -130.97 133.69 46.03 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 104.672 -2.344 . . . . 10.0 104.672 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -122.08 125.73 46.86 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 118.254 -0.879 . . . . 10.0 110.699 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' TRP . . . . . 0.496 ' CD1' ' C ' ' A' ' 109' ' ' TRP . 0.0 OUTLIER -138.45 145.14 40.53 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 126.097 2.123 . . . . 10.0 106.74 -179.98 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.498 HD13 ' CE1' ' A' ' 4' ' ' PHE . 4.7 mt -105.36 137.9 32.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 124.184 1.945 . . . . 10.0 115.646 179.718 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -104.45 165.95 10.72 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 104.611 -2.366 . . . . 10.0 104.611 179.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -39.55 -73.07 0.19 Allowed Glycine 0 N--CA 1.448 -0.521 0 O-C-N 126.015 2.072 . . . . 10.0 111.414 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -122.46 35.98 4.75 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 121.576 0.703 . . . . 10.0 110.248 -179.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -150.45 164.12 36.69 Favored 'General case' 0 C--O 1.241 0.62 0 O-C-N 119.402 -2.061 . . . . 10.0 109.722 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -119.2 120.99 38.68 Favored 'General case' 0 C--N 1.314 -0.965 0 N-CA-C 104.351 -2.463 . . . . 10.0 104.351 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -119.0 91.1 3.47 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 119.348 0.976 . . . . 10.0 108.517 179.85 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 30.5 tp -86.98 151.2 23.49 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 124.55 1.156 . . . . 10.0 109.745 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -139.46 102.94 4.59 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 114.924 -1.034 . . . . 10.0 109.966 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 4.7 mtp -97.54 154.33 17.58 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 108.437 -0.949 . . . . 10.0 108.437 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -146.89 154.78 41.7 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 114.093 1.146 . . . . 10.0 114.093 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -170.02 118.53 0.59 Allowed 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 105.027 -2.212 . . . . 10.0 105.027 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 63.64 43.31 5.78 Favored 'General case' 0 C--O 1.242 0.7 0 O-C-N 126.664 2.477 . . . . 10.0 113.093 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 64.47 15.92 59.98 Favored Glycine 0 C--O 1.22 -0.763 0 O-C-N 121.236 -0.915 . . . . 10.0 115.37 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 2.6 t -105.16 123.25 59.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 N-CA-C 108.064 -1.087 . . . . 10.0 108.064 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 85.1 m -93.78 117.47 30.14 Favored 'General case' 0 N--CA 1.441 -0.903 0 O-C-N 123.82 0.7 . . . . 10.0 112.484 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 51.6 t -116.88 104.93 11.8 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 106.487 -1.672 . . . . 10.0 106.487 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 28.9 mtpt -106.56 152.38 23.78 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 122.396 1.093 . . . . 10.0 111.822 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -135.3 107.91 7.43 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 108.206 -1.035 . . . . 10.0 108.206 -179.579 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 76.8 t -83.14 122.37 37.38 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.73 0 O-C-N 125.555 1.784 . . . . 10.0 107.694 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 59.6 m-85 -112.07 -172.38 2.03 Favored 'General case' 0 N--CA 1.45 -0.457 0 O-C-N 125.173 1.545 . . . . 10.0 108.506 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 24.1 tptp -151.87 122.48 7.4 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 123.542 1.639 . . . . 10.0 107.745 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . 0.508 ' HG2' ' CZ3' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -78.27 110.78 13.59 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-N 115.01 -0.995 . . . . 10.0 108.866 -179.832 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 4.2 t -100.87 -1.85 9.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 118.209 -0.901 . . . . 10.0 109.313 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.44 -0.936 0 O-C-N 126.044 2.09 . . . . 10.0 110.866 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_exo . . . . . 0 N--CA 1.491 1.368 0 N-CA-C 110.989 -0.427 . . . . 10.0 110.989 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -139.41 -43.21 0.29 Allowed 'Isoleucine or valine' 0 C--O 1.242 0.709 0 CA-C-N 113.28 -1.782 . . . . 10.0 112.589 -179.703 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 170.16 -66.36 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.561 0 O-C-N 125.465 1.728 . . . . 10.0 112.511 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.472 ' CD1' HD11 ' A' ' 110' ' ' ILE . 84.9 m-85 68.86 -49.22 0.58 Allowed 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 126.168 1.787 . . . . 10.0 114.027 -179.706 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -47.55 113.17 0.65 Allowed 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 115.105 1.52 . . . . 10.0 115.105 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 169.96 -116.0 0.63 Allowed Glycine 0 CA--C 1.529 0.968 0 O-C-N 125.467 1.729 . . . . 10.0 113.954 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -165.66 144.4 6.15 Favored 'General case' 0 C--O 1.224 -0.243 0 N-CA-C 100.894 -3.743 . . . . 10.0 100.894 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.497 ' CD2' HD11 ' A' ' 115' ' ' LEU . 87.2 m95 -129.92 114.9 16.43 Favored 'General case' 0 C--N 1.315 -0.919 0 O-C-N 124.53 1.144 . . . . 10.0 109.331 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 9.1 tptt -99.01 116.91 32.32 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.231 -1.35 . . . . 10.0 110.698 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.46 135.51 57.7 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-O 122.234 1.016 . . . . 10.0 111.483 179.265 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 15.0 tp -117.02 -45.02 2.77 Favored 'General case' 0 CA--C 1.514 -0.441 0 O-C-N 120.611 -1.306 . . . . 10.0 111.436 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -122.29 156.93 32.82 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 123.977 1.846 . . . . 10.0 113.992 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -148.43 120.04 8.01 Favored 'General case' 0 CA--C 1.508 -0.666 0 CA-C-N 112.098 -2.319 . . . . 10.0 107.51 179.683 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.5 mt-10 -101.49 -71.57 0.71 Allowed 'General case' 0 C--N 1.319 -0.76 0 C-N-CA 122.861 0.465 . . . . 10.0 112.169 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 10.3 m-20 -107.18 56.38 0.64 Allowed 'General case' 0 C--O 1.24 0.586 0 CA-C-O 123.123 1.439 . . . . 10.0 112.893 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -71.26 -49.75 39.87 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 118.16 -2.838 . . . . 10.0 111.088 179.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -64.62 -36.63 84.88 Favored 'General case' 0 C--N 1.323 -0.565 0 O-C-N 119.396 -2.065 . . . . 10.0 115.633 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.68 -28.92 64.06 Favored 'General case' 0 C--O 1.216 -0.701 0 CA-C-O 122.95 1.357 . . . . 10.0 111.752 179.508 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -67.58 -42.96 81.7 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 113.142 -1.844 . . . . 10.0 111.447 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 46.9 mt -75.73 -22.35 56.65 Favored 'General case' 0 C--O 1.212 -0.902 0 O-C-N 120.989 -1.07 . . . . 10.0 110.817 179.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.34 -21.53 56.03 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 112.883 -1.962 . . . . 10.0 106.44 179.682 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.8 -35.71 59.98 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-O 125.194 2.426 . . . . 10.0 111.151 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -89.41 -7.74 54.51 Favored 'General case' 0 CA--C 1.546 0.808 0 O-C-N 120.265 -1.522 . . . . 10.0 114.618 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 64.78 38.34 6.84 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 124.232 1.968 . . . . 10.0 113.606 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.42 ' CG2' HD23 ' A' ' 29' ' ' LEU . 0.3 OUTLIER -68.22 160.47 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.709 0 N-CA-C 105.161 -2.162 . . . . 10.0 105.161 -179.909 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 13.0 p30 -63.0 160.14 15.62 Favored 'General case' 0 C--O 1.242 0.663 0 O-C-N 125.412 1.695 . . . . 10.0 114.557 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -67.95 -35.24 71.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 N-CA-C 115.925 1.824 . . . . 10.0 115.925 -179.365 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -72.66 -34.72 67.44 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 121.259 -0.9 . . . . 10.0 112.086 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.42 HD23 ' CG2' ' A' ' 25' ' ' VAL . 32.8 tp -66.18 -31.02 71.61 Favored 'General case' 0 C--N 1.32 -0.679 0 O-C-N 120.153 -1.592 . . . . 10.0 112.093 -179.719 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 7.7 ttp180 -78.04 -29.83 49.55 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 113.757 -1.565 . . . . 10.0 109.563 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -78.86 -41.08 30.82 Favored 'General case' 0 N--CA 1.466 0.328 0 O-C-N 124.431 1.082 . . . . 10.0 111.608 -179.783 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.2 mp -74.72 -30.47 24.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 CA-C-N 113.698 -1.592 . . . . 10.0 109.449 -179.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -76.8 -52.23 9.91 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 115.691 1.737 . . . . 10.0 115.691 179.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 16.8 p30 -45.65 -23.96 0.3 Allowed 'General case' 0 C--O 1.217 -0.628 0 N-CA-C 115.409 1.633 . . . . 10.0 115.409 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.0 mt -73.56 -46.95 44.37 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-O 124.198 1.951 . . . . 10.0 111.1 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.6 pp -97.51 -178.91 4.29 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 113.783 -1.553 . . . . 10.0 109.815 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 18.8 mttt -142.43 138.53 16.52 Favored Pre-proline 0 N--CA 1.468 0.438 0 N-CA-C 104.293 -2.484 . . . . 10.0 104.293 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -68.83 108.83 1.98 Allowed 'Trans proline' 0 N--CA 1.45 -1.055 0 C-N-CA 124.782 3.655 . . . . 10.0 119.018 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -88.26 136.32 33.03 Favored 'General case' 0 C--O 1.219 -0.521 0 N-CA-C 105.38 -2.082 . . . . 10.0 105.38 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.9 mttm -119.06 138.81 52.61 Favored 'General case' 0 C--O 1.211 -0.922 0 CA-C-O 123.417 1.579 . . . . 10.0 112.29 179.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -134.61 128.36 33.03 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 103.544 -2.761 . . . . 10.0 103.544 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 17.5 mt -118.01 136.84 53.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 O-C-N 125.843 1.964 . . . . 10.0 110.992 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 48.7 t -128.79 103.84 10.28 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.38 0 N-CA-C 105.162 -2.162 . . . . 10.0 105.162 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.26 142.84 27.92 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-O 123.374 1.559 . . . . 10.0 111.804 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -132.45 167.45 19.93 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 102.725 -3.065 . . . . 10.0 102.725 -179.699 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -67.9 118.43 9.65 Favored Glycine 0 C--O 1.246 0.862 0 CA-C-O 117.685 -1.619 . . . . 10.0 109.443 179.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 62.74 18.75 10.91 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 119.198 1.499 . . . . 10.0 112.695 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -156.76 119.98 4.15 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 105.837 -1.912 . . . . 10.0 105.837 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.448 ' HE1' ' CD1' ' A' ' 93' ' ' LEU . 5.6 ttp -118.88 159.61 23.45 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 114.794 -1.094 . . . . 10.0 112.226 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 35.0 mt -145.41 135.45 18.59 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 N-CA-C 108.095 -1.076 . . . . 10.0 108.095 179.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.3 mm -117.42 129.17 74.33 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 N-CA-C 105.262 -2.125 . . . . 10.0 105.262 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.9 mtp-105 -121.85 106.26 11.11 Favored 'General case' 0 N--CA 1.437 -1.091 0 O-C-N 124.338 1.024 . . . . 10.0 113.588 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.3 m -80.81 128.78 34.05 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 101.17 -3.641 . . . . 10.0 101.17 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 64.2 mt -132.94 76.46 1.68 Allowed 'General case' 0 N--CA 1.448 -0.549 1 N-CA-C 122.559 4.281 . . . . 10.0 122.559 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -110.18 129.33 55.73 Favored 'General case' 0 C--O 1.242 0.66 0 C-N-CA 124.992 1.317 . . . . 10.0 107.942 -179.737 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 22.9 p -61.41 89.11 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.728 0 O-C-N 125.145 1.528 . . . . 10.0 109.465 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 3.0 t80 174.11 -69.52 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 126.796 2.56 . . . . 10.0 109.71 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 40.2 ttm180 -148.21 105.72 3.67 Favored 'General case' 0 C--N 1.344 0.368 0 O-C-N 125.246 1.591 . . . . 10.0 114.758 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . 0.641 ' N ' HD21 ' A' ' 59' ' ' ASN . 0.7 OUTLIER -91.04 123.86 34.83 Favored 'General case' 0 C--N 1.319 -0.722 0 O-C-N 125.182 1.551 . . . . 10.0 112.668 -179.746 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.407 ' CD1' ' O ' ' A' ' 60' ' ' TYR . 0.1 OUTLIER -118.09 120.68 38.49 Favored 'General case' 0 C--O 1.211 -0.931 0 N-CA-C 104.041 -2.577 . . . . 10.0 104.041 179.697 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.0 mm -108.56 156.61 9.08 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.476 0 O-C-N 119.049 -2.282 . . . . 10.0 111.895 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -136.18 -169.07 2.35 Favored 'General case' 0 C--O 1.219 -0.551 0 CA-C-N 112.86 -1.973 . . . . 10.0 107.819 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 12.3 t0 -170.62 77.42 0.08 Allowed 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 101.598 -3.482 . . . . 10.0 101.598 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.499 ' CD1' ' CD2' ' A' ' 70' ' ' PHE . 66.4 m-85 -62.96 175.13 0.91 Allowed 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 114.722 1.379 . . . . 10.0 114.722 -179.891 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -134.75 94.05 3.12 Favored 'General case' 0 C--O 1.217 -0.65 0 N-CA-C 104.451 -2.425 . . . . 10.0 104.451 179.517 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 5.3 t -59.99 120.12 5.29 Favored 'Isoleucine or valine' 0 C--O 1.245 0.862 0 O-C-N 124.268 0.98 . . . . 10.0 112.961 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 105.66 23.35 7.56 Favored Glycine 0 CA--C 1.532 1.149 0 CA-C-N 114.903 -1.044 . . . . 10.0 114.957 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -172.43 143.5 1.4 Allowed 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 116.795 -1.574 . . . . 10.0 114.701 179.78 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.421 ' HG3' ' HB3' ' A' ' 83' ' ' MET . 0.0 OUTLIER -53.3 118.31 3.72 Favored 'General case' 0 C--N 1.319 -0.747 0 O-C-N 125.333 1.646 . . . . 10.0 108.61 179.757 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.499 ' CD2' ' CD1' ' A' ' 64' ' ' PHE . 81.8 t80 -91.83 -34.29 14.61 Favored 'General case' 0 C--O 1.239 0.525 0 CA-C-N 113.122 -1.854 . . . . 10.0 112.824 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 72.6 161.76 0.25 Allowed 'General case' 0 C--O 1.217 -0.649 0 N-CA-C 105.513 -2.032 . . . . 10.0 105.513 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -136.85 -46.92 0.59 Allowed 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 114.779 1.4 . . . . 10.0 114.779 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 56.52 28.03 13.19 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 108.405 -0.961 . . . . 10.0 108.405 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -39.57 143.25 0.23 Allowed 'General case' 0 C--N 1.313 -1.009 0 N-CA-C 116.917 2.191 . . . . 10.0 116.917 -179.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -165.84 107.62 0.75 Allowed 'General case' 0 C--O 1.241 0.626 0 N-CA-C 107.314 -1.365 . . . . 10.0 107.314 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 162.26 -54.88 0.3 Allowed Glycine 0 N--CA 1.438 -1.177 0 N-CA-C 108.988 -1.645 . . . . 10.0 108.988 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.2 pt -121.77 142.94 36.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 N-CA-C 103.441 -2.8 . . . . 10.0 103.441 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 23.5 t0 64.7 -68.5 0.1 Allowed 'General case' 0 N--CA 1.443 -0.804 0 O-C-N 125.712 1.883 . . . . 10.0 113.918 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 81.83 70.52 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.572 0 O-C-N 126.309 2.255 . . . . 10.0 111.46 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 6.3 mtm180 -121.68 -171.96 2.33 Favored 'General case' 0 C--O 1.236 0.358 0 O-C-N 120.506 -1.371 . . . . 10.0 112.733 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 5.4 mtpm? -139.27 135.77 34.2 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 103.439 -2.801 . . . . 10.0 103.439 -179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 27.5 p -172.22 159.08 4.7 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-O 123.014 1.388 . . . . 10.0 108.993 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' MET . . . . . 0.421 ' HB3' ' HG3' ' A' ' 69' ' ' GLU . 0.7 OUTLIER -107.05 108.45 19.94 Favored 'General case' 0 N--CA 1.441 -0.923 1 N-CA-C 98.381 -4.674 . . . . 10.0 98.381 -179.726 . . . . . . . . 4 4 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 17.7 m -105.04 112.79 26.05 Favored 'General case' 0 N--CA 1.445 -0.693 0 O-C-N 126.805 2.566 . . . . 10.0 116.641 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 25.5 m -106.72 115.66 30.57 Favored 'General case' 0 N--CA 1.439 -0.979 0 O-C-N 125.892 1.995 . . . . 10.0 109.284 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 58.1 t -86.76 143.21 11.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 104.625 -2.361 . . . . 10.0 104.625 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 39.1 t -163.73 133.17 4.01 Favored 'General case' 0 C--O 1.243 0.759 0 CA-C-N 113.986 -1.461 . . . . 10.0 111.712 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -82.61 126.22 32.07 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 119.573 -0.851 . . . . 10.0 110.08 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -75.28 -37.95 60.65 Favored 'General case' 0 C--N 1.313 -1.002 1 N-CA-C 98.803 -4.518 . . . . 10.0 98.803 179.868 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 163.04 -73.75 0.19 Allowed Glycine 0 C--N 1.333 0.4 0 N-CA-C 106.015 -2.834 . . . . 10.0 106.015 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -106.57 8.45 31.29 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.092 -0.643 . . . . 10.0 109.669 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.5 121.04 21.59 Favored 'General case' 0 N--CA 1.442 -0.846 0 N-CA-C 109.195 -0.669 . . . . 10.0 109.195 -179.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.448 ' CD1' ' HE1' ' A' ' 49' ' ' MET . 0.3 OUTLIER -84.24 83.32 8.01 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 104.931 -2.248 . . . . 10.0 104.931 -179.998 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -86.05 139.45 31.14 Favored 'General case' 0 C--O 1.212 -0.881 0 CA-C-N 113.051 -1.886 . . . . 10.0 113.663 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -130.86 146.05 52.17 Favored 'General case' 0 C--O 1.241 0.631 0 CA-C-N 113.521 -1.672 . . . . 10.0 109.616 -179.753 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 9.1 p -121.16 142.41 37.43 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 N-CA-C 104.765 -2.309 . . . . 10.0 104.765 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -148.82 94.43 2.26 Favored 'General case' 0 C--N 1.321 -0.656 0 O-C-N 125.106 1.504 . . . . 10.0 109.557 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.87 119.88 8.54 Favored 'General case' 0 C--O 1.213 -0.833 0 O-C-N 121.055 -1.028 . . . . 10.0 112.448 -179.697 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -134.77 -160.37 9.08 Favored Glycine 0 C--N 1.312 -0.782 0 CA-C-O 117.808 -1.551 . . . . 10.0 110.62 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -90.33 4.48 50.67 Favored 'General case' 0 C--N 1.316 -0.873 0 O-C-N 126.7 2.059 . . . . 10.0 115.723 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 11.1 mmtt -107.86 -176.27 3.01 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 115.342 1.608 . . . . 10.0 115.342 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -67.31 -60.89 2.21 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 125.546 1.779 . . . . 10.0 108.659 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -141.91 127.28 3.22 Favored Glycine 0 C--N 1.338 0.681 0 N-CA-C 117.639 1.815 . . . . 10.0 117.639 179.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -144.45 127.92 16.96 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-O 117.734 -1.127 . . . . 10.0 109.343 -179.655 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 176.49 160.68 24.11 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 109.21 -1.556 . . . . 10.0 109.21 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 38.6 m0 -116.48 105.29 12.32 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 123.321 0.648 . . . . 10.0 109.726 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.4 m -98.69 77.03 2.24 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 107.518 -1.29 . . . . 10.0 107.518 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.432 ' CG ' HD22 ' A' ' 115' ' ' LEU . 14.5 mp0 -72.02 111.69 7.47 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 122.743 1.259 . . . . 10.0 108.468 -179.754 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 4.4 t90 -113.53 109.31 18.44 Favored 'General case' 0 C--O 1.214 -0.804 0 O-C-N 120.557 -1.34 . . . . 10.0 110.934 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.472 HD11 ' CD1' ' A' ' 4' ' ' PHE . 10.3 mt -76.58 148.09 7.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 116.568 2.062 . . . . 10.0 116.568 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -130.84 58.66 1.69 Allowed 'General case' 0 C--O 1.219 -0.523 0 N-CA-C 105.429 -2.063 . . . . 10.0 105.429 -179.833 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 65.66 -94.24 0.19 Allowed Glycine 0 C--O 1.22 -0.777 0 N-CA-C 109.785 -1.326 . . . . 10.0 109.785 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -89.6 29.1 1.18 Allowed 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 122.838 1.304 . . . . 10.0 111.787 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -152.63 163.9 38.72 Favored 'General case' 0 CA--C 1.503 -0.827 0 O-C-N 120.736 -1.228 . . . . 10.0 114.082 179.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.497 HD11 ' CD2' ' A' ' 8' ' ' TRP . 2.4 tt -134.37 108.74 8.35 Favored 'General case' 0 N--CA 1.437 -1.12 0 O-C-N 126.201 2.188 . . . . 10.0 106.375 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -103.83 99.64 9.42 Favored 'General case' 0 C--O 1.212 -0.909 0 N-CA-C 105.53 -2.026 . . . . 10.0 105.53 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 17.2 tp -99.7 123.75 44.28 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 115.413 1.634 . . . . 10.0 115.413 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -99.66 73.7 1.82 Allowed 'General case' 0 N--CA 1.446 -0.665 0 O-C-N 123.479 0.487 . . . . 10.0 110.424 179.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 13.9 ttp -57.03 140.7 48.27 Favored 'General case' 0 N--CA 1.449 -0.516 0 O-C-N 124.4 1.063 . . . . 10.0 108.143 -179.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -125.64 156.04 39.85 Favored 'General case' 0 C--N 1.322 -0.621 0 O-C-N 125.928 2.018 . . . . 10.0 109.884 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 178.9 117.85 0.04 OUTLIER 'General case' 0 C--O 1.216 -0.662 0 O-C-N 126.545 2.403 . . . . 10.0 109.241 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 50.85 34.64 10.64 Favored 'General case' 0 N--CA 1.445 -0.72 0 O-C-N 125.447 1.717 . . . . 10.0 113.007 -179.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 85.02 -3.41 87.27 Favored Glycine 0 C--N 1.339 0.707 0 CA-C-O 122.385 0.992 . . . . 10.0 113.348 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 24.7 t -95.12 111.16 25.2 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 N-CA-C 107.632 -1.247 . . . . 10.0 107.632 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 4.1 m -101.1 106.25 17.5 Favored 'General case' 0 N--CA 1.442 -0.859 0 C-N-CA 125.468 1.507 . . . . 10.0 112.004 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -105.5 147.33 28.45 Favored 'General case' 0 C--O 1.214 -0.769 0 N-CA-C 105.047 -2.205 . . . . 10.0 105.047 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 7.8 mtpt -114.55 149.5 36.39 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 123.317 0.647 . . . . 10.0 110.739 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . 0.416 ' NE2' ' CZ ' ' A' ' 130' ' ' PHE . 0.1 OUTLIER -138.52 115.8 11.11 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 118.047 -0.978 . . . . 10.0 109.553 179.942 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 21.3 t -97.26 106.24 18.25 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.28 0 O-C-N 126.659 2.475 . . . . 10.0 110.885 -179.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . 0.416 ' CZ ' ' NE2' ' A' ' 128' ' ' GLN . 96.3 m-85 -92.75 172.65 8.21 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 106.58 -1.637 . . . . 10.0 106.58 179.827 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 46.5 tptt -140.88 122.13 14.83 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 107.014 -1.476 . . . . 10.0 107.014 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . 0.405 ' HB2' ' CZ3' ' A' ' 8' ' ' TRP . 18.4 ttpt -68.04 138.84 56.14 Favored 'General case' 0 C--O 1.218 -0.572 0 CA-C-N 120.169 1.35 . . . . 10.0 107.951 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -154.03 54.41 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.241 0.646 0 O-C-N 126.069 2.106 . . . . 10.0 111.139 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.441 -0.884 0 CA-C-O 116.392 -1.766 . . . . 10.0 111.925 -179.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_exo . . . . . 0 N--CA 1.481 0.781 0 N-CA-C 109.684 -0.929 . . . . 10.0 109.684 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 8.8 p -110.44 61.26 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 CA-C-O 124.07 1.891 . . . . 10.0 111.348 -179.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -112.49 130.3 56.04 Favored 'General case' 0 CA--C 1.521 -0.135 0 O-C-N 119.967 -1.708 . . . . 10.0 109.664 179.795 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.516 ' CE1' HD12 ' A' ' 110' ' ' ILE . 99.0 m-85 -91.73 -17.39 25.5 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 117.447 2.388 . . . . 10.0 117.447 179.863 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 8.8 m120 -54.19 113.82 1.39 Allowed 'General case' 0 N--CA 1.477 0.89 0 CA-C-O 122.985 1.374 . . . . 10.0 112.858 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -177.61 -110.84 0.28 Allowed Glycine 0 C--N 1.347 1.163 0 N-CA-C 117.704 1.841 . . . . 10.0 117.704 179.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 173.09 93.99 0.01 OUTLIER 'General case' 0 C--O 1.241 0.621 0 N-CA-C 102.767 -3.049 . . . . 10.0 102.767 -179.846 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 10.0 m95 -94.38 105.48 17.45 Favored 'General case' 0 C--O 1.215 -0.724 0 CA-C-N 114.282 -1.326 . . . . 10.0 112.382 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.407 ' HB3' HG22 ' A' ' 133' ' ' VAL . 0.0 OUTLIER -68.99 -163.5 0.04 OUTLIER 'General case' 0 C--O 1.239 0.53 0 C-N-CA 118.923 -1.111 . . . . 10.0 109.401 179.789 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -128.7 134.7 48.56 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.406 0.622 . . . . 10.0 112.628 179.813 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -99.73 -63.09 1.16 Allowed 'General case' 0 C--O 1.236 0.352 0 N-CA-C 108.853 -0.795 . . . . 10.0 108.853 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -132.52 173.77 10.97 Favored 'General case' 0 CA--C 1.511 -0.532 0 O-C-N 126.771 2.544 . . . . 10.0 114.59 -179.533 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 23.8 p-10 -150.11 172.48 15.21 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 113.906 -1.497 . . . . 10.0 107.641 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -157.6 132.68 8.79 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 114.673 1.36 . . . . 10.0 114.673 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 52.32 42.95 31.19 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 122.691 1.234 . . . . 10.0 112.425 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -69.36 -44.41 71.62 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 115.004 1.483 . . . . 10.0 115.004 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.414 ' HG2' ' HG3' ' A' ' 30' ' ' ARG . 0.6 OUTLIER -71.9 -34.18 68.92 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-O 122.69 1.233 . . . . 10.0 113.758 -179.953 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 -77.44 -20.35 54.66 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 117.651 -1.166 . . . . 10.0 109.371 179.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.516 ' CZ ' ' HE1' ' A' ' 119' ' ' MET . 0.1 OUTLIER -76.19 -42.81 45.09 Favored 'General case' 0 CA--C 1.552 1.032 0 O-C-N 126.976 2.673 . . . . 10.0 108.537 179.968 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.434 HD21 ' CD2' ' A' ' 19' ' ' TYR . 3.0 mt -72.03 -21.41 61.54 Favored 'General case' 0 C--O 1.211 -0.947 0 O-C-N 120.764 -1.21 . . . . 10.0 113.211 -179.826 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.6 ttm180 -78.52 -25.37 45.54 Favored 'General case' 0 C--O 1.243 0.737 0 N-CA-C 106.252 -1.759 . . . . 10.0 106.252 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.81 -47.23 81.7 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.86 1.059 . . . . 10.0 113.86 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.499 HD11 ' CE1' ' A' ' 19' ' ' TYR . 0.4 OUTLIER -87.36 -6.4 58.49 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 119.25 0.932 . . . . 10.0 110.355 -179.705 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 71.48 19.04 5.3 Favored 'General case' 0 C--O 1.224 -0.273 0 O-C-N 123.815 0.697 . . . . 10.0 111.734 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 10.0 p -59.04 163.54 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.219 0 N-CA-C 105.621 -1.992 . . . . 10.0 105.621 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -41.81 148.31 0.17 Allowed 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 115.38 1.622 . . . . 10.0 115.38 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 2.9 p -73.32 -23.24 19.66 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.66 0 O-C-N 119.441 -2.037 . . . . 10.0 114.021 -179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -73.98 -23.75 59.51 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 109.554 -0.535 . . . . 10.0 109.554 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -71.04 -45.49 63.77 Favored 'General case' 0 C--O 1.218 -0.566 0 O-C-N 126.317 2.261 . . . . 10.0 112.694 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.414 ' HG3' ' HG2' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -68.15 -30.99 70.25 Favored 'General case' 0 CA--C 1.512 -0.499 0 O-C-N 125.107 1.504 . . . . 10.0 111.47 179.986 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.19 -44.72 59.37 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 108.647 -0.871 . . . . 10.0 108.647 -179.623 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 5.4 mt -76.21 -30.54 20.24 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 N-CA-C 108.109 -1.071 . . . . 10.0 108.109 -179.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -49.94 -61.57 2.06 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 127.977 3.298 . . . . 10.0 110.403 179.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -52.86 154.93 2.57 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 116.134 -1.888 . . . . 10.0 108.632 179.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 77.3 -39.21 0.31 Allowed 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 120.16 1.345 . . . . 10.0 113.167 -179.248 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -100.48 139.68 35.82 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 120.068 1.304 . . . . 10.0 110.948 179.693 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 14.9 mttt -127.13 111.82 21.62 Favored Pre-proline 0 CA--C 1.535 0.404 0 CA-C-O 123.151 1.453 . . . . 10.0 107.677 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -60.04 105.88 0.31 Allowed 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 123.307 2.671 . . . . 10.0 115.954 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.58 -177.98 1.67 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 118.31 0.504 . . . . 10.0 109.687 179.847 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.0 tptt -140.44 153.0 46.12 Favored 'General case' 0 C--N 1.314 -0.966 0 O-C-N 121.043 -1.036 . . . . 10.0 109.526 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -154.6 69.68 0.76 Allowed 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 104.143 -2.54 . . . . 10.0 104.143 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 25.4 mm -56.99 152.21 2.7 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.01 0 O-C-N 121.791 -0.568 . . . . 10.0 112.181 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -146.49 95.29 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 N-CA-C 104.461 -2.422 . . . . 10.0 104.461 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 55.8 tt0 -122.78 118.76 28.76 Favored 'General case' 0 C--O 1.218 -0.597 0 O-C-N 119.846 -1.784 . . . . 10.0 108.634 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -69.02 -85.89 0.02 OUTLIER 'General case' 0 C--O 1.236 0.387 0 N-CA-C 105.638 -1.986 . . . . 10.0 105.638 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -160.45 -54.79 0.01 OUTLIER Glycine 0 N--CA 1.461 0.348 0 N-CA-C 106.192 -2.763 . . . . 10.0 106.192 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.9 m-20 -100.78 4.4 42.92 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 108.643 -0.873 . . . . 10.0 108.643 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 34.6 m170 -142.07 174.2 10.82 Favored 'General case' 0 N--CA 1.438 -1.049 0 CA-C-O 117.82 -1.086 . . . . 10.0 110.246 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 14.0 ttp -149.22 165.07 32.98 Favored 'General case' 0 N--CA 1.441 -0.91 0 C-N-CA 118.699 -1.201 . . . . 10.0 111.806 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 6.8 mm -149.25 123.5 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 103.563 -2.754 . . . . 10.0 103.563 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.6 mp -110.51 133.23 56.6 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 N-CA-C 107.833 -1.173 . . . . 10.0 107.833 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 63.6 mtp180 -127.36 146.87 50.31 Favored 'General case' 0 C--O 1.214 -0.763 0 N-CA-C 109.021 -0.733 . . . . 10.0 109.021 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 18.4 m -128.22 108.21 10.42 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 102.402 -3.184 . . . . 10.0 102.402 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 11.0 mt -105.26 99.24 8.86 Favored 'General case' 0 C--N 1.32 -0.707 1 N-CA-C 122.095 4.109 . . . . 10.0 122.095 -179.775 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.5 m -129.94 173.29 10.83 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 104.879 -2.267 . . . . 10.0 104.879 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 32.5 p -101.49 31.5 3.73 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 107.211 -1.403 . . . . 10.0 107.211 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -124.5 -43.85 2.01 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-O 118.277 -0.868 . . . . 10.0 110.123 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -176.3 137.38 0.29 Allowed 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 118.006 -0.997 . . . . 10.0 112.389 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . 0.412 ' N ' ' ND2' ' A' ' 59' ' ' ASN . 0.9 OUTLIER -101.55 171.07 7.79 Favored 'General case' 0 C--O 1.241 0.621 0 O-C-N 125.012 1.445 . . . . 10.0 113.81 179.833 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -130.32 117.25 19.49 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 104.533 -2.395 . . . . 10.0 104.533 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 26.0 mm -122.8 112.86 35.78 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 N-CA-C 115.024 1.49 . . . . 10.0 115.024 179.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 3.2 mmt -130.67 178.25 6.78 Favored 'General case' 0 C--O 1.212 -0.876 0 CA-C-O 123.507 1.622 . . . . 10.0 108.372 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -151.59 107.53 3.4 Favored 'General case' 0 N--CA 1.437 -1.102 0 N-CA-C 101.929 -3.36 . . . . 10.0 101.929 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -107.73 174.31 5.94 Favored 'General case' 0 C--O 1.247 0.964 0 N-CA-C 116.854 2.168 . . . . 10.0 116.854 -179.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 5.7 mm100 -126.06 115.27 19.58 Favored 'General case' 0 N--CA 1.444 -0.743 0 N-CA-C 104.934 -2.247 . . . . 10.0 104.934 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 3.4 t -71.12 95.25 0.49 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.728 0 N-CA-C 109.218 -0.66 . . . . 10.0 109.218 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 112.29 55.74 0.46 Allowed Glycine 0 CA--C 1.532 1.131 0 C-N-CA 124.705 1.145 . . . . 10.0 115.46 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -174.06 121.9 0.3 Allowed 'General case' 0 C--O 1.236 0.388 0 C-N-CA 123.386 0.674 . . . . 10.0 112.562 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -56.08 135.81 52.65 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 124.521 1.128 . . . . 10.0 112.708 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -120.5 -174.66 2.85 Favored 'General case' 0 N--CA 1.437 -1.085 0 C-N-CA 124.165 0.986 . . . . 10.0 110.74 -179.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -148.9 66.72 1.04 Allowed 'General case' 0 C--N 1.312 -1.039 0 N-CA-C 108.149 -1.056 . . . . 10.0 108.149 179.639 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -51.4 118.39 3.26 Favored 'General case' 0 CA--C 1.509 -0.624 0 O-C-N 124.682 1.239 . . . . 10.0 111.529 179.776 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -71.54 -36.91 71.14 Favored 'General case' 0 C--N 1.318 -0.768 0 O-C-N 125.539 1.774 . . . . 10.0 110.544 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 19.4 mt 41.76 71.71 0.2 Allowed 'General case' 0 N--CA 1.441 -0.88 0 C-N-CA 124.813 1.245 . . . . 10.0 114.268 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -113.79 116.75 29.85 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 106.722 -1.584 . . . . 10.0 106.722 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 140.35 -67.84 0.49 Allowed Glycine 0 N--CA 1.444 -0.825 0 CA-C-O 118.778 -1.012 . . . . 10.0 111.361 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -111.14 147.15 15.35 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 N-CA-C 105.539 -2.022 . . . . 10.0 105.539 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 55.28 16.5 1.71 Allowed 'General case' 0 N--CA 1.443 -0.8 0 CA-C-O 116.019 -1.943 . . . . 10.0 113.414 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -2.35 68.41 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 118.062 2.615 . . . . 10.0 118.062 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.64 -163.43 1.37 Allowed 'General case' 0 N--CA 1.452 -0.337 0 O-C-N 119.936 -1.727 . . . . 10.0 111.868 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 2.1 tptp -153.18 147.64 25.98 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 102.998 -2.964 . . . . 10.0 102.998 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 5.7 p -158.84 140.6 13.55 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 122.395 1.093 . . . . 10.0 110.562 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.1 ttt -93.77 67.6 3.84 Favored 'General case' 0 N--CA 1.441 -0.895 0 N-CA-C 102.797 -3.038 . . . . 10.0 102.797 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' THR . . . . . 0.42 ' CG2' ' N ' ' A' ' 85' ' ' THR . 0.6 OUTLIER -50.89 166.21 0.09 Allowed 'General case' 0 N--CA 1.434 -1.263 0 CA-C-N 112.958 -1.928 . . . . 10.0 115.479 179.921 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.42 ' N ' ' CG2' ' A' ' 84' ' ' THR . 0.2 OUTLIER -164.27 106.05 0.89 Allowed 'General case' 0 N--CA 1.442 -0.842 0 N-CA-C 108.217 -1.031 . . . . 10.0 108.217 179.608 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 32.6 t -108.15 118.05 54.99 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.974 0 N-CA-C 103.237 -2.875 . . . . 10.0 103.237 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -124.65 149.44 47.13 Favored 'General case' 0 C--N 1.315 -0.895 0 O-C-N 124.786 1.304 . . . . 10.0 114.483 -179.868 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 4.0 t90 -85.4 127.88 34.53 Favored 'General case' 0 C--N 1.329 -0.319 0 O-C-N 121.567 -0.708 . . . . 10.0 110.055 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -92.24 -55.33 3.47 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 101.434 -3.543 . . . . 10.0 101.434 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 146.59 -76.87 0.26 Allowed Glycine 0 C--O 1.245 0.787 0 N-CA-C 107.691 -2.164 . . . . 10.0 107.691 179.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.0 -24.12 67.59 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 114.837 -0.681 . . . . 10.0 111.078 -179.768 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.33 168.08 23.51 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-O 122.249 1.023 . . . . 10.0 110.129 179.831 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -108.81 136.9 47.6 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 104.298 -2.482 . . . . 10.0 104.298 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -138.33 145.25 40.95 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 118.772 0.715 . . . . 10.0 110.199 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 6.7 m -123.03 159.98 27.27 Favored 'General case' 0 CA--C 1.505 -0.784 0 O-C-N 126.163 2.165 . . . . 10.0 114.129 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -159.02 128.75 0.75 Allowed 'Isoleucine or valine' 0 C--O 1.246 0.903 0 N-CA-C 105.134 -2.173 . . . . 10.0 105.134 -179.662 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.6 140.05 48.06 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 122.673 1.225 . . . . 10.0 110.998 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -86.92 179.69 6.67 Favored 'General case' 0 C--N 1.343 0.297 0 N-CA-C 115.013 1.486 . . . . 10.0 115.013 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 142.37 -157.01 26.44 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.972 -0.632 . . . . 10.0 112.281 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -89.03 -17.04 30.19 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 118.387 2.736 . . . . 10.0 118.387 179.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.414 ' HD3' ' N ' ' A' ' 101' ' ' LYS . 17.3 mmtt -81.96 179.55 7.78 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 115.203 1.557 . . . . 10.0 115.203 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -108.71 14.87 24.1 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 126.764 2.026 . . . . 10.0 113.004 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -148.24 -88.24 0.07 OUTLIER Glycine 0 C--N 1.342 0.914 0 CA-C-N 113.547 -1.661 . . . . 10.0 114.549 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 6.2 mtp180 31.71 92.17 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.808 0 O-C-N 126.912 2.183 . . . . 10.0 114.889 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 169.97 149.88 6.57 Favored Glycine 0 N--CA 1.441 -0.97 0 N-CA-C 110.085 -1.206 . . . . 10.0 110.085 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -112.26 168.08 9.91 Favored 'General case' 0 C--N 1.32 -0.679 0 O-C-N 120.64 -1.506 . . . . 10.0 109.257 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.7 m -151.01 120.06 6.7 Favored 'General case' 0 C--O 1.215 -0.72 0 N-CA-C 107.703 -1.221 . . . . 10.0 107.703 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -117.38 102.0 8.87 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 124.426 2.06 . . . . 10.0 114.738 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' TRP . . . . . 0.489 ' CD1' ' C ' ' A' ' 109' ' ' TRP . 0.0 OUTLIER -111.99 133.48 54.14 Favored 'General case' 0 C--O 1.217 -0.645 0 O-C-N 119.6 -1.938 . . . . 10.0 107.333 179.956 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.516 HD12 ' CE1' ' A' ' 4' ' ' PHE . 33.1 mt -98.93 142.13 15.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 O-C-N 126.603 2.439 . . . . 10.0 114.4 179.861 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -130.57 97.29 4.34 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 104.619 -2.363 . . . . 10.0 104.619 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 55.61 -118.13 10.04 Favored Glycine 0 C--O 1.221 -0.714 0 N-CA-C 109.721 -1.351 . . . . 10.0 109.721 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -92.4 12.72 21.76 Favored 'General case' 0 C--N 1.327 -0.392 0 O-C-N 126.06 1.682 . . . . 10.0 111.277 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -109.74 -179.18 3.74 Favored 'General case' 0 CA--C 1.513 -0.448 0 CA-C-O 117.701 -1.142 . . . . 10.0 111.234 179.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.504 HD22 ' CG ' ' A' ' 130' ' ' PHE . 2.3 tp -157.0 117.97 3.66 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 127.128 2.171 . . . . 10.0 106.725 179.749 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -104.47 121.21 42.96 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 106.367 -1.716 . . . . 10.0 106.367 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 10.8 tp -106.16 132.48 52.18 Favored 'General case' 0 C--N 1.315 -0.895 0 O-C-N 123.285 0.366 . . . . 10.0 111.101 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -119.25 100.53 7.38 Favored 'General case' 0 C--N 1.315 -0.893 0 O-C-N 125.149 1.531 . . . . 10.0 107.694 -179.664 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.516 ' HE1' ' CZ ' ' A' ' 19' ' ' TYR . 1.3 tmm? -109.55 136.67 48.55 Favored 'General case' 0 N--CA 1.444 -0.767 0 O-C-N 124.767 1.292 . . . . 10.0 109.372 -179.885 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -124.03 147.76 47.58 Favored 'General case' 0 C--N 1.315 -0.922 0 O-C-N 125.947 2.03 . . . . 10.0 113.172 179.756 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -156.17 131.49 9.41 Favored 'General case' 0 CA--C 1.501 -0.916 0 O-C-N 124.473 1.108 . . . . 10.0 109.314 179.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 47.42 29.5 1.35 Allowed 'General case' 0 C--N 1.319 -0.754 0 O-C-N 125.176 1.548 . . . . 10.0 114.409 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 93.6 -0.84 68.24 Favored Glycine 0 CA--C 1.528 0.881 0 N-CA-C 116.333 1.293 . . . . 10.0 116.333 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 21.2 t -107.21 158.9 7.0 Favored 'Isoleucine or valine' 0 C--O 1.242 0.676 0 N-CA-C 106.699 -1.593 . . . . 10.0 106.699 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -138.86 130.3 27.21 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 118.72 0.691 . . . . 10.0 111.94 -179.744 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 1.1 t -98.18 148.56 23.46 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 104.837 -2.282 . . . . 10.0 104.837 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 20.1 mtpt -126.83 111.48 14.24 Favored 'General case' 0 C--O 1.218 -0.605 0 O-C-N 125.491 1.744 . . . . 10.0 108.988 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -114.53 113.59 24.63 Favored 'General case' 0 N--CA 1.447 -0.622 0 O-C-N 127.287 2.867 . . . . 10.0 114.136 179.821 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 2.3 t -91.56 133.01 34.49 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.768 0 O-C-N 123.905 0.753 . . . . 10.0 109.043 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . 0.504 ' CG ' HD22 ' A' ' 115' ' ' LEU . 9.3 m-85 -121.58 177.62 5.16 Favored 'General case' 0 C--O 1.214 -0.802 0 C-N-CA 126.178 1.791 . . . . 10.0 107.259 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 4.9 ttpt -158.07 138.66 12.84 Favored 'General case' 0 N--CA 1.445 -0.715 0 O-C-N 126.281 2.238 . . . . 10.0 106.376 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 2.2 tttp -74.16 130.11 39.14 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 123.035 1.398 . . . . 10.0 108.692 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . 0.407 HG22 ' HB3' ' A' ' 9' ' ' LYS . 2.1 t -96.83 -0.69 10.52 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 CA-C-N 114.846 -1.07 . . . . 10.0 109.219 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.24 0.604 0 O-C-N 126.773 2.545 . . . . 10.0 108.778 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo . . . . . 0 N--CA 1.488 1.176 0 CA-C-O 122.105 0.794 . . . . 10.0 113.359 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -123.67 61.08 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 O-C-N 120.679 -1.263 . . . . 10.0 110.191 179.808 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -94.85 110.02 21.94 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.351 1.46 . . . . 10.0 113.857 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -56.82 -28.7 61.92 Favored 'General case' 0 C--O 1.222 -0.358 0 N-CA-C 117.869 2.544 . . . . 10.0 117.869 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.4 p30 -52.46 153.15 3.14 Favored 'General case' 0 N--CA 1.478 0.962 0 O-C-N 125.75 1.906 . . . . 10.0 113.673 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 148.06 -140.91 8.71 Favored Glycine 0 C--N 1.336 0.533 0 N-CA-C 116.659 1.423 . . . . 10.0 116.659 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -144.17 156.9 44.51 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 103.392 -2.818 . . . . 10.0 103.392 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.513 ' CD2' ' CD2' ' A' ' 115' ' ' LEU . 3.8 m0 -160.11 72.73 0.5 Allowed 'General case' 0 C--N 1.315 -0.897 0 O-C-N 126.313 2.258 . . . . 10.0 113.202 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.31 113.83 1.73 Allowed 'General case' 0 C--O 1.238 0.458 0 N-CA-C 107.21 -1.404 . . . . 10.0 107.21 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -68.32 146.31 53.4 Favored 'General case' 0 CA--C 1.512 -0.51 0 O-C-N 119.338 -2.101 . . . . 10.0 113.424 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.0 mt -103.98 -46.56 4.44 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.994 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.5 t -155.31 153.82 31.13 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 116.182 1.919 . . . . 10.0 116.182 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -120.37 115.12 22.9 Favored 'General case' 0 C--N 1.318 -0.789 0 O-C-N 127.059 2.725 . . . . 10.0 104.508 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -92.68 139.22 30.78 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 120.243 1.383 . . . . 10.0 112.923 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 8.2 m120 56.09 31.66 18.59 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 113.683 0.994 . . . . 10.0 113.683 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 22.0 t80 -67.5 -32.13 72.74 Favored 'General case' 0 CA--C 1.55 0.967 0 O-C-N 120.778 -1.201 . . . . 10.0 113.733 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.65 -37.43 42.06 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-O 122.729 1.252 . . . . 10.0 110.565 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.33 -20.22 60.18 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-O 123.897 1.808 . . . . 10.0 107.064 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.461 ' CD2' HD21 ' A' ' 20' ' ' LEU . 2.8 t80 -74.81 -39.26 61.78 Favored 'General case' 0 CA--C 1.553 1.093 0 CA-C-N 114.141 -1.391 . . . . 10.0 111.105 -179.66 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.461 HD21 ' CD2' ' A' ' 19' ' ' TYR . 4.0 mt -78.02 -21.13 51.22 Favored 'General case' 0 C--O 1.21 -0.987 0 O-C-N 125.152 1.532 . . . . 10.0 109.73 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 26.9 ttp180 -77.27 -24.13 51.11 Favored 'General case' 0 C--O 1.245 0.846 0 CA-C-N 114.015 -1.448 . . . . 10.0 109.101 179.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.22 -51.46 67.68 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 126.224 1.809 . . . . 10.0 113.731 -179.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -110.78 6.98 21.84 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 119.094 0.861 . . . . 10.0 112.001 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 50.57 80.77 0.07 Allowed 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.795 1.035 . . . . 10.0 113.795 179.568 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 8.7 p -99.09 39.69 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.808 0 CA-C-N 115.162 -0.926 . . . . 10.0 110.074 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 75.11 143.7 0.08 Allowed 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 117.151 2.278 . . . . 10.0 117.151 -179.48 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 63.3 t -75.4 -33.42 27.57 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 O-C-N 124.893 1.371 . . . . 10.0 114.647 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -71.51 -27.87 63.5 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 122.933 1.349 . . . . 10.0 111.223 179.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.3 tp -79.17 -34.65 42.91 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 123.685 0.794 . . . . 10.0 110.206 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 42.8 ttp85 -77.37 -30.86 53.97 Favored 'General case' 0 C--O 1.242 0.702 0 O-C-N 120.742 -1.224 . . . . 10.0 111.746 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.66 -39.5 80.64 Favored 'General case' 0 C--N 1.314 -0.947 0 C-N-CA 126.45 1.9 . . . . 10.0 109.38 179.715 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 80.1 mt -79.41 -57.16 5.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 O-C-N 125.284 1.615 . . . . 10.0 112.595 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -50.01 -31.79 13.71 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 115.127 1.528 . . . . 10.0 115.127 -179.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -61.05 -26.76 67.86 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 123.38 1.562 . . . . 10.0 113.377 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.425 ' CD2' ' N ' ' A' ' 35' ' ' LEU . 0.9 OUTLIER -97.17 -6.3 35.15 Favored 'General case' 0 C--N 1.323 -0.576 0 O-C-N 119.074 -2.266 . . . . 10.0 113.666 179.848 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 47.2 mt -96.64 109.03 21.73 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 124.933 1.395 . . . . 10.0 108.023 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 20.1 mttp -120.01 93.86 48.17 Favored Pre-proline 0 C--O 1.236 0.392 0 O-C-N 119.657 -1.902 . . . . 10.0 106.935 -179.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -69.41 172.1 12.9 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 125.205 3.937 . . . . 10.0 118.211 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -122.0 113.63 19.83 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 104.429 -2.434 . . . . 10.0 104.429 -179.825 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.411 ' HD3' ' CE2' ' A' ' 130' ' ' PHE . 3.1 mttm -81.26 138.17 35.77 Favored 'General case' 0 C--N 1.316 -0.883 0 O-C-N 120.752 -1.218 . . . . 10.0 112.431 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -128.32 107.62 9.91 Favored 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 103.783 -2.673 . . . . 10.0 103.783 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.6 mt -95.82 149.34 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 CA-C-O 123.573 1.654 . . . . 10.0 108.968 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -147.41 131.03 9.07 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 CA-C-O 123.92 1.819 . . . . 10.0 106.105 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -116.61 143.95 44.99 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 105.638 -1.986 . . . . 10.0 105.638 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -126.29 -66.65 0.91 Allowed 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 108.31 -0.996 . . . . 10.0 108.31 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -171.54 92.78 0.1 OUTLIER Glycine 0 CA--C 1.522 0.479 0 N-CA-C 107.82 -2.112 . . . . 10.0 107.82 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 60.89 19.29 9.59 Favored 'General case' 0 C--N 1.32 -0.686 0 O-C-N 121.72 -0.871 . . . . 10.0 109.663 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 5.9 m80 -137.88 78.18 1.67 Allowed 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 104.884 -2.265 . . . . 10.0 104.884 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.475 ' HB2' ' CG2' ' A' ' 66' ' ' VAL . 1.0 OUTLIER -78.3 126.27 30.54 Favored 'General case' 0 N--CA 1.441 -0.889 0 CA-C-N 114.114 -1.403 . . . . 10.0 112.133 179.925 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 76.3 mt -110.6 139.68 33.14 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.544 0 N-CA-C 107.872 -1.159 . . . . 10.0 107.872 -179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.8 mp -132.43 109.56 15.0 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 N-CA-C 105.629 -1.989 . . . . 10.0 105.629 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 36.7 mtt180 -106.15 116.15 31.44 Favored 'General case' 0 C--N 1.315 -0.904 0 O-C-N 126.802 2.564 . . . . 10.0 111.487 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.1 m -105.28 127.59 53.02 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 100.441 -3.911 . . . . 10.0 100.441 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 11.6 mt -117.29 98.28 6.35 Favored 'General case' 0 C--N 1.321 -0.662 1 N-CA-C 121.929 4.048 . . . . 10.0 121.929 179.772 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 82.7 p -108.72 138.75 44.54 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 126.926 2.09 . . . . 10.0 106.342 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -82.36 9.22 9.43 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 116.873 -1.537 . . . . 10.0 111.564 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 29.1 t80 -110.1 -46.62 3.43 Favored 'General case' 0 C--O 1.24 0.599 0 N-CA-C 108.27 -1.011 . . . . 10.0 108.27 -179.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 2.4 tpm_? -163.86 102.62 0.9 Allowed 'General case' 0 C--O 1.241 0.618 0 O-C-N 124.65 1.219 . . . . 10.0 111.93 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -76.05 170.09 16.94 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 120.737 -1.227 . . . . 10.0 111.435 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.459 ' CG ' ' O ' ' A' ' 60' ' ' TYR . 0.1 OUTLIER -151.44 56.19 0.87 Allowed 'General case' 0 C--O 1.214 -0.802 0 CA-C-O 125.088 2.375 . . . . 10.0 107.194 179.902 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.9 mm -39.79 134.15 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 O-C-N 120.429 -1.42 . . . . 10.0 114.593 -179.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -106.92 -178.06 3.54 Favored 'General case' 0 CA--C 1.513 -0.457 0 O-C-N 125.426 1.704 . . . . 10.0 107.345 -179.668 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -166.76 87.76 0.32 Allowed 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 101.878 -3.378 . . . . 10.0 101.878 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -93.2 164.87 13.08 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 116.249 1.944 . . . . 10.0 116.249 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.64 125.22 33.49 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 102.79 -3.041 . . . . 10.0 102.79 -179.715 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.475 ' CG2' ' HB2' ' A' ' 49' ' ' MET . 5.1 t -80.18 95.51 2.37 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 O-C-N 124.143 0.902 . . . . 10.0 112.803 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 102.8 39.8 2.64 Favored Glycine 0 CA--C 1.52 0.383 0 N-CA-C 114.99 0.756 . . . . 10.0 114.99 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -160.96 144.84 13.41 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 115.256 1.576 . . . . 10.0 115.256 -179.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -91.91 129.2 37.93 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 108.639 -0.874 . . . . 10.0 108.639 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 29.6 p90 -150.05 31.17 0.69 Allowed 'General case' 0 N--CA 1.439 -0.989 0 CA-C-O 116.113 -1.898 . . . . 10.0 113.413 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 12.6 pm0 36.18 84.53 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.773 0 O-C-N 126.243 2.215 . . . . 10.0 110.762 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -23.65 -43.51 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.959 0 O-C-N 126.764 2.54 . . . . 10.0 117.124 -179.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 73.29 89.68 0.09 Allowed 'General case' 0 C--O 1.224 -0.277 0 CA-C-N 113.223 -1.808 . . . . 10.0 109.871 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 8.6 mt -104.41 65.46 0.78 Allowed 'General case' 0 C--N 1.313 -0.988 0 O-C-N 121.145 -0.972 . . . . 10.0 112.798 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 11.0 p -107.99 33.22 4.22 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.447 -0.946 . . . . 10.0 108.447 179.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -116.98 -26.68 2.93 Favored Glycine 0 CA--C 1.509 -0.334 0 CA-C-O 117.617 -1.657 . . . . 10.0 113.277 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -132.11 -80.1 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.721 0 CA-C-N 119.202 1.501 . . . . 10.0 110.022 -179.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -87.52 36.85 0.76 Allowed 'General case' 0 N--CA 1.444 -0.768 0 CA-C-O 116.697 -1.621 . . . . 10.0 115.02 -179.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 25.0 t0 11.75 74.93 0.01 OUTLIER 'General case' 0 C--O 1.219 -0.501 0 O-C-N 126.283 2.24 . . . . 10.0 116.45 179.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.86 96.09 1.11 Allowed 'General case' 0 CA--C 1.508 -0.653 0 O-C-N 126.667 2.48 . . . . 10.0 114.299 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 11.1 ttpt -67.75 128.6 37.08 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 106.378 -1.712 . . . . 10.0 106.378 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 41.3 m -120.97 171.82 8.37 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 126.856 2.598 . . . . 10.0 108.159 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 18.5 mtt -95.54 107.35 19.52 Favored 'General case' 0 C--N 1.314 -0.977 1 N-CA-C 99.697 -4.186 . . . . 10.0 99.697 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 5.2 m -122.89 144.14 49.42 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 117.665 2.468 . . . . 10.0 117.665 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -136.52 125.61 24.49 Favored 'General case' 0 N--CA 1.441 -0.878 0 N-CA-C 107.661 -1.237 . . . . 10.0 107.661 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -100.1 149.62 5.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 N-CA-C 102.798 -3.038 . . . . 10.0 102.798 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -165.77 156.86 13.71 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 114.306 1.224 . . . . 10.0 114.306 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . 0.423 ' CZ3' HG11 ' A' ' 66' ' ' VAL . 0.0 OUTLIER -97.55 112.32 24.22 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 114.574 -1.194 . . . . 10.0 109.49 -179.829 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -118.8 85.03 2.29 Favored 'General case' 0 CA--C 1.532 0.288 1 N-CA-C 99.998 -4.075 . . . . 10.0 99.998 -179.774 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 92.93 -133.91 11.93 Favored Glycine 0 CA--C 1.498 -0.977 0 N-CA-C 105.308 -3.117 . . . . 10.0 105.308 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -104.43 35.17 2.81 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 122.841 0.457 . . . . 10.0 110.0 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 7.5 mtpt -128.18 172.33 11.1 Favored 'General case' 0 N--CA 1.463 0.18 0 O-C-N 126.506 2.379 . . . . 10.0 106.817 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -133.65 89.48 2.59 Favored 'General case' 0 C--N 1.323 -0.572 0 O-C-N 126.715 2.509 . . . . 10.0 107.275 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -76.16 154.99 34.97 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 116.465 -0.334 . . . . 10.0 110.828 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 3.3 m -144.27 133.74 23.34 Favored 'General case' 0 C--O 1.218 -0.587 0 O-C-N 126.212 2.195 . . . . 10.0 110.506 179.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -136.83 132.84 48.05 Favored 'Isoleucine or valine' 0 C--O 1.243 0.747 0 CA-C-N 113.42 -1.718 . . . . 10.0 107.395 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -118.54 121.1 39.42 Favored 'General case' 0 C--O 1.24 0.597 0 C-N-CA 124.36 1.064 . . . . 10.0 110.776 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 6.9 mttm -90.7 87.31 6.64 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 119.123 0.874 . . . . 10.0 109.979 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -131.11 75.55 0.42 Allowed Glycine 0 N--CA 1.438 -1.174 0 CA-C-O 116.458 -2.301 . . . . 10.0 114.082 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 28.04 39.74 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 117.549 2.426 . . . . 10.0 117.549 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 5.8 mmtt -131.46 160.01 36.41 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 115.31 1.596 . . . . 10.0 115.31 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -73.75 -37.95 64.88 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 112.676 -2.056 . . . . 10.0 108.829 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -135.78 134.0 6.97 Favored Glycine 0 C--O 1.222 -0.617 0 CA-C-O 117.201 -1.888 . . . . 10.0 113.681 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 173.72 106.07 0.01 OUTLIER 'General case' 0 N--CA 1.439 -0.983 0 O-C-N 124.91 1.006 . . . . 10.0 110.034 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 166.45 160.31 13.49 Favored Glycine 0 C--O 1.215 -1.063 0 N-CA-C 109.313 -1.515 . . . . 10.0 109.313 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 6.2 m0 -123.04 -179.65 4.35 Favored 'General case' 0 N--CA 1.442 -0.841 0 O-C-N 126.496 1.939 . . . . 10.0 109.268 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -164.47 151.55 11.46 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 104.163 -2.532 . . . . 10.0 104.163 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 3.4 tp-100 -140.32 151.98 45.48 Favored 'General case' 0 N--CA 1.444 -0.744 0 O-C-N 125.731 1.894 . . . . 10.0 108.808 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' TRP . . . . . 0.458 ' CD1' ' C ' ' A' ' 109' ' ' TRP . 0.0 OUTLIER -167.34 137.39 2.88 Favored 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 125.156 1.382 . . . . 10.0 107.529 179.977 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 33.6 mt -96.92 114.98 35.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 118.624 2.824 . . . . 10.0 118.624 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -95.97 161.75 13.86 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 102.645 -3.094 . . . . 10.0 102.645 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -57.75 106.25 0.75 Allowed Glycine 0 N--CA 1.443 -0.843 0 CA-C-O 118.571 -1.127 . . . . 10.0 110.835 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 69.34 11.76 8.18 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 126.133 1.725 . . . . 10.0 112.701 -179.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -151.86 120.57 6.53 Favored 'General case' 0 CA--C 1.499 -0.989 0 CA-C-O 124.712 2.196 . . . . 10.0 114.559 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.513 ' CD2' ' CD2' ' A' ' 8' ' ' TRP . 2.9 tp -78.07 138.06 38.57 Favored 'General case' 0 C--N 1.319 -0.717 0 CA-C-N 113.903 -1.498 . . . . 10.0 107.52 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -117.81 112.01 19.83 Favored 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 106.601 -1.629 . . . . 10.0 106.601 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 6.9 tp -122.65 131.83 53.99 Favored 'General case' 0 C--N 1.315 -0.921 0 C-N-CA 124.952 1.301 . . . . 10.0 107.922 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -135.81 151.93 50.57 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 106.183 -1.784 . . . . 10.0 106.183 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -156.39 160.42 39.63 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.328 -0.851 . . . . 10.0 109.641 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 3.4 mtm180 -138.82 179.55 6.42 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 117.289 -1.338 . . . . 10.0 114.042 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -173.62 132.5 0.45 Allowed 'General case' 0 CA--C 1.499 -1.016 0 O-C-N 125.269 1.606 . . . . 10.0 106.734 179.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 35.56 60.46 0.75 Allowed 'General case' 0 N--CA 1.475 0.821 0 O-C-N 126.669 2.481 . . . . 10.0 116.661 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 64.52 10.33 42.63 Favored Glycine 0 N--CA 1.444 -0.813 0 C-N-CA 123.877 0.751 . . . . 10.0 113.091 179.601 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 14.9 t -107.81 151.42 9.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 CA-C-N 118.958 1.379 . . . . 10.0 108.203 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 3.1 m -121.85 140.01 52.92 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 122.648 1.213 . . . . 10.0 112.279 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -137.77 175.23 9.77 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 113.165 -1.834 . . . . 10.0 106.466 -179.749 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 177.74 163.33 0.6 Allowed 'General case' 0 C--O 1.24 0.553 0 O-C-N 123.973 0.795 . . . . 10.0 111.309 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -131.01 133.51 45.83 Favored 'General case' 0 CA--C 1.5 -0.961 0 CA-C-N 115.708 -0.678 . . . . 10.0 111.461 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 55.5 t -100.21 90.56 1.94 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.43 0 C-N-CA 124.675 1.19 . . . . 10.0 109.68 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . 0.434 ' HB2' ' HB3' ' A' ' 115' ' ' LEU . 13.4 m-30 -81.96 166.57 19.74 Favored 'General case' 0 N--CA 1.442 -0.85 0 CA-C-O 122.557 1.17 . . . . 10.0 111.31 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.23 127.14 16.36 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 106.318 -1.734 . . . . 10.0 106.318 179.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 8.6 tttp -77.55 142.98 38.72 Favored 'General case' 0 CA--C 1.504 -0.807 0 N-CA-C 106.376 -1.713 . . . . 10.0 106.376 179.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 10.4 p -97.03 -14.26 7.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 119.369 0.986 . . . . 10.0 111.978 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 12.0 t-80 . . . . . 0 C--N 1.314 -0.946 0 O-C-N 126.315 2.259 . . . . 10.0 110.87 -179.958 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo . . . . . 0 N--CA 1.484 0.968 0 CA-C-O 123.068 1.195 . . . . 10.0 113.398 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 1.4 p -122.22 97.53 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 CA-C-N 113.553 -1.658 . . . . 10.0 109.502 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -56.54 117.22 3.65 Favored 'General case' 0 C--O 1.239 0.52 0 N-CA-C 113.89 1.07 . . . . 10.0 113.89 179.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.462 ' CE1' HD12 ' A' ' 110' ' ' ILE . 14.9 m-85 -85.45 24.32 1.2 Allowed 'General case' 0 C--O 1.243 0.719 0 O-C-N 121.119 -0.988 . . . . 10.0 111.759 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 13.2 m-80 -55.92 125.51 21.74 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 120.909 -1.12 . . . . 10.0 111.762 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 159.26 -163.38 33.35 Favored Glycine 0 C--O 1.214 -1.132 0 C-N-CA 117.963 -2.065 . . . . 10.0 116.409 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -122.7 173.26 7.84 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 105.058 -2.201 . . . . 10.0 105.058 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.46 ' CE3' HD13 ' A' ' 115' ' ' LEU . 1.1 m0 -169.56 98.58 0.33 Allowed 'General case' 0 N--CA 1.445 -0.698 0 O-C-N 125.306 1.629 . . . . 10.0 114.782 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.53 146.95 28.06 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 104.362 -2.458 . . . . 10.0 104.362 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.413 ' HB2' ' HE1' ' A' ' 10' ' ' MET . 0.0 OUTLIER -93.39 132.4 37.67 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 117.554 -1.658 . . . . 10.0 114.447 179.794 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -80.92 -54.98 5.1 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 113.731 -1.577 . . . . 10.0 110.07 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 33.9 m -156.47 130.79 8.68 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 115.598 1.703 . . . . 10.0 115.598 -179.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 5.1 p30 -116.18 171.36 7.86 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 112.534 -2.121 . . . . 10.0 105.521 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -136.57 -56.51 0.74 Allowed 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 116.703 2.112 . . . . 10.0 116.703 -179.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -92.96 51.05 1.62 Allowed 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 114.029 1.122 . . . . 10.0 114.029 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 27.9 t80 -71.72 -49.58 38.05 Favored 'General case' 0 C--O 1.243 0.761 0 CA-C-O 117.219 -1.372 . . . . 10.0 112.861 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.407 ' OE2' ' ND2' ' A' ' 34' ' ' ASN . 1.7 mp0 -72.66 -39.09 67.39 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 114.362 1.245 . . . . 10.0 114.362 -179.766 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.94 -24.7 63.39 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 121.831 0.824 . . . . 10.0 110.871 -179.816 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -74.63 -42.8 57.92 Favored 'General case' 0 C--N 1.319 -0.756 0 O-C-N 120.292 -1.505 . . . . 10.0 107.803 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 45.7 mt -75.92 -20.13 58.23 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-O 123.408 1.575 . . . . 10.0 109.64 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -79.7 -29.1 40.61 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 107.577 -1.268 . . . . 10.0 107.577 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.82 -23.23 64.24 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 120.427 -1.421 . . . . 10.0 111.977 -179.61 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 85.2 mt -102.42 -21.92 14.17 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 118.247 -0.882 . . . . 10.0 111.394 179.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 50.0 m-20 70.86 63.85 0.18 Allowed 'General case' 0 C--O 1.247 0.935 0 O-C-N 126.965 2.666 . . . . 10.0 114.561 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -93.1 167.22 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 106.203 -1.777 . . . . 10.0 106.203 179.811 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 43.9 t30 -43.67 159.02 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 117.154 2.279 . . . . 10.0 117.154 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.4 t -77.19 -40.92 30.33 Favored 'Isoleucine or valine' 0 C--O 1.232 0.158 0 CA-C-N 113.057 -1.883 . . . . 10.0 112.791 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.75 -33.9 71.29 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.212 -0.904 . . . . 10.0 111.798 -179.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 10.5 tt -72.31 -26.94 62.15 Favored 'General case' 0 C--O 1.218 -0.585 0 CA-C-N 115.662 -0.699 . . . . 10.0 111.969 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.1 -31.35 62.76 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 125.024 1.33 . . . . 10.0 110.535 179.703 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 30.4 tttp -78.24 -41.28 34.7 Favored 'General case' 0 N--CA 1.447 -0.606 0 O-C-N 123.735 0.647 . . . . 10.0 112.736 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 40.2 mt -75.46 -44.48 41.43 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.321 0 O-C-N 124.048 0.843 . . . . 10.0 111.623 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -63.12 -22.57 66.95 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.267 -0.879 . . . . 10.0 113.034 -179.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.407 ' ND2' ' OE2' ' A' ' 17' ' ' GLU . 49.4 t30 -81.25 -5.35 57.68 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 113.934 1.087 . . . . 10.0 113.934 179.761 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.5 13.05 36.16 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-O 116.711 -1.614 . . . . 10.0 112.859 -179.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -137.14 172.98 12.2 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 119.557 1.071 . . . . 10.0 110.184 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -127.94 102.29 22.15 Favored Pre-proline 0 C--O 1.24 0.601 0 N-CA-C 104.853 -2.277 . . . . 10.0 104.853 -179.593 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -57.56 87.57 0.05 OUTLIER 'Trans proline' 0 C--O 1.221 -0.374 0 N-CA-C 116.947 1.864 . . . . 10.0 116.947 179.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -61.55 152.57 30.0 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 122.165 0.983 . . . . 10.0 108.819 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -108.75 156.39 19.67 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.038 -1.437 . . . . 10.0 110.335 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -149.62 103.05 3.22 Favored 'General case' 0 N--CA 1.439 -1.007 0 N-CA-C 103.477 -2.786 . . . . 10.0 103.477 -179.866 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 5.0 mt -101.66 133.99 43.43 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 CA-C-N 115.586 -0.734 . . . . 10.0 111.885 179.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 47.2 t -136.66 90.62 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.883 0 N-CA-C 105.265 -2.124 . . . . 10.0 105.265 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 21.8 tt0 -90.0 126.76 35.87 Favored 'General case' 0 C--N 1.313 -0.983 0 O-C-N 125.6 1.813 . . . . 10.0 109.288 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -95.71 -22.48 17.52 Favored 'General case' 0 C--N 1.319 -0.747 0 O-C-N 120.571 -1.331 . . . . 10.0 108.829 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 140.34 -126.49 3.2 Favored Glycine 0 CA--C 1.534 1.243 0 N-CA-C 105.943 -2.863 . . . . 10.0 105.943 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -47.25 -30.75 3.23 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 119.737 1.769 . . . . 10.0 111.672 -179.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 40.7 m170 -102.37 128.46 48.94 Favored 'General case' 0 N--CA 1.444 -0.766 0 O-C-N 120.037 -1.664 . . . . 10.0 106.571 179.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 31.7 ttm -122.2 142.11 50.77 Favored 'General case' 0 N--CA 1.437 -1.102 0 O-C-N 119.698 -1.876 . . . . 10.0 112.374 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 10.1 mt -131.33 121.85 49.62 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.068 0 N-CA-C 107.383 -1.339 . . . . 10.0 107.383 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mp -116.16 125.98 73.46 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 N-CA-C 104.985 -2.228 . . . . 10.0 104.985 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.9 mtt85 -120.16 94.96 4.56 Favored 'General case' 0 C--O 1.214 -0.766 0 O-C-N 126.069 2.106 . . . . 10.0 109.074 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.8 m -83.16 113.5 20.68 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 101.323 -3.584 . . . . 10.0 101.323 -179.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 6.6 mp -102.74 93.97 5.37 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 118.267 2.691 . . . . 10.0 118.267 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -100.21 132.0 45.83 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 104.413 -2.439 . . . . 10.0 104.413 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 8.4 p -46.88 -28.57 1.63 Allowed 'General case' 0 CA--C 1.545 0.776 0 O-C-N 125.252 1.595 . . . . 10.0 109.041 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -106.01 99.79 9.36 Favored 'General case' 0 C--O 1.245 0.817 0 C-N-CA 125.048 1.339 . . . . 10.0 110.446 -179.609 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 67.79 149.74 0.06 Allowed 'General case' 0 C--N 1.321 -0.659 0 O-C-N 126.697 2.498 . . . . 10.0 110.743 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -108.73 150.37 27.68 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 113.594 -1.639 . . . . 10.0 110.785 179.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 6.5 t80 -137.59 84.67 2.06 Favored 'General case' 0 N--CA 1.434 -1.244 0 CA-C-N 114.035 -1.438 . . . . 10.0 107.468 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -102.99 157.33 4.94 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-N 120.492 1.496 . . . . 10.0 112.488 179.821 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 2.4 mtp -134.82 158.97 42.83 Favored 'General case' 0 C--N 1.32 -0.686 0 O-C-N 126.378 2.299 . . . . 10.0 107.826 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -145.55 95.84 2.72 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 100.79 -3.782 . . . . 10.0 100.79 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.426 ' CD2' HG21 ' A' ' 86' ' ' VAL . 8.6 m-30 -116.87 163.38 16.28 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 117.026 2.232 . . . . 10.0 117.026 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 82.2 mt-30 -117.23 116.33 27.05 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 103.611 -2.737 . . . . 10.0 103.611 179.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.9 t -66.95 138.99 21.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 124.025 1.869 . . . . 10.0 109.483 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 66.06 24.39 71.73 Favored Glycine 0 C--N 1.336 0.553 0 CA-C-N 114.081 -1.418 . . . . 10.0 113.818 179.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 11.7 mttt -141.41 158.22 44.15 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 118.417 -1.313 . . . . 10.0 113.389 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -72.74 167.88 19.94 Favored 'General case' 0 C--N 1.316 -0.885 0 O-C-N 124.87 1.357 . . . . 10.0 109.145 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -157.48 -175.28 5.31 Favored 'General case' 0 C--O 1.247 0.941 0 C-N-CA 124.482 1.113 . . . . 10.0 110.547 -179.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -163.14 127.51 2.96 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 105.304 -2.11 . . . . 10.0 105.304 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -120.17 169.51 10.17 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 114.913 -1.039 . . . . 10.0 113.543 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -100.22 -15.24 18.17 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 107.258 -1.386 . . . . 10.0 107.258 179.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.415 ' HA ' ' HB2' ' A' ' 79' ' ' ASP . 3.3 pp -141.72 -174.64 4.12 Favored 'General case' 0 C--N 1.314 -0.954 0 O-C-N 125.495 1.747 . . . . 10.0 114.706 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.422 HG21 ' HA ' ' A' ' 79' ' ' ASP . 0.5 OUTLIER -141.88 -76.1 0.29 Allowed 'General case' 0 C--O 1.218 -0.582 0 N-CA-C 106.899 -1.519 . . . . 10.0 106.899 179.829 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -130.78 76.33 0.41 Allowed Glycine 0 C--O 1.238 0.37 0 CA-C-O 119.702 -0.499 . . . . 10.0 112.273 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 19.5 mt 64.63 -71.22 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.714 0 CA-C-O 118.262 -0.875 . . . . 10.0 109.928 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -45.25 -29.81 1.08 Allowed 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 124.917 1.287 . . . . 10.0 110.536 -179.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . 0.422 ' HA ' HG21 ' A' ' 75' ' ' THR . 2.8 p30 56.25 168.77 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 129.386 3.074 . . . . 10.0 118.595 179.348 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.9 ttm-85 169.03 118.23 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 116.107 -1.902 . . . . 10.0 108.134 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 23.3 mtpt -47.52 121.19 3.76 Favored 'General case' 0 C--N 1.314 -0.973 0 O-C-N 125.336 1.648 . . . . 10.0 107.583 -179.545 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -133.93 170.61 15.36 Favored 'General case' 0 C--N 1.315 -0.901 0 O-C-N 125.933 2.021 . . . . 10.0 109.696 179.868 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 4.3 mtp -126.75 98.43 5.37 Favored 'General case' 0 N--CA 1.44 -0.964 1 N-CA-C 100.063 -4.051 . . . . 10.0 100.063 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 26.1 m -99.94 131.24 46.03 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 124.371 2.034 . . . . 10.0 114.762 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 1.2 m -115.88 128.93 56.18 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 112.773 -2.012 . . . . 10.0 107.032 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.426 HG21 ' CD2' ' A' ' 64' ' ' PHE . 2.2 t -106.2 127.32 61.51 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.929 0 N-CA-C 103.384 -2.821 . . . . 10.0 103.384 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.2 t -151.13 147.11 26.65 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 123.143 1.449 . . . . 10.0 111.547 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 2.2 p-90 -95.75 130.4 42.68 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 105.589 -2.004 . . . . 10.0 105.589 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -78.3 -51.17 10.53 Favored 'General case' 0 C--O 1.247 0.93 1 N-CA-C 99.904 -4.11 . . . . 10.0 99.904 179.888 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -157.25 -76.55 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.445 0 N-CA-C 108.192 -1.963 . . . . 10.0 108.192 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -114.48 19.05 16.45 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 115.103 1.52 . . . . 10.0 115.103 179.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 9.0 mttm -129.98 -171.96 2.66 Favored 'General case' 0 C--O 1.244 0.792 0 CA-C-O 118.24 -0.886 . . . . 10.0 108.725 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.3 tt -137.34 131.92 32.86 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 104.57 -2.382 . . . . 10.0 104.57 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -137.43 -173.62 3.53 Favored 'General case' 0 C--O 1.219 -0.508 0 N-CA-C 114.78 1.4 . . . . 10.0 114.78 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 1.1 m -156.33 137.28 13.53 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 118.817 0.735 . . . . 10.0 110.156 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 3.7 t -95.8 -52.83 8.9 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 N-CA-C 106.845 -1.539 . . . . 10.0 106.845 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 1.9 mm-40 71.44 114.37 0.05 Allowed 'General case' 0 C--O 1.244 0.809 0 C-N-CA 127.395 2.278 . . . . 10.0 109.572 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 13.4 mttt -97.21 74.58 2.54 Favored 'General case' 0 C--N 1.343 0.306 0 CA-C-O 116.756 -1.593 . . . . 10.0 112.41 -179.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -107.5 -93.22 2.29 Favored Glycine 0 N--CA 1.451 -0.305 0 O-C-N 125.473 1.733 . . . . 10.0 109.967 179.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -167.55 -39.01 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 117.553 2.427 . . . . 10.0 117.553 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.05 146.34 11.43 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 113.808 1.04 . . . . 10.0 113.808 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -78.82 83.37 4.95 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 125.08 1.352 . . . . 10.0 112.341 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 142.23 -1.75 1.71 Allowed Glycine 0 C--O 1.219 -0.802 0 O-C-N 126.516 2.385 . . . . 10.0 115.544 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 23.7 mtt180 -52.63 161.81 0.66 Allowed 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 118.572 1.186 . . . . 10.0 112.835 -179.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 107.65 152.88 17.82 Favored Glycine 0 C--O 1.224 -0.485 0 CA-C-N 112.522 -2.126 . . . . 10.0 110.562 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' TRP . . . . . 0.423 ' CD1' ' N ' ' A' ' 106' ' ' TRP . 0.0 OUTLIER -117.39 179.28 4.09 Favored 'General case' 0 C--N 1.33 -0.249 0 O-C-N 120.198 -1.766 . . . . 10.0 110.246 179.909 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -153.51 99.08 2.3 Favored 'General case' 0 CA--C 1.503 -0.839 0 O-C-N 124.748 1.28 . . . . 10.0 108.517 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 62.4 mt-30 -98.49 147.41 24.78 Favored 'General case' 0 C--O 1.239 0.52 0 O-C-N 126.564 2.415 . . . . 10.0 112.309 -179.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -169.41 128.76 1.01 Allowed 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 105.966 -1.864 . . . . 10.0 105.966 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.462 HD12 ' CE1' ' A' ' 4' ' ' PHE . 69.5 mt -88.56 160.28 2.86 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.802 0 N-CA-C 116.894 2.183 . . . . 10.0 116.894 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -139.28 63.04 1.51 Allowed 'General case' 0 N--CA 1.463 0.194 0 O-C-N 126.36 2.287 . . . . 10.0 106.474 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 72.89 -98.64 0.88 Allowed Glycine 0 CA--C 1.531 1.036 0 N-CA-C 107.928 -2.069 . . . . 10.0 107.928 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -108.13 19.63 19.71 Favored 'General case' 0 C--N 1.321 -0.655 0 O-C-N 121.453 -1.028 . . . . 10.0 113.078 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -128.86 95.8 4.19 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 120.554 -1.341 . . . . 10.0 111.071 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.46 HD13 ' CE3' ' A' ' 8' ' ' TRP . 0.2 OUTLIER -64.89 120.1 11.91 Favored 'General case' 0 C--N 1.319 -0.738 0 O-C-N 121.123 -0.985 . . . . 10.0 109.677 -179.838 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 5.0 t60 -109.97 103.28 12.01 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 107.083 -1.451 . . . . 10.0 107.083 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -110.09 115.94 30.66 Favored 'General case' 0 C--N 1.321 -0.653 0 O-C-N 125.237 1.586 . . . . 10.0 109.11 -179.853 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -108.83 90.99 3.46 Favored 'General case' 0 CA--C 1.507 -0.711 0 N-CA-C 105.408 -2.071 . . . . 10.0 105.408 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -78.01 154.93 31.03 Favored 'General case' 0 N--CA 1.443 -0.823 0 C-N-CA 126.336 1.854 . . . . 10.0 111.15 179.776 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -136.98 137.62 39.68 Favored 'General case' 0 C--N 1.319 -0.734 0 O-C-N 126.027 2.079 . . . . 10.0 113.809 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -160.91 129.97 4.72 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 116.362 -1.78 . . . . 10.0 109.291 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 40.23 49.42 2.46 Favored 'General case' 0 C--O 1.241 0.647 0 N-CA-C 115.639 1.718 . . . . 10.0 115.639 -179.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 70.49 16.87 74.1 Favored Glycine 0 CA--C 1.538 1.512 0 CA-C-O 115.945 -2.586 . . . . 10.0 115.847 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 4.0 m -108.1 169.45 3.04 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 O-C-N 125.723 1.484 . . . . 10.0 108.698 179.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 2.7 m -136.39 91.08 2.63 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.98 -0.554 . . . . 10.0 111.573 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 26.2 t -95.23 99.62 11.55 Favored 'General case' 0 C--O 1.216 -0.66 0 N-CA-C 105.691 -1.966 . . . . 10.0 105.691 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.33 151.01 22.4 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 114.055 -1.429 . . . . 10.0 109.564 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 14.1 mt-30 -144.4 125.5 14.53 Favored 'General case' 0 C--N 1.315 -0.911 0 O-C-N 126.136 2.147 . . . . 10.0 113.462 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 19.4 t -91.03 114.4 28.31 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 107.077 -1.453 . . . . 10.0 107.077 -179.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . 0.432 ' HB3' ' CD1' ' A' ' 8' ' ' TRP . 89.5 m-85 -101.99 177.21 4.96 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.661 -0.866 . . . . 10.0 108.661 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -148.17 120.06 8.16 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 106.339 -1.726 . . . . 10.0 106.339 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -79.64 125.58 29.81 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 117.86 -1.536 . . . . 10.0 107.632 -179.619 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 18.3 t -82.61 -66.18 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-O 117.934 -1.031 . . . . 10.0 109.996 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.255 1.364 0 O-C-N 125.289 1.618 . . . . 10.0 109.711 179.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.482 0.852 0 CA-C-O 118.287 -0.797 . . . . 10.0 112.575 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 60.0 t 73.65 -56.77 0.28 Allowed 'Isoleucine or valine' 0 C--O 1.241 0.632 0 C-N-CA 125.167 1.387 . . . . 10.0 110.44 179.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 62.49 -68.33 0.07 Allowed 'General case' 0 C--N 1.32 -0.692 0 O-C-N 126.53 2.394 . . . . 10.0 112.59 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.424 ' CZ ' HD11 ' A' ' 110' ' ' ILE . 0.2 OUTLIER 68.1 -28.97 0.15 Allowed 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 117.296 2.332 . . . . 10.0 117.296 179.971 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -37.39 115.14 0.38 Allowed 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 116.499 2.037 . . . . 10.0 116.499 179.695 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -176.16 164.19 33.98 Favored Glycine 0 CA--C 1.527 0.808 0 N-CA-C 117.384 1.714 . . . . 10.0 117.384 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 16.9 m-30 -94.96 141.92 28.08 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 101.138 -3.653 . . . . 10.0 101.138 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.434 ' CE3' ' HB2' ' A' ' 115' ' ' LEU . 57.8 m95 -134.82 85.73 2.2 Favored 'General case' 0 C--N 1.313 -1.0 0 O-C-N 126.012 2.07 . . . . 10.0 111.591 179.726 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.06 149.39 27.82 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 104.912 -2.255 . . . . 10.0 104.912 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.434 ' HE1' ' CZ ' ' A' ' 130' ' ' PHE . 27.4 ttm -99.93 150.09 22.76 Favored 'General case' 0 N--CA 1.444 -0.748 0 N-CA-C 115.171 1.545 . . . . 10.0 115.171 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.8 mp -108.71 -64.71 1.2 Allowed 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 113.394 -1.73 . . . . 10.0 107.281 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -156.42 154.61 30.74 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 117.023 2.231 . . . . 10.0 117.023 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -113.8 165.79 12.21 Favored 'General case' 0 CA--C 1.509 -0.616 0 O-C-N 128.406 3.566 . . . . 10.0 109.154 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -142.37 138.06 30.92 Favored 'General case' 0 C--O 1.24 0.565 0 O-C-N 120.659 -1.275 . . . . 10.0 112.962 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 60.79 17.71 7.94 Favored 'General case' 0 C--O 1.247 0.959 0 CA-C-O 124.737 2.208 . . . . 10.0 115.686 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -52.24 -50.48 61.94 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 116.607 -3.808 . . . . 10.0 115.966 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 59.7 mt-10 -63.33 -30.43 71.57 Favored 'General case' 0 C--O 1.219 -0.535 0 N-CA-C 114.748 1.388 . . . . 10.0 114.748 179.496 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -79.87 -28.99 39.92 Favored 'General case' 0 C--N 1.328 -0.361 0 O-C-N 127.022 2.701 . . . . 10.0 109.989 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -65.5 -53.26 44.95 Favored 'General case' 0 C--N 1.317 -0.823 0 O-C-N 124.209 0.943 . . . . 10.0 111.369 179.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 12.8 mt -65.45 -21.7 66.68 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 114.091 1.145 . . . . 10.0 114.091 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -71.18 -31.41 67.62 Favored 'General case' 0 C--N 1.317 -0.81 0 C-N-CA 124.316 1.046 . . . . 10.0 110.534 -179.776 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.68 -48.64 79.89 Favored 'General case' 0 CA--C 1.531 0.24 0 O-C-N 125.204 1.565 . . . . 10.0 113.396 179.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -90.76 -12.3 36.96 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.406 -1.27 . . . . 10.0 109.167 179.906 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.2 t0 55.83 57.82 4.91 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 114.512 -1.222 . . . . 10.0 113.529 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 14.5 m -73.37 -164.8 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-N 114.703 -1.135 . . . . 10.0 109.123 -179.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -64.17 140.83 58.91 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 116.232 1.938 . . . . 10.0 116.232 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.4 p -60.15 -39.14 79.67 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.945 0 C-N-CA 126.188 1.795 . . . . 10.0 115.775 179.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.63 -21.16 64.49 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 114.16 -1.382 . . . . 10.0 111.043 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.41 -43.18 23.87 Favored 'General case' 0 C--O 1.218 -0.603 0 O-C-N 124.773 1.296 . . . . 10.0 110.719 -179.762 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.5 ttm180 -59.58 -34.12 72.31 Favored 'General case' 0 C--O 1.243 0.763 0 C-N-CA 125.709 1.604 . . . . 10.0 114.291 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.0 ttpt -75.89 -46.73 28.6 Favored 'General case' 0 N--CA 1.438 -1.032 0 O-C-N 125.715 1.885 . . . . 10.0 112.659 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 7.8 mm -76.19 -39.36 35.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 O-C-N 121.427 -0.796 . . . . 10.0 111.451 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -63.64 -24.23 67.71 Favored 'General case' 0 C--O 1.215 -0.752 0 N-CA-C 115.732 1.752 . . . . 10.0 115.732 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -65.32 -56.54 12.06 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 119.522 -0.871 . . . . 10.0 109.903 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.5 pp -79.89 0.87 29.38 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 113.031 0.752 . . . . 10.0 113.031 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 12.3 tp -105.68 125.1 50.6 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 124.451 1.094 . . . . 10.0 108.728 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.56 103.06 53.08 Favored Pre-proline 0 C--N 1.316 -0.862 0 CA-C-N 120.463 1.483 . . . . 10.0 109.582 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -70.59 112.41 3.22 Favored 'Trans proline' 0 C--N 1.354 0.826 0 CA-C-O 123.906 1.544 . . . . 10.0 114.516 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -71.5 169.61 15.07 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 114.407 -1.27 . . . . 10.0 109.443 -179.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.6 mtmt -136.58 153.21 51.03 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-O 122.575 1.178 . . . . 10.0 112.527 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -142.1 115.35 8.89 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 103.003 -2.962 . . . . 10.0 103.003 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.414 HD12 ' NE1' ' A' ' 8' ' ' TRP . 61.7 mt -100.49 147.65 7.58 Favored 'Isoleucine or valine' 0 C--O 1.247 0.925 0 N-CA-C 108.757 -0.831 . . . . 10.0 108.757 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.5 t -147.96 130.32 7.05 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.836 0 N-CA-C 105.727 -1.953 . . . . 10.0 105.727 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -132.56 151.98 51.75 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 122.68 1.229 . . . . 10.0 109.667 -179.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -149.82 100.47 2.96 Favored 'General case' 0 N--CA 1.444 -0.763 0 N-CA-C 106.876 -1.528 . . . . 10.0 106.876 179.841 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.17 -115.49 4.04 Favored Glycine 0 C--N 1.345 1.045 0 N-CA-C 109.056 -1.618 . . . . 10.0 109.056 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -119.12 18.46 13.09 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 108.62 -0.882 . . . . 10.0 108.62 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 7.6 t-160 -107.85 122.24 46.39 Favored 'General case' 0 CA--C 1.508 -0.671 0 N-CA-C 106.601 -1.629 . . . . 10.0 106.601 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 4.1 ttt -109.68 134.43 51.98 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 114.333 1.234 . . . . 10.0 114.333 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 7.1 mt -118.63 98.79 6.85 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.994 0 N-CA-C 107.751 -1.204 . . . . 10.0 107.751 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.0 mp -89.0 131.37 36.5 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.969 0 N-CA-C 105.527 -2.027 . . . . 10.0 105.527 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 22.0 mtm180 -129.31 133.96 47.7 Favored 'General case' 0 C--O 1.215 -0.745 0 N-CA-C 113.506 0.928 . . . . 10.0 113.506 -179.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 54.1 m -114.13 99.37 7.58 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 101.048 -3.686 . . . . 10.0 101.048 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 8.4 mt -99.41 133.22 44.04 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 120.194 3.405 . . . . 10.0 120.194 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -158.33 155.26 28.46 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 126.679 1.992 . . . . 10.0 105.683 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 7.0 t -87.05 -1.96 58.27 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 105.753 -1.943 . . . . 10.0 105.753 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -124.49 102.41 7.63 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 105.27 -2.122 . . . . 10.0 105.27 179.761 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 63.85 129.83 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 125.434 2.54 . . . . 10.0 110.825 179.799 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -150.28 157.24 42.86 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-O 125.15 2.405 . . . . 10.0 110.376 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 32.3 p90 -152.25 139.74 19.62 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 104.743 -2.317 . . . . 10.0 104.743 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.0 mp -130.87 139.64 50.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 O-C-N 125.299 1.625 . . . . 10.0 111.443 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 5.0 ptp -115.89 179.78 3.88 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 127.322 2.249 . . . . 10.0 104.975 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -157.08 102.93 1.99 Allowed 'General case' 0 N--CA 1.441 -0.876 0 N-CA-C 102.575 -3.12 . . . . 10.0 102.575 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -114.47 160.67 18.94 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 117.696 2.48 . . . . 10.0 117.696 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 5.6 mm-40 -116.31 152.01 34.71 Favored 'General case' 0 C--O 1.216 -0.706 0 N-CA-C 107.734 -1.21 . . . . 10.0 107.734 179.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 14.7 t -95.19 115.9 35.25 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 CA-C-O 123.492 1.615 . . . . 10.0 111.062 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 79.41 23.94 61.91 Favored Glycine 0 C--O 1.224 -0.481 0 CA-C-N 113.943 -1.481 . . . . 10.0 113.729 179.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.86 145.08 51.33 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 123.346 0.658 . . . . 10.0 111.145 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 66.5 tt0 -68.95 165.17 20.58 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 107.56 -1.274 . . . . 10.0 107.56 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -160.26 131.44 5.76 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 122.741 1.258 . . . . 10.0 112.465 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -96.24 67.52 2.56 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.514 -1.221 . . . . 10.0 109.916 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 57.1 tt0 -58.79 125.11 22.13 Favored 'General case' 0 N--CA 1.442 -0.865 0 O-C-N 126.798 2.561 . . . . 10.0 115.985 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -111.61 105.11 13.56 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-O 122.853 1.311 . . . . 10.0 108.337 179.729 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 20.9 mt -80.53 137.39 36.42 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 114.752 -1.113 . . . . 10.0 113.587 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 53.8 p -120.2 105.38 10.91 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 106.155 -1.794 . . . . 10.0 106.155 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 98.79 -169.39 23.17 Favored Glycine 0 C--O 1.243 0.69 0 CA-C-O 117.171 -1.905 . . . . 10.0 108.98 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER 39.64 54.11 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 O-C-N 126.739 2.082 . . . . 10.0 110.474 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 5.0 t70 86.97 -26.85 0.08 Allowed 'General case' 0 C--O 1.239 0.526 0 O-C-N 126.126 2.141 . . . . 10.0 112.426 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 47.07 100.24 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 123.947 1.832 . . . . 10.0 115.931 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.89 93.73 1.98 Allowed 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 114.222 -1.354 . . . . 10.0 110.187 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 5.4 pttt -58.44 141.02 52.84 Favored 'General case' 0 N--CA 1.444 -0.743 0 N-CA-C 104.51 -2.404 . . . . 10.0 104.51 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -134.64 -177.3 4.55 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 113.715 -1.584 . . . . 10.0 110.002 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 25.6 mtm -119.85 66.15 0.81 Allowed 'General case' 0 CA--C 1.503 -0.844 0 N-CA-C 102.564 -3.125 . . . . 10.0 102.564 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 96.7 m -72.17 139.12 48.09 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 117.623 2.453 . . . . 10.0 117.623 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -120.63 116.64 25.73 Favored 'General case' 0 C--N 1.319 -0.752 0 O-C-N 126.955 2.659 . . . . 10.0 105.566 179.782 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 1.4 t -107.36 146.89 13.01 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 O-C-N 126.961 2.663 . . . . 10.0 104.407 179.647 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.9 t -148.78 -173.83 4.46 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 123.65 0.78 . . . . 10.0 109.091 -179.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 1.1 p-90 -151.65 122.71 7.64 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 106.834 -1.543 . . . . 10.0 106.834 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -112.24 56.67 0.66 Allowed 'General case' 0 CA--C 1.5 -0.976 0 N-CA-C 101.648 -3.464 . . . . 10.0 101.648 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 117.43 -154.0 16.94 Favored Glycine 0 C--N 1.338 0.659 0 N-CA-C 104.92 -3.272 . . . . 10.0 104.92 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 12.0 t0 -82.85 58.63 4.42 Favored 'General case' 0 C--O 1.219 -0.528 0 O-C-N 120.024 -1.868 . . . . 10.0 112.027 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.5 mtmt -136.03 -172.11 3.04 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 122.644 1.211 . . . . 10.0 108.249 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 1.5 tp -152.64 98.29 2.34 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 108.385 -0.968 . . . . 10.0 108.385 -179.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.31 138.31 40.25 Favored 'General case' 0 C--O 1.216 -0.688 0 CA-C-O 121.863 0.84 . . . . 10.0 110.023 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 7.7 m -128.81 143.99 51.05 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 123.784 0.834 . . . . 10.0 111.7 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 23.8 t -137.46 110.48 7.75 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 N-CA-C 105.157 -2.164 . . . . 10.0 105.157 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 -101.65 127.29 48.45 Favored 'General case' 0 C--O 1.244 0.79 0 C-N-CA 123.219 0.608 . . . . 10.0 110.041 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 1.3 pttt -114.62 88.39 2.85 Favored 'General case' 0 C--O 1.233 0.204 0 N-CA-C 113.06 0.763 . . . . 10.0 113.06 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -115.17 -91.49 1.77 Allowed Glycine 0 N--CA 1.437 -1.252 0 N-CA-C 110.361 -1.096 . . . . 10.0 110.361 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -134.83 -8.15 2.4 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 116.966 2.21 . . . . 10.0 116.966 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.04 -177.53 4.52 Favored 'General case' 0 C--N 1.326 -0.423 0 O-C-N 126.682 2.489 . . . . 10.0 113.856 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -123.04 30.64 6.29 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 126.962 2.105 . . . . 10.0 112.869 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -161.93 -19.32 0.03 OUTLIER Glycine 0 N--CA 1.467 0.758 0 N-CA-C 119.855 2.702 . . . . 10.0 119.855 -179.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 1.5 mtt180 -51.42 116.12 1.92 Allowed 'General case' 0 C--O 1.223 -0.339 0 CA-C-O 124.133 1.921 . . . . 10.0 110.989 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 165.11 150.39 6.18 Favored Glycine 0 CA--C 1.518 0.26 0 N-CA-C 108.963 -1.655 . . . . 10.0 108.963 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -135.27 -173.05 3.22 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-N 114.181 -1.01 . . . . 10.0 112.227 -179.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 35.5 m -165.63 136.03 3.64 Favored 'General case' 0 N--CA 1.443 -0.782 0 C-N-CA 124.651 1.18 . . . . 10.0 108.544 -179.767 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -125.94 103.75 7.92 Favored 'General case' 0 C--O 1.244 0.807 0 C-N-CA 126.675 1.99 . . . . 10.0 108.944 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' TRP . . . . . 0.476 ' CD1' ' C ' ' A' ' 109' ' ' TRP . 0.0 OUTLIER -100.9 161.48 13.56 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 106.254 -1.758 . . . . 10.0 106.254 -179.805 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.424 HD11 ' CZ ' ' A' ' 4' ' ' PHE . 0.6 OUTLIER -131.28 143.03 41.87 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.028 0 N-CA-C 114.957 1.466 . . . . 10.0 114.957 179.999 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -136.59 90.14 2.53 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 112.703 -2.044 . . . . 10.0 108.993 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 47.4 -91.86 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.672 0 N-CA-C 109.278 -1.529 . . . . 10.0 109.278 179.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -96.94 -19.83 18.53 Favored 'General case' 0 C--N 1.333 -0.146 0 O-C-N 120.57 -1.547 . . . . 10.0 113.95 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -98.09 148.87 23.1 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 121.162 1.801 . . . . 10.0 113.937 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.434 ' HB2' ' CE3' ' A' ' 8' ' ' TRP . 13.7 tp -116.53 138.0 51.73 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 106.483 -1.673 . . . . 10.0 106.483 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 48.3 m80 -132.76 89.38 2.63 Favored 'General case' 0 C--N 1.315 -0.928 0 O-C-N 121.006 -1.058 . . . . 10.0 108.62 -179.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 31.6 tp -94.68 142.95 26.85 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 114.317 -1.31 . . . . 10.0 109.686 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -140.78 107.5 5.36 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 119.239 -0.984 . . . . 10.0 108.769 179.904 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 6.4 mtt -87.83 149.3 24.22 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 109.446 -0.575 . . . . 10.0 109.446 179.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -133.61 142.93 48.33 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 118.814 0.734 . . . . 10.0 109.481 179.616 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -154.27 134.5 13.28 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 108.828 -0.805 . . . . 10.0 108.828 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 36.0 44.14 0.24 Allowed 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 116.298 1.962 . . . . 10.0 116.298 -179.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 91.46 2.35 70.46 Favored Glycine 0 N--CA 1.468 0.807 0 CA-C-O 118.15 -1.361 . . . . 10.0 115.878 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -109.9 162.56 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 CA-C-N 120.398 2.099 . . . . 10.0 109.667 179.873 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 20.9 m -135.92 101.68 4.81 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 114.966 1.469 . . . . 10.0 114.966 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -86.09 143.78 27.88 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 107.538 -1.282 . . . . 10.0 107.538 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 2.1 mttt -140.17 118.8 12.32 Favored 'General case' 0 C--N 1.322 -0.612 0 O-C-N 124.081 0.863 . . . . 10.0 111.539 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -111.02 130.01 55.72 Favored 'General case' 0 C--O 1.244 0.811 0 O-C-N 125.068 1.48 . . . . 10.0 113.106 -179.491 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 4.8 t -97.58 127.12 50.22 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-O 122.302 1.048 . . . . 10.0 111.516 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . 0.434 ' CZ ' ' HE1' ' A' ' 10' ' ' MET . 0.0 OUTLIER -121.39 155.7 34.24 Favored 'General case' 0 N--CA 1.443 -0.793 0 C-N-CA 126.156 1.782 . . . . 10.0 110.646 179.952 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 4.9 tptt -125.59 120.45 30.85 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 105.128 -2.175 . . . . 10.0 105.128 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.81 116.14 8.15 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 120.928 1.694 . . . . 10.0 111.182 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 27.6 m -122.98 52.29 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 113.772 1.027 . . . . 10.0 113.772 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 . . . . . 0 C--O 1.242 0.7 0 CA-C-N 114.639 -1.164 . . . . 10.0 113.701 -180.0 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo . . . . . 0 N--CA 1.48 0.69 0 N-CA-C 108.901 -1.23 . . . . 10.0 108.901 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 14.5 p -78.9 154.63 4.87 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.417 0 O-C-N 126.184 2.177 . . . . 10.0 112.815 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -96.04 126.16 41.08 Favored 'General case' 0 C--N 1.329 -0.309 0 O-C-N 120.899 -1.126 . . . . 10.0 110.394 -179.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -128.74 -39.3 1.63 Allowed 'General case' 0 C--O 1.241 0.629 0 N-CA-C 117.531 2.419 . . . . 10.0 117.531 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -50.24 137.91 17.32 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 115.665 1.728 . . . . 10.0 115.665 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -167.04 -97.33 0.11 Allowed Glycine 0 C--N 1.341 0.827 0 CA-C-O 125.011 2.451 . . . . 10.0 112.903 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . 0.492 ' CB ' ' CG1' ' A' ' 133' ' ' VAL . 0.1 OUTLIER 178.4 178.28 0.4 Allowed 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 104.626 -2.361 . . . . 10.0 104.626 -179.833 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.533 ' CD2' ' HB2' ' A' ' 39' ' ' ASP 0.297 36.0 p-90 -147.4 -179.6 6.97 Favored 'General case' 0 C--N 1.317 -0.809 0 O-C-N 127.403 2.939 . . . . 10.0 113.846 -178.384 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.2 ptmm? 166.42 99.8 0.0 OUTLIER 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 111.756 -2.475 . . . . 10.0 108.564 178.678 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.48 148.54 48.36 Favored 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 125.139 1.525 . . . . 10.0 114.44 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -113.25 -10.93 13.29 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.263 -0.881 . . . . 10.0 109.572 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 42.3 t -172.06 168.19 5.89 Favored 'General case' 0 CA--C 1.515 -0.377 0 N-CA-C 115.199 1.555 . . . . 10.0 115.199 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.4 t-20 -163.76 122.97 2.02 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 105.198 -2.149 . . . . 10.0 105.198 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -125.28 178.09 5.78 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 119.734 1.152 . . . . 10.0 111.278 -179.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 37.7 m-20 34.22 33.59 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.478 0 O-C-N 127.057 2.723 . . . . 10.0 112.298 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -68.42 -42.87 78.31 Favored 'General case' 0 CA--C 1.546 0.796 0 O-C-N 120.018 -1.676 . . . . 10.0 112.939 179.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 74.7 mt-10 -71.22 -34.48 70.87 Favored 'General case' 0 N--CA 1.464 0.238 0 O-C-N 120.317 -1.489 . . . . 10.0 112.55 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -74.58 -34.43 62.89 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 106.968 -1.493 . . . . 10.0 106.968 179.524 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -69.63 -27.9 65.46 Favored 'General case' 0 C--O 1.245 0.832 0 O-C-N 126.04 2.088 . . . . 10.0 109.079 179.587 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 44.5 mt -79.0 -25.59 43.33 Favored 'General case' 0 C--O 1.22 -0.479 0 N-CA-C 112.652 0.612 . . . . 10.0 112.652 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 17.3 tpt180 -79.11 -20.37 48.82 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 113.629 -1.623 . . . . 10.0 109.437 179.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.68 -44.42 96.3 Favored 'General case' 0 C--O 1.213 -0.847 0 C-N-CA 126.383 1.873 . . . . 10.0 113.228 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -84.88 -21.56 29.69 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 123.714 1.721 . . . . 10.0 109.712 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.9 t0 74.45 67.73 0.09 Allowed 'General case' 0 N--CA 1.48 1.027 0 CA-C-N 113.404 -1.725 . . . . 10.0 113.519 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 5.8 m -98.44 -176.89 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.469 0 N-CA-C 105.316 -2.105 . . . . 10.0 105.316 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.43 133.54 55.17 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-O 123.617 1.675 . . . . 10.0 113.411 -179.771 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 4.2 m -63.69 -31.77 54.34 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 N-CA-C 116.409 2.003 . . . . 10.0 116.409 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -74.14 -30.22 62.18 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-O 123.593 1.663 . . . . 10.0 108.829 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 60.8 tp -73.63 -22.06 60.11 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 113.325 -1.761 . . . . 10.0 112.686 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.5 ttp-105 -71.97 -31.02 65.87 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 114.931 -1.031 . . . . 10.0 111.917 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 14.8 tttm -74.2 -39.13 63.36 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-O 122.943 1.354 . . . . 10.0 113.872 -179.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.405 ' N ' ' CD1' ' A' ' 32' ' ' ILE . 1.2 mm -72.61 -33.21 44.1 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.747 0 O-C-N 119.619 -1.926 . . . . 10.0 112.074 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -69.77 -33.15 72.01 Favored 'General case' 0 C--O 1.217 -0.654 0 CA-C-O 118.348 -0.834 . . . . 10.0 111.659 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -60.21 -14.3 16.93 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 118.04 -1.464 . . . . 10.0 113.109 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.9 mt -93.8 -18.6 21.87 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 118.517 -1.273 . . . . 10.0 111.86 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -91.28 134.39 34.62 Favored 'General case' 0 N--CA 1.48 1.05 0 O-C-N 124.654 1.221 . . . . 10.0 109.033 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 16.8 mtpp -123.33 103.93 35.13 Favored Pre-proline 0 N--CA 1.475 0.783 0 N-CA-C 104.785 -2.302 . . . . 10.0 104.785 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -60.69 136.64 68.02 Favored 'Trans proline' 0 C--N 1.357 1.009 0 N-CA-C 117.796 2.191 . . . . 10.0 117.796 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.533 ' HB2' ' CD2' ' A' ' 8' ' ' TRP . 0.4 OUTLIER -100.05 174.66 6.06 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 104.876 -2.268 . . . . 10.0 104.876 179.455 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.408 ' C ' ' CD1' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -167.77 119.05 0.85 Allowed 'General case' 0 CA--C 1.497 -1.075 0 C-N-CA 116.82 -1.952 . . . . 10.0 112.681 179.839 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -103.71 137.6 41.51 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 107.084 -1.45 . . . . 10.0 107.084 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 16.0 mt -112.64 153.23 14.28 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-O 117.427 -1.273 . . . . 10.0 107.709 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -147.75 126.32 3.79 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.734 0 N-CA-C 105.523 -2.029 . . . . 10.0 105.523 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 6.5 mm100 -131.86 113.44 13.47 Favored 'General case' 0 C--N 1.314 -0.977 0 O-C-N 125.605 1.816 . . . . 10.0 110.404 179.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -104.66 -11.77 16.73 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 105.089 -2.189 . . . . 10.0 105.089 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 166.47 -123.89 1.18 Allowed Glycine 0 CA--C 1.511 -0.171 0 N-CA-C 108.958 -1.657 . . . . 10.0 108.958 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -84.37 -8.13 59.08 Favored 'General case' 0 C--O 1.216 -0.701 0 CA-C-N 121.242 2.521 . . . . 10.0 108.308 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -96.02 118.03 31.82 Favored 'General case' 0 C--O 1.219 -0.524 0 N-CA-C 105.907 -1.886 . . . . 10.0 105.907 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.411 ' CE ' HD12 ' A' ' 51' ' ' ILE . 17.9 ttp -115.46 127.29 55.22 Favored 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 115.216 1.561 . . . . 10.0 115.216 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 15.0 mt -113.5 145.37 19.48 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.057 0 N-CA-C 105.175 -2.157 . . . . 10.0 105.175 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.411 HD12 ' CE ' ' A' ' 49' ' ' MET . 2.6 mt -136.75 114.15 13.66 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-O 122.956 1.36 . . . . 10.0 107.807 -179.646 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -95.92 84.32 3.84 Favored 'General case' 0 CA--C 1.503 -0.83 0 CA-C-N 112.911 -1.95 . . . . 10.0 111.555 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 98.5 m -89.35 115.91 27.16 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 100.203 -3.999 . . . . 10.0 100.203 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 43.9 mt -117.47 73.79 0.9 Allowed 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 119.174 3.028 . . . . 10.0 119.174 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 4.3 m -69.01 101.09 1.32 Allowed 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 102.572 -3.122 . . . . 10.0 102.572 179.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.8 t -60.16 96.35 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 119.991 1.269 . . . . 10.0 108.466 -179.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER 160.08 -42.6 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 126.713 2.005 . . . . 10.0 106.247 -179.865 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -144.11 105.16 4.21 Favored 'General case' 0 CA--C 1.511 -0.55 0 O-C-N 126.117 2.135 . . . . 10.0 112.517 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.92 125.38 23.78 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 120.079 -1.638 . . . . 10.0 108.637 179.848 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -109.01 125.92 52.57 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 102.403 -3.184 . . . . 10.0 102.403 -179.817 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 5.1 mt -132.81 129.55 58.25 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.722 0 N-CA-C 112.931 0.715 . . . . 10.0 112.931 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -134.0 164.32 27.58 Favored 'General case' 0 C--O 1.216 -0.7 0 N-CA-C 108.033 -1.099 . . . . 10.0 108.033 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -157.61 77.21 0.83 Allowed 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 101.041 -3.689 . . . . 10.0 101.041 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 1.8 m-30 -91.59 -178.07 4.97 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 117.212 2.301 . . . . 10.0 117.212 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -132.69 145.04 50.72 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 107.099 -1.445 . . . . 10.0 107.099 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 95.3 t -81.74 85.41 1.63 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.207 0 O-C-N 124.669 1.231 . . . . 10.0 113.335 -179.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 110.16 55.21 0.54 Allowed Glycine 0 C--O 1.221 -0.676 0 C-N-CA 120.547 -0.835 . . . . 10.0 113.367 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 34.4 ttmt -157.93 138.46 12.85 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-N 118.663 1.231 . . . . 10.0 112.6 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -78.2 123.15 26.58 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-O 123.197 1.475 . . . . 10.0 110.142 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -106.54 178.04 4.68 Favored 'General case' 0 C--O 1.244 0.79 0 CA-C-N 112.737 -2.028 . . . . 10.0 108.444 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -145.84 81.82 1.61 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 113.265 -1.789 . . . . 10.0 109.439 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -75.31 139.99 42.82 Favored 'General case' 0 C--O 1.219 -0.545 0 O-C-N 124.768 1.293 . . . . 10.0 112.068 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -112.32 70.88 0.72 Allowed 'General case' 0 N--CA 1.456 -0.154 0 CA-C-O 124.082 1.896 . . . . 10.0 106.007 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.63 129.96 41.61 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 123.789 1.757 . . . . 10.0 111.625 179.778 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -135.19 65.75 1.55 Allowed 'General case' 0 CA--C 1.51 -0.589 0 N-CA-C 105.806 -1.924 . . . . 10.0 105.806 179.78 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -159.5 -178.89 33.91 Favored Glycine 0 N--CA 1.438 -1.207 0 CA-C-O 117.334 -1.814 . . . . 10.0 109.705 -179.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.439 ' CD1' ' N ' ' A' ' 77' ' ' ILE . 0.0 OUTLIER 37.7 -93.99 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.51 -0.589 0 O-C-N 127.179 2.34 . . . . 10.0 110.035 -179.848 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -87.94 -31.19 19.55 Favored 'General case' 0 CA--C 1.51 -0.578 0 N-CA-C 114.963 1.468 . . . . 10.0 114.963 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.4 t0 77.91 116.25 0.06 Allowed 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 127.451 2.3 . . . . 10.0 113.587 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 3.6 mtt180 169.15 161.96 0.05 Allowed 'General case' 0 C--N 1.315 -0.899 0 O-C-N 120.676 -1.265 . . . . 10.0 109.152 -179.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.04 165.78 11.22 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 108.802 -0.814 . . . . 10.0 108.802 -179.732 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -135.13 -174.8 3.71 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 122.522 1.153 . . . . 10.0 110.179 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -145.86 44.49 1.27 Allowed 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 101.44 -3.541 . . . . 10.0 101.44 179.868 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -42.14 150.13 0.13 Allowed 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 118.931 2.937 . . . . 10.0 118.931 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 87.6 m -139.16 104.36 4.99 Favored 'General case' 0 CA--C 1.506 -0.746 0 N-CA-C 104.785 -2.302 . . . . 10.0 104.785 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -91.53 107.02 18.26 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.068 0 N-CA-C 102.795 -3.039 . . . . 10.0 102.795 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 15.6 p -139.97 135.41 32.73 Favored 'General case' 0 C--O 1.243 0.724 0 C-N-CA 119.001 -1.08 . . . . 10.0 111.562 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -65.94 110.74 3.01 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-O 123.072 1.415 . . . . 10.0 108.21 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -84.96 -24.12 28.47 Favored 'General case' 0 C--O 1.248 1.001 0 N-CA-C 102.76 -3.052 . . . . 10.0 102.76 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 146.05 70.74 0.02 OUTLIER Glycine 0 C--N 1.317 -0.525 0 N-CA-C 103.175 -3.97 . . . . 10.0 103.175 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 86.56 -57.23 0.06 Allowed 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 124.812 1.245 . . . . 10.0 108.113 -179.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.7 ttpp -55.86 105.29 0.17 Allowed 'General case' 0 C--O 1.236 0.36 0 N-CA-C 106.112 -1.81 . . . . 10.0 106.112 -179.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 4.2 tp -67.97 99.48 0.86 Allowed 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 103.935 -2.617 . . . . 10.0 103.935 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -88.44 113.62 24.22 Favored 'General case' 0 C--O 1.218 -0.598 0 N-CA-C 114.858 1.429 . . . . 10.0 114.858 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 27.1 m -104.83 98.43 8.16 Favored 'General case' 0 N--CA 1.443 -0.787 0 O-C-N 126.044 2.09 . . . . 10.0 110.068 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -108.24 116.89 52.6 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 N-CA-C 105.061 -2.2 . . . . 10.0 105.061 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -110.45 118.4 36.16 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 126.727 2.517 . . . . 10.0 112.942 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 12.0 mtmt -74.61 119.53 18.92 Favored 'General case' 0 C--O 1.215 -0.754 0 O-C-N 124.276 0.985 . . . . 10.0 112.431 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -173.99 -160.69 22.72 Favored Glycine 0 C--N 1.338 0.669 0 N-CA-C 109.683 -1.367 . . . . 10.0 109.683 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -82.54 -172.15 3.88 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-O 116.204 -1.855 . . . . 10.0 111.568 179.86 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 81.05 -157.07 0.02 OUTLIER 'General case' 0 C--N 1.317 -0.84 0 O-C-N 127.087 2.742 . . . . 10.0 111.319 -179.863 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -136.29 -41.34 0.64 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.983 0.897 . . . . 10.0 113.087 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -97.61 1.39 60.02 Favored Glycine 0 CA--C 1.526 0.78 0 CA-C-O 116.108 -2.496 . . . . 10.0 117.041 -179.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 1.8 mtt180 -53.16 129.69 32.01 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 123.289 1.518 . . . . 10.0 109.692 -179.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 134.88 133.29 3.26 Favored Glycine 0 C--O 1.219 -0.829 0 CA-C-N 113.493 -1.685 . . . . 10.0 109.558 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -110.75 -169.47 1.46 Allowed 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 108.812 -0.81 . . . . 10.0 108.812 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -162.03 132.94 5.06 Favored 'General case' 0 C--O 1.211 -0.933 0 O-C-N 125.684 1.865 . . . . 10.0 108.713 -179.753 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -115.74 95.3 5.06 Favored 'General case' 0 C--N 1.316 -0.877 0 O-C-N 125.69 1.869 . . . . 10.0 109.846 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' TRP . . . . . 0.461 ' CD1' ' C ' ' A' ' 109' ' ' TRP . 1.3 t90 -109.73 114.18 27.56 Favored 'General case' 0 C--O 1.221 -0.414 0 CA-C-N 114.592 -1.185 . . . . 10.0 108.859 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.406 HG22 ' N ' ' A' ' 111' ' ' GLU . 88.3 mt -91.52 140.08 16.67 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 CA-C-N 113.412 -1.722 . . . . 10.0 114.041 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . 0.406 ' N ' HG22 ' A' ' 110' ' ' ILE . 3.9 mt-10 -116.67 64.45 0.71 Allowed 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 104.143 -2.54 . . . . 10.0 104.143 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 66.68 -119.24 11.93 Favored Glycine 0 N--CA 1.467 0.744 0 N-CA-C 108.294 -1.923 . . . . 10.0 108.294 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -63.15 -4.37 2.36 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 121.121 -1.223 . . . . 10.0 113.247 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -118.14 156.66 28.32 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 119.388 0.994 . . . . 10.0 110.047 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.433 ' HB3' ' HB3' ' A' ' 130' ' ' PHE . 0.2 OUTLIER -124.19 105.86 9.85 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 105.299 -2.111 . . . . 10.0 105.299 179.755 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 18.8 m80 -97.81 85.96 3.66 Favored 'General case' 0 CA--C 1.505 -0.788 0 O-C-N 119.55 -1.969 . . . . 10.0 109.049 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.82 115.15 24.05 Favored 'General case' 0 N--CA 1.447 -0.599 0 O-C-N 125.271 1.607 . . . . 10.0 110.869 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -117.16 90.68 3.39 Favored 'General case' 0 CA--C 1.498 -1.055 0 CA-C-O 118.47 -0.776 . . . . 10.0 111.264 -179.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 34.6 mtm -82.28 162.22 22.37 Favored 'General case' 0 CA--C 1.514 -0.414 0 C-N-CA 119.193 -1.003 . . . . 10.0 110.425 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 3.8 ttm180 -150.53 150.24 30.99 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 122.396 1.093 . . . . 10.0 112.38 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -166.62 124.75 1.39 Allowed 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 114.338 -1.301 . . . . 10.0 108.457 -179.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 53.58 34.74 19.25 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 117.952 2.575 . . . . 10.0 117.952 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 91.01 -6.97 81.69 Favored Glycine 0 C--N 1.336 0.546 0 N-CA-C 117.551 1.78 . . . . 10.0 117.551 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 15.1 t -108.72 117.97 55.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 CA-C-N 118.213 1.007 . . . . 10.0 112.469 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 22.7 m -92.37 119.28 31.76 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 126.009 2.068 . . . . 10.0 112.352 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -107.96 139.29 42.8 Favored 'General case' 0 C--N 1.322 -0.595 0 O-C-N 127.513 3.008 . . . . 10.0 106.175 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.42 149.58 34.98 Favored 'General case' 0 C--N 1.319 -0.745 0 C-N-CA 118.759 -1.176 . . . . 10.0 112.926 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -132.96 117.7 17.97 Favored 'General case' 0 C--N 1.318 -0.78 0 O-C-N 127.877 3.236 . . . . 10.0 109.509 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 38.9 t -78.39 87.42 1.1 Allowed 'Isoleucine or valine' 0 C--O 1.217 -0.636 0 C-N-CA 118.549 -1.26 . . . . 10.0 110.227 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . 0.433 ' HB3' ' HB3' ' A' ' 115' ' ' LEU . 0.7 OUTLIER -73.42 167.68 20.78 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 108.451 -0.944 . . . . 10.0 108.451 -179.967 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -139.04 88.25 2.27 Favored 'General case' 0 C--O 1.241 0.616 0 N-CA-C 106.343 -1.725 . . . . 10.0 106.343 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 9.2 ttpt -61.67 98.82 0.1 Allowed 'General case' 0 C--N 1.32 -0.702 0 O-C-N 121.95 -0.469 . . . . 10.0 110.017 179.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . 0.492 ' CG1' ' CB ' ' A' ' 7' ' ' TYR . 9.5 p -43.96 -31.18 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 C-N-CA 124.76 1.224 . . . . 10.0 111.275 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 54.7 t-80 . . . . . 0 C--O 1.245 0.826 0 O-C-N 126.189 2.181 . . . . 10.0 110.981 -179.72 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.473 0.286 0 CA-C-O 122.366 0.902 . . . . 10.0 112.687 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 2.0 t -127.02 15.79 3.57 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-O 123.138 1.447 . . . . 10.0 111.371 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -70.92 112.65 7.26 Favored 'General case' 0 C--O 1.24 0.601 0 CA-C-N 113.927 -1.488 . . . . 10.0 110.715 -179.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -74.08 -15.9 61.04 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 123.989 0.806 . . . . 10.0 112.652 179.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -58.01 115.38 2.84 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 122.493 1.14 . . . . 10.0 112.766 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -162.3 -101.33 0.16 Allowed Glycine 0 C--N 1.344 0.986 0 N-CA-C 118.87 2.308 . . . . 10.0 118.87 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . 0.459 ' HA ' ' CE3' ' A' ' 8' ' ' TRP . 6.4 m-85 -167.9 163.28 13.85 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 102.535 -3.135 . . . . 10.0 102.535 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.566 ' CZ3' ' CG ' ' A' ' 41' ' ' GLU 0.285 29.6 p90 -144.41 -176.39 5.02 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 125.683 1.593 . . . . 10.0 113.51 -179.492 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 164.41 93.52 0.0 OUTLIER 'General case' 0 C--O 1.232 0.173 0 CA-C-N 111.984 -2.371 . . . . 10.0 107.999 179.3 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.477 ' HE2' ' CB ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -41.68 153.36 0.06 Allowed 'General case' 0 C--N 1.311 -1.083 0 N-CA-C 115.164 1.542 . . . . 10.0 115.164 179.435 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.431 ' CD1' ' HB2' ' A' ' 131' ' ' LYS . 0.3 OUTLIER -118.61 -49.0 2.47 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 108.065 -1.087 . . . . 10.0 108.065 -179.976 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.8 t -161.76 164.36 29.01 Favored 'General case' 0 C--O 1.242 0.68 0 N-CA-C 115.079 1.511 . . . . 10.0 115.079 179.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -129.25 151.36 50.0 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 105.121 -2.177 . . . . 10.0 105.121 179.837 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -151.47 137.53 18.26 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 116.839 2.163 . . . . 10.0 116.839 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 74.1 m-20 55.56 19.97 3.54 Favored 'General case' 0 N--CA 1.444 -0.754 0 O-C-N 125.793 1.933 . . . . 10.0 112.657 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.463 ' CZ ' ' HA ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -69.01 -20.43 64.15 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 114.551 1.315 . . . . 10.0 114.551 179.723 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -78.58 -40.14 35.5 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 119.794 -1.816 . . . . 10.0 111.576 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.483 ' CG ' HG12 ' A' ' 124' ' ' VAL . 2.1 pt-20 -75.55 -20.89 58.35 Favored 'General case' 0 CA--C 1.51 -0.581 0 N-CA-C 108.256 -1.016 . . . . 10.0 108.256 179.815 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -72.93 -34.2 66.43 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 105.964 -1.865 . . . . 10.0 105.964 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 41.5 mt -78.81 -23.31 45.2 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 120.82 1.646 . . . . 10.0 108.858 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.5 ttm-85 -69.33 -30.39 68.43 Favored 'General case' 0 N--CA 1.447 -0.617 0 O-C-N 126.127 2.142 . . . . 10.0 108.652 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.86 -38.95 83.75 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 125.152 1.381 . . . . 10.0 110.923 -179.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 33.4 mt -75.9 -28.17 57.98 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 117.51 -1.233 . . . . 10.0 109.454 179.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.4 t70 78.51 45.96 0.06 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 126.762 2.539 . . . . 10.0 113.042 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 3.2 m -85.64 -162.65 0.08 OUTLIER 'Isoleucine or valine' 0 C--O 1.243 0.748 0 N-CA-C 106.998 -1.482 . . . . 10.0 106.998 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -93.4 170.83 9.32 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 116.599 2.074 . . . . 10.0 116.599 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.5 m -75.89 -35.46 29.99 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 CA-C-N 112.847 -1.979 . . . . 10.0 111.733 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.05 -34.19 74.79 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 122.884 1.326 . . . . 10.0 111.293 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.433 ' CD1' ' C ' ' A' ' 29' ' ' LEU . 1.7 tm? -76.9 -40.85 45.95 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.492 -1.231 . . . . 10.0 111.553 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.5 ttp85 -61.38 -29.08 69.69 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 125.432 1.493 . . . . 10.0 113.948 179.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.48 -41.47 39.37 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 106.495 -1.669 . . . . 10.0 106.495 179.75 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 2.1 mm -62.25 -40.57 88.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 O-C-N 120.204 -1.56 . . . . 10.0 112.196 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -73.79 -48.25 32.9 Favored 'General case' 0 N--CA 1.476 0.83 0 O-C-N 125.245 1.591 . . . . 10.0 110.943 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.463 ' HA ' ' CZ ' ' A' ' 16' ' ' PHE . 0.0 OUTLIER -67.79 175.24 3.09 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-O 115.381 -2.247 . . . . 10.0 107.976 179.085 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.412 ' N ' ' CG ' ' A' ' 34' ' ' ASN . 0.3 OUTLIER 84.0 -43.6 0.09 Allowed 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 114.957 1.466 . . . . 10.0 114.957 179.831 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.415 HD13 ' CB ' ' A' ' 57' ' ' PHE . 51.9 mt -83.79 152.13 24.81 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 126.626 2.454 . . . . 10.0 111.182 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.477 ' CB ' ' HE2' ' A' ' 10' ' ' MET . 6.9 mttt -125.52 96.22 39.06 Favored Pre-proline 0 C--N 1.318 -0.797 0 O-C-N 127.374 2.921 . . . . 10.0 107.132 -179.737 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -63.6 -170.35 0.11 Allowed 'Trans proline' 0 C--O 1.219 -0.447 0 O-C-N 124.806 1.95 . . . . 10.0 116.261 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.53 ' CB ' ' CD1' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -141.93 171.36 14.16 Favored 'General case' 0 C--O 1.235 0.33 0 O-C-N 126.665 2.478 . . . . 10.0 108.024 179.942 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.453 ' HB2' ' CZ ' ' A' ' 130' ' ' PHE . 0.8 OUTLIER -149.21 90.93 1.78 Allowed 'General case' 0 CA--C 1.498 -1.046 0 CA-C-O 123.63 1.681 . . . . 10.0 112.398 -179.698 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.566 ' CG ' ' CZ3' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -88.98 142.72 27.4 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 103.609 -2.737 . . . . 10.0 103.609 -179.793 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.7 mm -127.31 149.97 32.8 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.736 0 CA-C-N 119.403 1.001 . . . . 10.0 108.51 179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 16.9 t -153.82 132.43 2.95 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 N-CA-C 104.963 -2.236 . . . . 10.0 104.963 179.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -141.7 130.03 22.37 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 124.178 1.942 . . . . 10.0 107.397 179.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -88.8 -9.21 52.62 Favored 'General case' 0 C--N 1.313 -0.995 0 C-N-CA 126.399 1.88 . . . . 10.0 107.98 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 145.49 -96.1 0.18 Allowed Glycine 0 N--CA 1.468 0.786 0 O-C-N 127.333 2.896 . . . . 10.0 108.888 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -90.57 -23.67 20.8 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 118.555 1.177 . . . . 10.0 110.586 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.4 t-160 -85.51 116.8 24.03 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 104.447 -2.427 . . . . 10.0 104.447 179.866 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 58.3 ttp -101.81 147.11 26.88 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 113.637 -1.62 . . . . 10.0 114.179 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 31.9 mt -137.79 115.46 12.81 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.735 0 O-C-N 119.113 -2.242 . . . . 10.0 107.852 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.6 mp -105.89 127.63 60.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 105.415 -2.068 . . . . 10.0 105.415 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 83.4 mtt180 -116.33 138.48 51.29 Favored 'General case' 0 C--O 1.212 -0.88 0 O-C-N 126.687 2.492 . . . . 10.0 111.799 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 5.8 m -131.19 134.28 46.33 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 100.547 -3.871 . . . . 10.0 100.547 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.2 mp -126.48 63.81 1.27 Allowed 'General case' 0 C--N 1.321 -0.636 1 N-CA-C 121.845 4.017 . . . . 10.0 121.845 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.3 m -84.57 153.05 23.47 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 105.376 -2.083 . . . . 10.0 105.376 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -63.54 -29.16 70.46 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 107.249 -1.389 . . . . 10.0 107.249 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.415 ' CB ' HD13 ' A' ' 36' ' ' LEU . 2.1 t80 -112.41 123.74 50.95 Favored 'General case' 0 C--O 1.243 0.76 0 O-C-N 125.831 1.957 . . . . 10.0 107.945 -179.899 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 53.53 91.67 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 113.813 1.042 . . . . 10.0 113.813 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . 0.459 ' HB3' ' CD1' ' A' ' 61' ' ' ILE . 6.0 m-20 -58.32 -52.39 65.81 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 115.126 -0.943 . . . . 10.0 110.736 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER 76.42 84.95 0.09 Allowed 'General case' 0 C--N 1.311 -1.105 0 C-N-CA 126.325 1.85 . . . . 10.0 106.105 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.459 ' CD1' ' HB3' ' A' ' 59' ' ' ASN . 1.7 mp -105.75 135.54 43.55 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.81 0 O-C-N 120.834 -1.166 . . . . 10.0 110.33 -179.868 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 7.8 mtt -125.58 166.58 16.43 Favored 'General case' 0 C--O 1.214 -0.802 0 N-CA-C 107.692 -1.225 . . . . 10.0 107.692 179.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -146.02 89.61 1.9 Allowed 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 100.301 -3.963 . . . . 10.0 100.301 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.503 ' CD2' HG23 ' A' ' 86' ' ' VAL . 3.7 m-30 -100.63 157.43 16.68 Favored 'General case' 0 C--N 1.32 -0.714 0 O-C-N 126.168 2.168 . . . . 10.0 113.999 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -120.22 104.47 10.09 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 105.504 -2.035 . . . . 10.0 105.504 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.7 t -59.48 113.12 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.921 0 CA-C-N 115.423 -0.808 . . . . 10.0 109.49 -179.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 103.2 22.01 9.56 Favored Glycine 0 C--O 1.224 -0.5 0 CA-C-O 117.613 -1.659 . . . . 10.0 114.98 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.1 tttm -140.95 159.36 42.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 121.055 2.428 . . . . 10.0 115.951 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.86 144.19 35.22 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 107.765 -1.198 . . . . 10.0 107.765 -179.846 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -144.02 98.69 3.26 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-O 123.543 1.639 . . . . 10.0 112.686 179.735 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -70.33 103.4 2.39 Favored 'General case' 0 C--O 1.22 -0.474 0 O-C-N 119.364 -2.085 . . . . 10.0 105.639 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.407 ' HB3' ' HG ' ' A' ' 74' ' ' LEU . 3.5 mt-10 -75.86 -34.39 60.04 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-O 117.214 -1.374 . . . . 10.0 114.342 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 41.53 73.65 0.12 Allowed 'General case' 0 C--N 1.317 -0.816 0 O-C-N 126.409 2.318 . . . . 10.0 109.702 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.407 ' HG ' ' HB3' ' A' ' 72' ' ' GLU . 1.2 mt -95.55 126.77 41.07 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 115.742 1.756 . . . . 10.0 115.742 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 35.6 p -123.84 41.56 3.45 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 103.845 -2.65 . . . . 10.0 103.845 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -155.0 165.99 32.36 Favored Glycine 0 N--CA 1.446 -0.668 0 N-CA-C 109.733 -1.347 . . . . 10.0 109.733 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 3.0 mm 64.21 -73.81 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 O-C-N 126.089 1.699 . . . . 10.0 107.772 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 23.7 p30 -139.09 39.02 2.12 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 117.548 -1.215 . . . . 10.0 108.567 179.635 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 4.26 91.16 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.646 0 O-C-N 127.523 3.014 . . . . 10.0 117.528 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.46 112.59 8.59 Favored 'General case' 0 CA--C 1.506 -0.726 0 CA-C-O 121.645 0.736 . . . . 10.0 112.828 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 7.3 pttt -80.25 121.54 25.76 Favored 'General case' 0 N--CA 1.438 -1.074 0 N-CA-C 103.515 -2.772 . . . . 10.0 103.515 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 28.2 p -153.21 -178.59 7.06 Favored 'General case' 0 C--O 1.216 -0.705 0 CA-C-N 114.906 -1.043 . . . . 10.0 108.204 -179.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.1 ptt? -130.48 132.78 45.83 Favored 'General case' 0 CA--C 1.505 -0.773 1 N-CA-C 99.003 -4.443 . . . . 10.0 99.003 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 25.6 m -132.64 120.71 22.12 Favored 'General case' 0 CA--C 1.505 -0.769 0 N-CA-C 118.179 2.659 . . . . 10.0 118.179 -179.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.12 118.6 36.83 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 112.313 -2.221 . . . . 10.0 108.471 -179.811 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.503 HG23 ' CD2' ' A' ' 64' ' ' PHE . 96.5 t -104.66 120.3 54.89 Favored 'Isoleucine or valine' 0 C--O 1.24 0.561 0 N-CA-C 105.795 -1.928 . . . . 10.0 105.795 -179.922 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -127.15 -159.14 0.91 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 123.94 1.829 . . . . 10.0 109.821 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 7.4 p-90 -148.77 123.59 9.93 Favored 'General case' 0 CA--C 1.51 -0.573 0 O-C-N 120.569 -1.332 . . . . 10.0 107.9 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -80.0 -38.33 32.33 Favored 'General case' 0 N--CA 1.447 -0.62 1 N-CA-C 98.862 -4.495 . . . . 10.0 98.862 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 134.4 126.81 2.67 Favored Glycine 0 N--CA 1.44 -1.034 0 N-CA-C 103.857 -3.697 . . . . 10.0 103.857 -179.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 58.14 20.44 7.01 Favored 'General case' 0 N--CA 1.468 0.426 0 O-C-N 120.706 -1.467 . . . . 10.0 110.247 179.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 5.0 ttpt -156.7 143.47 18.55 Favored 'General case' 0 C--N 1.341 0.211 0 O-C-N 125.879 1.987 . . . . 10.0 108.501 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 2.9 tp -111.45 82.94 1.69 Allowed 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 106.137 -1.801 . . . . 10.0 106.137 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -86.79 145.31 26.67 Favored 'General case' 0 CA--C 1.505 -0.769 0 O-C-N 119.716 -1.865 . . . . 10.0 111.303 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -144.07 141.72 30.23 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-N 114.392 -1.277 . . . . 10.0 109.777 179.75 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 1.6 t -122.62 142.71 38.08 Favored 'Isoleucine or valine' 0 C--O 1.242 0.702 0 N-CA-C 105.217 -2.142 . . . . 10.0 105.217 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 31.3 mt-30 -125.15 100.01 6.36 Favored 'General case' 0 C--O 1.246 0.881 0 CA-C-N 114.074 -1.421 . . . . 10.0 112.247 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 28.8 mmtt -63.45 113.49 3.3 Favored 'General case' 0 CA--C 1.505 -0.77 0 N-CA-C 115.396 1.628 . . . . 10.0 115.396 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -145.99 -114.11 0.85 Allowed Glycine 0 C--O 1.217 -0.953 0 C-N-CA 118.584 -1.769 . . . . 10.0 113.357 -179.651 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 18.8 tp10 -126.8 -9.02 6.1 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 115.348 1.611 . . . . 10.0 115.348 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 21.5 mmtt -107.57 158.26 17.38 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 117.699 2.481 . . . . 10.0 117.699 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -51.55 -63.07 1.25 Allowed 'General case' 0 C--O 1.238 0.48 0 O-C-N 119.674 -1.891 . . . . 10.0 109.948 -179.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -78.09 -82.76 0.6 Allowed Glycine 0 CA--C 1.505 -0.558 0 C-N-CA 121.14 -0.552 . . . . 10.0 114.143 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 46.2 81.85 0.04 OUTLIER 'General case' 0 N--CA 1.44 -0.956 0 CA-C-O 124.524 2.107 . . . . 10.0 114.398 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 179.23 174.57 45.46 Favored Glycine 0 C--O 1.219 -0.841 0 CA-C-N 112.686 -2.052 . . . . 10.0 111.191 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' TRP . . . . . 0.455 ' CE3' HD11 ' A' ' 117' ' ' LEU . 15.5 m0 -123.02 144.47 49.24 Favored 'General case' 0 C--O 1.217 -0.613 0 N-CA-C 108.077 -1.083 . . . . 10.0 108.077 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -131.1 133.34 45.55 Favored 'General case' 0 C--O 1.21 -0.979 0 N-CA-C 106.252 -1.759 . . . . 10.0 106.252 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 9.5 tp60 -141.97 112.79 7.32 Favored 'General case' 0 C--N 1.323 -0.569 0 O-C-N 125.706 1.879 . . . . 10.0 113.462 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -126.46 104.11 7.98 Favored 'General case' 0 C--O 1.212 -0.89 0 CA-C-O 122.929 1.347 . . . . 10.0 112.102 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 14.6 mt -55.21 109.29 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 112.968 -1.924 . . . . 10.0 112.614 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -96.46 -175.96 3.49 Favored 'General case' 0 C--N 1.333 -0.123 0 O-C-N 126.685 2.491 . . . . 10.0 106.865 -179.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -52.5 94.31 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.638 0 O-C-N 126.103 2.127 . . . . 10.0 111.378 179.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 44.86 33.42 0.99 Allowed 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 123.555 1.645 . . . . 10.0 111.669 -179.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -139.39 124.17 18.56 Favored 'General case' 0 C--O 1.241 0.613 0 N-CA-C 115.539 1.681 . . . . 10.0 115.539 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.41 ' HB2' ' HB3' ' A' ' 130' ' ' PHE . 0.5 OUTLIER -84.96 125.51 32.74 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 103.643 -2.725 . . . . 10.0 103.643 179.797 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -129.13 91.62 3.23 Favored 'General case' 0 N--CA 1.445 -0.689 0 O-C-N 121.784 -0.573 . . . . 10.0 110.239 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.455 HD11 ' CE3' ' A' ' 106' ' ' TRP . 1.1 tp -95.79 122.17 38.29 Favored 'General case' 0 N--CA 1.442 -0.857 0 O-C-N 124.988 1.43 . . . . 10.0 110.722 179.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -122.23 108.0 12.79 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 117.999 -1.0 . . . . 10.0 109.085 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -98.32 136.51 38.39 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 118.571 0.623 . . . . 10.0 112.124 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -113.65 146.63 39.48 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 113.022 0.749 . . . . 10.0 113.022 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -162.44 113.54 1.56 Allowed 'General case' 0 C--N 1.32 -0.699 0 O-C-N 125.527 1.767 . . . . 10.0 109.639 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 52.72 46.7 26.23 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 117.279 -1.343 . . . . 10.0 112.899 179.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 74.13 14.49 80.45 Favored Glycine 0 N--CA 1.469 0.888 0 O-C-N 125.72 1.888 . . . . 10.0 117.205 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.483 HG12 ' CG ' ' A' ' 18' ' ' GLU . 97.3 t -116.31 112.98 41.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 N-CA-C 106.974 -1.491 . . . . 10.0 106.974 179.877 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 37.0 m -90.97 87.65 6.7 Favored 'General case' 0 N--CA 1.444 -0.736 0 O-C-N 125.169 1.543 . . . . 10.0 114.508 179.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 8.6 t -76.31 136.28 39.58 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 105.148 -2.168 . . . . 10.0 105.148 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -127.46 157.46 40.0 Favored 'General case' 0 N--CA 1.474 0.773 0 O-C-N 125.284 1.615 . . . . 10.0 112.055 -179.61 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -140.38 97.1 3.15 Favored 'General case' 0 CA--C 1.503 -0.846 0 CA-C-O 122.478 1.132 . . . . 10.0 110.044 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 40.7 t -72.93 129.09 36.11 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 O-C-N 120.62 -1.3 . . . . 10.0 107.92 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . 0.453 ' CZ ' ' HB2' ' A' ' 40' ' ' LYS . 0.6 OUTLIER -128.21 160.13 33.05 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 113.614 -1.63 . . . . 10.0 110.218 179.776 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.431 ' HB2' ' CD1' ' A' ' 11' ' ' LEU . 4.4 mmtt -132.54 127.78 35.87 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 105.817 -1.92 . . . . 10.0 105.817 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 12.7 tttt -90.7 102.84 15.59 Favored 'General case' 0 C--O 1.219 -0.536 0 O-C-N 125.178 1.549 . . . . 10.0 108.904 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 16.5 t -41.83 -55.17 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 127.491 2.994 . . . . 10.0 114.257 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.445 -0.699 0 O-C-N 125.508 1.755 . . . . 10.0 111.463 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 99.9 Cg_exo . . . . . 0 C--O 1.239 0.54 0 CA-C-O 118.052 -0.895 . . . . 10.0 111.23 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 4.7 p -86.0 124.11 40.01 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.784 0 CA-C-O 117.904 -1.046 . . . . 10.0 111.532 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -131.28 114.72 15.37 Favored 'General case' 0 C--O 1.241 0.615 0 O-C-N 124.776 1.297 . . . . 10.0 108.936 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.541 ' CD1' ' CD1' ' A' ' 110' ' ' ILE . 20.8 m-30 -59.0 -14.85 10.52 Favored 'General case' 0 C--O 1.22 -0.486 0 N-CA-C 112.828 0.677 . . . . 10.0 112.828 -179.751 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.49 124.9 21.55 Favored 'General case' 0 C--O 1.244 0.765 0 N-CA-C 114.347 1.24 . . . . 10.0 114.347 -179.704 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -155.91 -105.39 0.23 Allowed Glycine 0 CA--C 1.532 1.106 0 C-N-CA 118.447 -1.835 . . . . 10.0 116.198 -179.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -166.11 166.38 17.14 Favored 'General case' 0 C--O 1.241 0.619 0 N-CA-C 102.445 -3.169 . . . . 10.0 102.445 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.503 ' CZ3' ' HB2' ' A' ' 41' ' ' GLU 0.302 18.1 p90 -144.3 -173.71 4.1 Favored 'General case' 0 C--N 1.314 -0.942 0 C-N-CA 126.591 1.957 . . . . 10.0 113.458 179.964 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.474 ' N ' ' CD1' ' A' ' 8' ' ' TRP . 0.0 OUTLIER 162.5 72.71 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.575 0 O-C-N 127.428 2.955 . . . . 10.0 106.271 177.757 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 0.51 -58.46 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.924 0 O-C-N 127.697 3.123 . . . . 10.0 117.57 -179.459 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.449 ' N ' ' O ' ' A' ' 9' ' ' LYS . 0.2 OUTLIER 81.71 -58.17 0.24 Allowed 'General case' 0 C--O 1.246 0.92 0 C-N-CA 127.421 2.288 . . . . 10.0 107.671 179.83 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -163.71 159.3 21.34 Favored 'General case' 0 C--N 1.323 -0.574 0 O-C-N 125.178 1.549 . . . . 10.0 114.114 179.844 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 4.6 p-10 -157.57 164.16 37.59 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 112.429 -2.169 . . . . 10.0 108.291 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -144.31 -178.92 6.21 Favored 'General case' 0 C--O 1.219 -0.515 0 O-C-N 125.623 1.827 . . . . 10.0 111.88 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 28.09 44.13 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.555 0 O-C-N 126.458 2.349 . . . . 10.0 114.119 179.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -72.13 -45.79 59.16 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-O 117.88 -1.057 . . . . 10.0 110.608 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -78.4 -22.51 47.69 Favored 'General case' 0 C--O 1.218 -0.567 0 CA-C-O 123.488 1.613 . . . . 10.0 110.358 179.82 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -76.55 -27.06 55.77 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 123.499 1.619 . . . . 10.0 107.11 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -77.25 -33.65 55.98 Favored 'General case' 0 CA--C 1.55 0.947 0 CA-C-N 113.475 -1.693 . . . . 10.0 110.49 -179.856 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 83.5 mt -70.55 -31.28 68.27 Favored 'General case' 0 C--O 1.215 -0.712 0 O-C-N 124.501 1.126 . . . . 10.0 110.561 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.56 -22.77 58.83 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 114.972 -1.013 . . . . 10.0 110.383 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.93 -31.34 67.92 Favored 'General case' 0 C--O 1.214 -0.807 0 CA-C-N 119.154 0.888 . . . . 10.0 112.287 179.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.8 mt -92.26 -21.36 20.37 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 124.658 1.224 . . . . 10.0 109.175 179.568 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 34.9 t0 76.98 49.36 0.05 Allowed 'General case' 0 C--O 1.244 0.788 0 N-CA-C 115.849 1.796 . . . . 10.0 115.849 -179.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 33.1 m -80.12 -179.2 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.815 0 O-C-N 118.716 -2.49 . . . . 10.0 108.406 179.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -60.54 155.48 18.48 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 119.093 -1.043 . . . . 10.0 111.769 179.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.6 m -75.91 -26.09 17.51 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.921 0 N-CA-C 116.834 2.161 . . . . 10.0 116.834 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -77.52 -25.26 50.09 Favored 'General case' 0 C--O 1.243 0.755 0 O-C-N 121.047 -1.033 . . . . 10.0 109.866 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.38 -31.14 65.33 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 114.625 -1.171 . . . . 10.0 111.757 -179.693 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.4 ttm180 -68.39 -33.3 74.0 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 125.791 1.636 . . . . 10.0 110.223 179.667 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -74.39 -40.29 62.15 Favored 'General case' 0 CA--C 1.508 -0.65 0 CA-C-N 113.168 -1.833 . . . . 10.0 111.535 -179.746 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.527 HG21 ' CE1' ' A' ' 57' ' ' PHE . 0.4 OUTLIER -73.58 -52.57 20.74 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 CA-C-O 122.471 1.129 . . . . 10.0 112.975 179.968 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -56.06 -21.8 23.96 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 112.511 -2.131 . . . . 10.0 112.659 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -66.87 -47.67 71.16 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-O 118.231 -0.89 . . . . 10.0 112.656 -179.742 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.2 pp -73.01 -2.53 21.48 Favored 'General case' 0 CA--C 1.517 -0.303 0 O-C-N 125.091 1.494 . . . . 10.0 114.088 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -103.66 156.04 18.1 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 122.928 1.347 . . . . 10.0 112.748 179.504 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.403 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 17.4 mttt -140.32 126.94 12.08 Favored Pre-proline 0 N--CA 1.466 0.347 0 N-CA-C 105.689 -1.967 . . . . 10.0 105.689 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 37' ' ' LYS . 12.5 Cg_exo -86.27 153.14 9.4 Favored 'Trans proline' 0 CA--C 1.538 0.715 0 C-N-CA 124.836 3.69 . . . . 10.0 116.632 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.477 ' CB ' ' NE1' ' A' ' 8' ' ' TRP . 0.5 OUTLIER -114.63 166.74 11.41 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 125.571 1.548 . . . . 10.0 106.974 179.872 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.42 ' HB3' ' CZ ' ' A' ' 130' ' ' PHE . 9.4 ttmt -161.36 104.93 1.27 Allowed 'General case' 0 CA--C 1.496 -1.103 0 C-N-CA 116.697 -2.001 . . . . 10.0 112.148 -179.643 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.503 ' HB2' ' CZ3' ' A' ' 8' ' ' TRP . 27.6 tt0 -94.79 135.64 36.04 Favored 'General case' 0 C--O 1.24 0.556 0 N-CA-C 102.41 -3.182 . . . . 10.0 102.41 179.881 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.431 HG21 ' N ' ' A' ' 43' ' ' VAL . 62.4 mt -120.62 150.78 23.42 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 CA-C-N 120.291 1.405 . . . . 10.0 109.319 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.431 ' N ' HG21 ' A' ' 42' ' ' ILE . 0.2 OUTLIER -141.84 127.19 17.87 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 N-CA-C 103.898 -2.63 . . . . 10.0 103.898 -179.882 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -132.62 103.52 6.18 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 125.203 1.564 . . . . 10.0 110.953 -179.757 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -69.45 -63.05 1.14 Allowed 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 106.262 -1.755 . . . . 10.0 106.262 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -163.67 -78.75 0.03 OUTLIER Glycine 0 CA--C 1.532 1.108 0 N-CA-C 109.614 -1.394 . . . . 10.0 109.614 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -107.24 53.71 0.69 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 123.351 1.548 . . . . 10.0 109.089 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -163.43 168.52 20.16 Favored 'General case' 0 C--O 1.215 -0.733 0 N-CA-C 105.041 -2.207 . . . . 10.0 105.041 -179.846 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.405 ' HG2' ' CD1' ' A' ' 51' ' ' ILE . 6.6 ttp -163.41 102.54 0.95 Allowed 'General case' 0 C--O 1.216 -0.659 0 O-C-N 126.112 2.132 . . . . 10.0 112.317 179.66 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 2.3 mp -93.98 100.6 11.43 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.759 0 O-C-N 124.483 1.115 . . . . 10.0 108.177 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.405 ' CD1' ' HG2' ' A' ' 49' ' ' MET . 0.4 OUTLIER -95.59 114.82 33.12 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.805 0 CA-C-O 123.722 1.725 . . . . 10.0 106.745 -179.897 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -115.03 125.97 54.19 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 112.926 -1.943 . . . . 10.0 111.843 179.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 26.7 m -112.32 121.71 45.66 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 100.908 -3.738 . . . . 10.0 100.908 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.9 mt -94.64 12.82 26.3 Favored 'General case' 0 CA--C 1.513 -0.467 0 N-CA-C 121.597 3.925 . . . . 10.0 121.597 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.2 p -68.19 129.08 38.86 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 103.908 -2.627 . . . . 10.0 103.908 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -83.32 156.53 23.0 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 107.869 -1.16 . . . . 10.0 107.869 -179.906 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.527 ' CE1' HG21 ' A' ' 32' ' ' ILE . 3.9 t80 83.75 10.77 0.46 Allowed 'General case' 0 C--N 1.324 -0.506 0 O-C-N 126.468 2.355 . . . . 10.0 105.308 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 5.7 mtp85 -151.45 -69.01 0.17 Allowed 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 126.066 1.747 . . . . 10.0 111.235 -179.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 24.49 88.91 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.775 0 O-C-N 128.441 3.588 . . . . 10.0 112.139 179.66 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 46.3 p90 -121.78 148.85 44.14 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 106.86 -1.533 . . . . 10.0 106.86 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.2 mp -133.27 158.87 43.14 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.869 0 N-CA-C 112.475 0.546 . . . . 10.0 112.475 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -141.86 158.31 43.94 Favored 'General case' 0 C--O 1.215 -0.715 0 N-CA-C 107.031 -1.47 . . . . 10.0 107.031 -179.672 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 29.9 t0 -125.63 77.73 1.68 Allowed 'General case' 0 N--CA 1.441 -0.876 0 N-CA-C 104.279 -2.489 . . . . 10.0 104.279 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 8.4 m-30 -76.8 177.03 7.95 Favored 'General case' 0 C--O 1.242 0.686 0 N-CA-C 115.898 1.814 . . . . 10.0 115.898 -179.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 56.5 mt-30 -151.61 123.65 8.14 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 125.038 1.461 . . . . 10.0 108.089 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 53.2 t -58.16 137.79 19.96 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 C-N-CA 125.848 1.659 . . . . 10.0 109.156 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 65.74 9.89 47.59 Favored Glycine 0 N--CA 1.439 -1.108 0 CA-C-O 118.418 -1.212 . . . . 10.0 114.506 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.06 165.58 12.49 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 120.714 2.257 . . . . 10.0 112.442 179.668 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -122.34 149.11 44.22 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 108.09 -1.078 . . . . 10.0 108.09 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -152.38 -170.66 3.7 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 122.98 1.371 . . . . 10.0 110.528 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -143.73 110.38 5.56 Favored 'General case' 0 C--N 1.319 -0.73 0 C-N-CA 119.139 -1.024 . . . . 10.0 110.468 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -95.8 72.77 3.07 Favored 'General case' 0 N--CA 1.441 -0.877 0 O-C-N 120.385 -1.447 . . . . 10.0 111.172 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.44 ' HA ' ' CB ' ' A' ' 81' ' ' LYS . 6.0 p-10 -44.59 137.33 3.86 Favored 'General case' 0 C--N 1.315 -0.929 0 O-C-N 128.945 3.903 . . . . 10.0 105.815 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.424 HD22 ' N ' ' A' ' 75' ' ' THR . 0.8 OUTLIER 63.85 119.72 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 116.748 2.129 . . . . 10.0 116.748 -179.717 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.427 ' O ' ' N ' ' A' ' 79' ' ' ASP . 1.7 m -104.6 102.42 12.03 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 106.794 -1.558 . . . . 10.0 106.794 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -57.9 101.35 0.18 Allowed Glycine 0 CA--C 1.531 1.054 0 CA-C-O 115.945 -2.586 . . . . 10.0 110.216 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 7.0 mt 134.32 -68.53 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.954 0 O-C-N 127.748 2.675 . . . . 10.0 109.81 179.522 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -103.41 8.29 38.03 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 112.908 0.707 . . . . 10.0 112.908 -179.526 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . 0.427 ' N ' ' O ' ' A' ' 75' ' ' THR . 0.0 OUTLIER 44.02 -166.71 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 127.136 2.174 . . . . 10.0 116.472 -179.694 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 78.08 156.52 0.17 Allowed 'General case' 0 CA--C 1.505 -0.766 0 CA-C-O 122.35 1.072 . . . . 10.0 110.998 179.761 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.44 ' CB ' ' HA ' ' A' ' 73' ' ' ASP . 1.4 pttm -96.11 136.61 36.34 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 105.32 -2.104 . . . . 10.0 105.32 179.804 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -120.45 137.71 54.19 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 125.651 1.58 . . . . 10.0 107.481 179.701 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.3 mtp -100.95 91.48 4.6 Favored 'General case' 0 N--CA 1.441 -0.897 0 N-CA-C 102.926 -2.99 . . . . 10.0 102.926 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 68.7 m -91.83 129.13 37.85 Favored 'General case' 0 C--O 1.215 -0.761 0 N-CA-C 114.121 1.156 . . . . 10.0 114.121 179.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 40.9 m -127.2 118.02 23.48 Favored 'General case' 0 N--CA 1.44 -0.94 0 O-C-N 126.564 2.415 . . . . 10.0 104.594 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 22.9 m -91.42 -175.75 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 N-CA-C 104.084 -2.561 . . . . 10.0 104.084 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 172.2 132.76 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.86 0 O-C-N 124.256 0.973 . . . . 10.0 111.268 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . 0.521 ' CD1' ' HA ' ' A' ' 91' ' ' ASP . 0.7 OUTLIER -78.74 80.83 5.08 Favored 'General case' 0 C--O 1.22 -0.469 0 N-CA-C 105.209 -2.145 . . . . 10.0 105.209 179.873 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -95.22 105.47 17.41 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 103.986 -2.598 . . . . 10.0 103.986 179.777 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 67.13 31.62 78.13 Favored Glycine 0 CA--C 1.504 -0.608 0 N-CA-C 108.552 -1.819 . . . . 10.0 108.552 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.521 ' HA ' ' CD1' ' A' ' 88' ' ' TRP . 0.5 OUTLIER 73.81 -11.59 0.94 Allowed 'General case' 0 C--O 1.236 0.394 0 CA-C-N 119.694 1.747 . . . . 10.0 114.768 179.911 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.488 ' HD3' ' CZ3' ' A' ' 109' ' ' TRP . 11.0 pttm -90.45 151.76 21.25 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 106.797 -1.557 . . . . 10.0 106.797 -179.863 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.41 92.73 7.07 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 106.104 -1.813 . . . . 10.0 106.104 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -98.41 95.88 7.63 Favored 'General case' 0 C--O 1.214 -0.789 0 O-C-N 120.515 -1.366 . . . . 10.0 110.003 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 30.8 p -106.25 143.87 33.76 Favored 'General case' 0 CA--C 1.507 -0.693 0 CA-C-O 124.382 2.039 . . . . 10.0 114.102 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -123.02 138.91 51.44 Favored 'Isoleucine or valine' 0 C--O 1.245 0.827 0 N-CA-C 104.551 -2.389 . . . . 10.0 104.551 179.801 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -123.41 76.23 1.38 Allowed 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.33 1.019 . . . . 10.0 112.642 -179.802 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 3.5 mmmt -46.39 124.92 6.24 Favored 'General case' 0 CA--C 1.512 -0.492 0 N-CA-C 113.753 1.02 . . . . 10.0 113.753 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 172.34 62.48 0.04 OUTLIER Glycine 0 CA--C 1.501 -0.82 0 O-C-N 126.081 2.113 . . . . 10.0 112.337 179.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 75.88 -172.44 0.1 Allowed 'General case' 0 C--N 1.316 -0.864 0 O-C-N 126.433 1.902 . . . . 10.0 114.574 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 13.0 mmtt 65.34 -177.25 0.18 Allowed 'General case' 0 N--CA 1.442 -0.873 0 CA-C-O 123.689 1.709 . . . . 10.0 113.184 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -124.3 49.6 1.77 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 113.519 -1.673 . . . . 10.0 114.231 179.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 153.21 36.59 0.03 OUTLIER Glycine 0 C--O 1.218 -0.885 0 N-CA-C 118.814 2.285 . . . . 10.0 118.814 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 43.3 mtp180 -75.95 163.64 26.97 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 116.951 0.375 . . . . 10.0 110.11 179.592 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 119.29 144.54 7.38 Favored Glycine 0 N--CA 1.437 -1.27 0 C-N-CA 118.956 -1.592 . . . . 10.0 110.225 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 19.1 m0 -111.27 173.89 6.12 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-O 117.123 -1.418 . . . . 10.0 109.267 179.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 2.7 m -147.96 135.73 20.94 Favored 'General case' 0 C--O 1.209 -1.07 0 O-C-N 124.908 1.38 . . . . 10.0 108.384 179.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -120.56 131.25 54.57 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 125.758 1.911 . . . . 10.0 107.974 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' TRP . . . . . 0.488 ' CZ3' ' HD3' ' A' ' 92' ' ' LYS . 2.6 t-105 -146.37 124.87 12.4 Favored 'General case' 0 CA--C 1.5 -0.959 0 CA-C-O 122.453 1.121 . . . . 10.0 110.134 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.541 ' CD1' ' CD1' ' A' ' 4' ' ' PHE . 43.2 mt -99.16 124.6 52.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 116.281 1.956 . . . . 10.0 116.281 179.63 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -129.78 110.25 11.6 Favored 'General case' 0 CA--C 1.509 -0.611 0 O-C-N 126.318 2.261 . . . . 10.0 105.514 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 53.97 -104.4 0.23 Allowed Glycine 0 N--CA 1.459 0.227 0 N-CA-C 108.682 -1.767 . . . . 10.0 108.682 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -114.86 4.0 14.75 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 125.331 1.253 . . . . 10.0 110.683 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 73.5 tt0 -102.96 101.52 11.54 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 115.176 1.547 . . . . 10.0 115.176 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.413 ' HB3' ' HB3' ' A' ' 130' ' ' PHE . 0.2 OUTLIER -67.48 107.65 2.54 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 103.574 -2.75 . . . . 10.0 103.574 179.764 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -99.34 103.63 15.46 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 119.671 -1.893 . . . . 10.0 110.372 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.427 HD22 ' HB2' ' A' ' 128' ' ' GLN . 0.0 OUTLIER -103.73 143.06 33.3 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 124.228 1.966 . . . . 10.0 111.534 179.814 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -141.01 120.14 12.88 Favored 'General case' 0 CA--C 1.5 -0.98 0 O-C-N 120.507 -1.37 . . . . 10.0 108.758 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.42 ' HE1' HD11 ' A' ' 117' ' ' LEU . 3.5 mtm -95.53 -174.85 3.29 Favored 'General case' 0 N--CA 1.439 -1.007 0 N-CA-C 113.779 1.029 . . . . 10.0 113.779 179.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 9.2 tpt180 -167.84 129.8 1.51 Allowed 'General case' 0 N--CA 1.445 -0.695 0 O-C-N 124.238 0.961 . . . . 10.0 112.912 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -156.91 121.16 4.36 Favored 'General case' 0 CA--C 1.503 -0.832 0 CA-C-O 122.936 1.35 . . . . 10.0 110.037 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 59.99 14.52 4.39 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 124.022 1.868 . . . . 10.0 115.338 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 105.9 9.55 32.22 Favored Glycine 0 C--O 1.241 0.591 0 O-C-N 120.818 -1.176 . . . . 10.0 115.775 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 20.1 m -101.69 164.32 3.05 Favored 'Isoleucine or valine' 0 C--O 1.239 0.539 0 CA-C-N 118.77 1.285 . . . . 10.0 110.061 179.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 1.3 m -131.41 108.67 9.78 Favored 'General case' 0 N--CA 1.447 -0.599 0 O-C-N 125.3 1.625 . . . . 10.0 114.558 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -111.47 137.45 49.26 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 104.753 -2.314 . . . . 10.0 104.753 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.88 166.98 23.15 Favored 'General case' 0 CA--C 1.509 -0.618 0 O-C-N 125.362 1.664 . . . . 10.0 114.913 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . 0.427 ' HB2' HD22 ' A' ' 117' ' ' LEU . 3.8 mt-30 -139.99 163.76 31.83 Favored 'General case' 0 C--O 1.242 0.7 0 O-C-N 125.902 2.001 . . . . 10.0 108.665 -179.836 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 6.9 m -125.98 66.95 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 N-CA-C 105.713 -1.958 . . . . 10.0 105.713 179.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . 0.439 ' CE1' ' HB2' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -56.22 132.34 50.33 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 125.576 1.55 . . . . 10.0 109.309 -179.927 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 37.4 tptt -111.48 104.78 13.22 Favored 'General case' 0 C--O 1.242 0.68 0 N-CA-C 106.387 -1.708 . . . . 10.0 106.387 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 1.4 ttpt -73.72 97.62 2.74 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 105.467 -2.049 . . . . 10.0 105.467 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 2.6 t -42.97 -31.9 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 124.546 1.154 . . . . 10.0 112.947 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 10.1 t60 . . . . . 0 C--N 1.317 -0.837 0 O-C-N 127.372 2.92 . . . . 10.0 110.924 179.677 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo . . . . . 0 N--CA 1.482 0.848 0 CA-C-O 119.758 -0.184 . . . . 10.0 111.871 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 9.8 p -98.12 -30.37 3.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 O-C-N 126.617 2.448 . . . . 10.0 112.826 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.0 t0 71.67 147.87 0.08 Allowed 'General case' 0 C--N 1.328 -0.339 0 O-C-N 124.686 1.241 . . . . 10.0 111.268 179.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -175.45 -49.38 0.01 OUTLIER 'General case' 0 C--O 1.244 0.776 0 N-CA-C 116.356 1.984 . . . . 10.0 116.356 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 35.0 t-20 -35.91 104.5 0.03 OUTLIER 'General case' 0 C--O 1.241 0.655 0 N-CA-C 115.659 1.726 . . . . 10.0 115.659 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -148.06 -137.04 2.83 Favored Glycine 0 C--O 1.217 -0.906 0 N-CA-C 117.61 1.804 . . . . 10.0 117.61 179.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 15.4 t80 -156.26 101.08 2.04 Favored 'General case' 0 C--O 1.242 0.691 0 N-CA-C 102.964 -2.976 . . . . 10.0 102.964 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.668 ' CE3' ' CE2' ' A' ' 130' ' ' PHE . 0.0 OUTLIER -90.59 121.93 32.95 Favored 'General case' 0 C--N 1.312 -1.04 0 N-CA-C 114.657 1.354 . . . . 10.0 114.657 -179.972 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.69 132.25 42.54 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 103.033 -2.951 . . . . 10.0 103.033 178.825 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.42 ' HG2' ' HB3' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -78.98 150.52 31.97 Favored 'General case' 0 C--N 1.312 -1.049 0 N-CA-C 116.386 1.995 . . . . 10.0 116.386 -179.419 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.9 tp -124.02 -59.21 1.51 Allowed 'General case' 0 CA--C 1.505 -0.778 0 CA-C-N 113.265 -1.789 . . . . 10.0 111.535 -179.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -131.73 172.38 12.34 Favored 'General case' 0 C--O 1.221 -0.413 0 N-CA-C 115.958 1.836 . . . . 10.0 115.958 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -161.57 135.32 6.62 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 111.375 -2.648 . . . . 10.0 109.037 179.814 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -107.05 -77.13 0.6 Allowed 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 115.818 1.784 . . . . 10.0 115.818 -179.828 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 36.1 m120 -96.4 58.51 1.77 Allowed 'General case' 0 C--N 1.32 -0.683 0 O-C-N 126.525 2.391 . . . . 10.0 111.389 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -70.06 -58.56 3.68 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 113.651 0.982 . . . . 10.0 113.651 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 64.3 mt-10 -67.86 -29.06 68.1 Favored 'General case' 0 C--O 1.243 0.719 0 C-N-CA 123.758 0.823 . . . . 10.0 112.74 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -76.39 -23.33 54.08 Favored 'General case' 0 C--O 1.218 -0.561 0 C-N-CA 119.118 -1.033 . . . . 10.0 109.652 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -73.98 -41.91 61.24 Favored 'General case' 0 CA--C 1.557 1.235 0 C-N-CA 124.455 1.102 . . . . 10.0 109.146 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.8 mt -70.7 -28.27 64.62 Favored 'General case' 0 C--O 1.217 -0.645 0 O-C-N 126.35 2.281 . . . . 10.0 112.891 -179.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.8 ttm-85 -73.61 -29.3 62.28 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 113.464 -1.698 . . . . 10.0 108.517 -179.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.3 -29.89 67.85 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 120.625 -1.297 . . . . 10.0 113.678 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 20.4 mt -105.45 1.2 27.49 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 125.35 1.656 . . . . 10.0 114.529 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 43.64 82.83 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.01 0 O-C-N 126.158 2.161 . . . . 10.0 110.164 -179.757 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 15.5 m -113.79 46.02 0.31 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.54 0 CA-C-N 113.344 -1.753 . . . . 10.0 111.167 -179.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 65.44 138.47 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 114.676 1.361 . . . . 10.0 114.676 179.781 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 31.1 m -64.12 -31.26 52.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 117.181 2.289 . . . . 10.0 117.181 -179.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -73.64 -41.48 62.69 Favored 'General case' 0 C--O 1.245 0.85 0 CA-C-N 114.373 -1.285 . . . . 10.0 111.748 -179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.54 -34.73 78.92 Favored 'General case' 0 C--O 1.223 -0.333 0 C-N-CA 123.628 0.771 . . . . 10.0 112.646 -179.604 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.93 -33.41 51.73 Favored 'General case' 0 CA--C 1.542 0.636 0 O-C-N 125.074 1.484 . . . . 10.0 111.488 179.718 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 33.1 ttmt -77.67 -33.71 53.28 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 123.064 1.411 . . . . 10.0 108.502 179.347 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -78.28 -38.93 23.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 N-CA-C 108.446 -0.946 . . . . 10.0 108.446 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -73.15 -20.1 60.98 Favored 'General case' 0 C--N 1.317 -0.814 0 O-C-N 124.386 1.054 . . . . 10.0 110.314 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -77.35 -33.11 55.41 Favored 'General case' 0 C--N 1.32 -0.689 0 O-C-N 121.46 -0.775 . . . . 10.0 111.677 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 73.3 mt -95.0 31.79 1.8 Allowed 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 122.24 1.019 . . . . 10.0 108.611 179.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 10.3 tp -153.83 140.59 19.06 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.495 1.118 . . . . 10.0 109.35 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.42 ' HB3' ' HG2' ' A' ' 10' ' ' MET . 0.5 OUTLIER -122.02 119.43 28.8 Favored Pre-proline 0 N--CA 1.47 0.57 0 N-CA-C 105.348 -2.093 . . . . 10.0 105.348 179.823 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -76.43 111.49 3.27 Favored 'Trans proline' 0 N--CA 1.446 -1.313 1 C-N-CA 126.365 4.71 . . . . 10.0 118.925 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -83.41 122.01 27.93 Favored 'General case' 0 C--O 1.219 -0.518 0 N-CA-C 104.329 -2.471 . . . . 10.0 104.329 179.12 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.557 ' HE3' ' CH2' ' A' ' 8' ' ' TRP . 2.5 ttpt -104.62 131.84 51.56 Favored 'General case' 0 C--O 1.209 -1.067 0 CA-C-O 123.293 1.521 . . . . 10.0 112.905 -179.511 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -115.88 129.34 56.37 Favored 'General case' 0 C--O 1.239 0.522 0 N-CA-C 104.841 -2.281 . . . . 10.0 104.841 179.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.5 mt -102.76 144.62 13.42 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 C-N-CA 119.012 -1.075 . . . . 10.0 113.331 179.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 92.8 t -140.73 124.2 16.83 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.938 0 N-CA-C 104.427 -2.434 . . . . 10.0 104.427 179.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -111.04 154.19 24.56 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 108.718 -0.845 . . . . 10.0 108.718 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -131.75 53.71 1.98 Allowed 'General case' 0 C--O 1.236 0.359 0 CA-C-O 123.163 1.459 . . . . 10.0 107.352 179.834 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 77.03 -92.45 1.04 Allowed Glycine 0 C--N 1.339 0.708 0 N-CA-C 105.602 -2.999 . . . . 10.0 105.602 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -92.48 -49.2 6.25 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 108.138 -1.06 . . . . 10.0 108.138 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 43.4 m170 -60.52 141.73 56.18 Favored 'General case' 0 C--O 1.218 -0.581 0 CA-C-O 122.482 1.134 . . . . 10.0 108.556 179.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 33.1 ttp -135.1 141.95 46.15 Favored 'General case' 0 N--CA 1.437 -1.101 0 CA-C-N 113.635 -1.62 . . . . 10.0 111.493 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 3.2 mt -130.19 136.73 58.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 106.701 -1.592 . . . . 10.0 106.701 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.441 ' HB ' ' HB2' ' A' ' 62' ' ' MET . 1.7 mm -119.93 105.36 17.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 122.998 1.38 . . . . 10.0 108.759 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 21.5 mtp85 -89.98 113.36 25.01 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 113.7 -1.591 . . . . 10.0 109.423 179.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 4.3 m -108.83 95.52 5.71 Favored 'General case' 0 C--O 1.239 0.543 0 N-CA-C 100.286 -3.968 . . . . 10.0 100.286 -180.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -95.33 146.09 24.63 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 117.531 2.419 . . . . 10.0 117.531 179.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -159.19 174.49 14.77 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 113.008 -1.905 . . . . 10.0 106.898 179.817 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 19.9 p -95.47 -8.71 34.61 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 121.647 -0.658 . . . . 10.0 110.82 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 6.4 t80 -92.6 -50.33 5.66 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 124.996 1.319 . . . . 10.0 109.461 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.89 -177.1 5.29 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 125.332 1.645 . . . . 10.0 111.052 179.714 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -138.68 156.83 47.08 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-O 124.276 1.989 . . . . 10.0 113.883 179.631 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -123.87 112.79 17.67 Favored 'General case' 0 C--O 1.211 -0.928 0 N-CA-C 104.904 -2.258 . . . . 10.0 104.904 179.827 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 19.9 mm -114.19 129.86 69.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 O-C-N 124.184 0.928 . . . . 10.0 110.65 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.522 ' HE1' ' CZ ' ' A' ' 64' ' ' PHE . 3.0 mtt -130.19 156.3 44.82 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 107.134 -1.432 . . . . 10.0 107.134 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -141.43 75.13 1.48 Allowed 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 103.797 -2.668 . . . . 10.0 103.797 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.522 ' CZ ' ' HE1' ' A' ' 62' ' ' MET . 2.6 m-30 -76.66 162.87 27.38 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 114.378 1.251 . . . . 10.0 114.378 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -131.32 107.1 8.72 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 113.322 -1.763 . . . . 10.0 108.34 -179.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -64.29 135.19 28.31 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 N-CA-C 108.255 -1.017 . . . . 10.0 108.255 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 56.39 36.25 69.08 Favored Glycine 0 N--CA 1.437 -1.257 0 O-C-N 126.016 2.073 . . . . 10.0 117.254 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -156.42 139.23 15.21 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 115.256 1.576 . . . . 10.0 115.256 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -52.7 138.83 27.88 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-O 119.16 -0.448 . . . . 10.0 111.786 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -140.75 96.22 2.98 Favored 'General case' 0 C--O 1.243 0.753 0 CA-C-O 123.209 1.48 . . . . 10.0 113.02 179.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -74.86 137.82 42.06 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 105.003 -2.221 . . . . 10.0 105.003 -179.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -138.58 130.53 28.16 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 124.228 1.011 . . . . 10.0 113.288 -179.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 20.9 p-10 -104.6 118.42 36.53 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-O 125.233 2.444 . . . . 10.0 111.684 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -124.66 126.62 46.04 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 116.658 2.096 . . . . 10.0 116.658 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -144.04 104.68 4.17 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 107.955 -1.128 . . . . 10.0 107.955 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 140.66 -80.42 0.26 Allowed Glycine 0 N--CA 1.442 -0.951 0 C-N-CA 119.766 -1.207 . . . . 10.0 111.047 -179.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -84.74 96.18 4.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 N-CA-C 106.302 -1.74 . . . . 10.0 106.302 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.48 -19.33 0.4 Allowed 'General case' 0 C--O 1.243 0.741 0 N-CA-C 115.16 1.541 . . . . 10.0 115.16 -179.919 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.0 p30 49.75 -164.25 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 125.756 1.622 . . . . 10.0 114.733 -179.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 8.6 ttm-85 83.82 143.74 0.07 Allowed 'General case' 0 C--N 1.32 -0.7 0 O-C-N 125.303 1.627 . . . . 10.0 110.906 179.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 5.5 pttt -93.98 165.34 12.7 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 102.412 -3.181 . . . . 10.0 102.412 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -155.1 144.42 21.12 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 120.89 -1.131 . . . . 10.0 108.695 179.848 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 31.2 mtt -114.34 52.05 0.85 Allowed 'General case' 0 N--CA 1.439 -1.001 0 N-CA-C 102.865 -3.013 . . . . 10.0 102.865 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 50.2 m -52.23 126.09 17.84 Favored 'General case' 0 N--CA 1.442 -0.862 0 N-CA-C 117.44 2.385 . . . . 10.0 117.44 -179.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 9.3 m -125.46 112.74 16.61 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 103.668 -2.716 . . . . 10.0 103.668 179.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.506 HG22 ' CD2' ' A' ' 64' ' ' PHE . 31.6 t -85.06 159.55 3.34 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.594 0 N-CA-C 101.095 -3.669 . . . . 10.0 101.095 -179.805 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -156.0 165.75 35.53 Favored 'General case' 0 C--N 1.318 -0.789 0 O-C-N 125.022 1.451 . . . . 10.0 113.296 179.857 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . 0.465 ' CD1' ' C ' ' A' ' 88' ' ' TRP . 0.0 OUTLIER -115.41 125.37 53.06 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 105.308 -2.108 . . . . 10.0 105.308 179.922 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -142.77 103.75 4.25 Favored 'General case' 0 CA--C 1.506 -0.726 0 N-CA-C 101.559 -3.497 . . . . 10.0 101.559 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 74.63 -146.94 36.27 Favored Glycine 0 CA--C 1.501 -0.796 0 N-CA-C 109.271 -1.531 . . . . 10.0 109.271 179.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -97.32 20.32 11.73 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-O 122.446 1.117 . . . . 10.0 109.681 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 6.6 mtmm -104.58 -174.67 2.59 Favored 'General case' 0 CA--C 1.508 -0.647 0 O-C-N 120.741 -1.225 . . . . 10.0 109.633 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 8.1 tp -131.36 128.6 39.99 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 103.125 -2.917 . . . . 10.0 103.125 179.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 6.6 mp0 -128.07 125.66 39.71 Favored 'General case' 0 C--N 1.316 -0.873 0 O-C-N 124.941 1.401 . . . . 10.0 112.515 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -124.7 125.62 44.38 Favored 'General case' 0 C--N 1.321 -0.667 0 O-C-N 121.9 -0.5 . . . . 10.0 109.845 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 71.1 t -120.8 142.95 34.57 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 N-CA-C 107.326 -1.361 . . . . 10.0 107.326 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 11.2 mt-30 -126.47 146.31 50.15 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 117.702 -1.142 . . . . 10.0 110.983 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 25.6 mmtt -86.24 -96.95 0.08 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 117.426 -1.273 . . . . 10.0 110.183 -179.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 51.4 -166.52 0.75 Allowed Glycine 0 CA--C 1.503 -0.674 0 O-C-N 124.126 0.891 . . . . 10.0 111.307 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -82.13 -170.11 2.73 Favored 'General case' 0 N--CA 1.447 -0.603 0 N-CA-C 112.788 0.662 . . . . 10.0 112.788 179.747 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 4.3 mttm 71.18 -158.75 0.13 Allowed 'General case' 0 N--CA 1.442 -0.867 0 CA-C-O 122.878 1.323 . . . . 10.0 113.178 179.78 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -146.75 18.2 1.29 Allowed 'General case' 0 CA--C 1.506 -0.736 0 O-C-N 119.861 -1.775 . . . . 10.0 115.272 -179.845 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -156.55 27.12 0.53 Allowed Glycine 0 C--O 1.226 -0.386 0 N-CA-C 118.226 2.05 . . . . 10.0 118.226 -179.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 8.6 mtm180 -86.07 117.78 25.12 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 121.492 -1.005 . . . . 10.0 109.641 179.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 163.24 151.58 6.48 Favored Glycine 0 N--CA 1.437 -1.242 0 O-C-N 125.66 1.85 . . . . 10.0 110.57 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' TRP . . . . . 0.437 ' CE2' ' HE3' ' A' ' 119' ' ' MET . 1.8 m0 -114.1 161.27 17.97 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 108.035 -1.098 . . . . 10.0 108.035 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.9 m -142.31 131.23 23.0 Favored 'General case' 0 C--O 1.212 -0.92 0 O-C-N 124.628 1.205 . . . . 10.0 110.984 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 -119.3 131.57 55.77 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.602 1.161 . . . . 10.0 109.603 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' TRP . . . . . 0.492 ' C ' ' CD1' ' A' ' 109' ' ' TRP . 0.0 OUTLIER -137.47 113.71 10.04 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 106.871 -1.529 . . . . 10.0 106.871 179.977 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -86.27 146.41 6.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 N-CA-C 116.38 1.992 . . . . 10.0 116.38 179.76 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -149.94 127.49 11.57 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-O 116.072 -1.918 . . . . 10.0 107.575 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 46.61 -129.23 11.37 Favored Glycine 0 CA--C 1.534 1.233 0 N-CA-C 106.24 -2.744 . . . . 10.0 106.24 179.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -95.51 29.11 2.68 Favored 'General case' 0 C--N 1.321 -0.659 0 O-C-N 124.829 0.958 . . . . 10.0 113.304 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -140.71 151.8 44.8 Favored 'General case' 0 C--O 1.24 0.595 0 CA-C-N 119.801 1.182 . . . . 10.0 111.634 179.855 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.541 ' HG ' ' CE2' ' A' ' 130' ' ' PHE . 0.7 OUTLIER -108.99 130.8 55.48 Favored 'General case' 0 C--N 1.316 -0.869 0 O-C-N 125.949 2.03 . . . . 10.0 108.992 179.882 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . 0.457 ' CE1' HG21 ' A' ' 129' ' ' VAL . 13.0 m80 -111.59 98.77 7.67 Favored 'General case' 0 CA--C 1.503 -0.83 0 N-CA-C 108.369 -0.974 . . . . 10.0 108.369 -179.809 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 15.7 tp -80.49 121.9 26.34 Favored 'General case' 0 CA--C 1.51 -0.567 0 C-N-CA 118.141 -1.424 . . . . 10.0 113.606 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -113.34 88.13 2.76 Favored 'General case' 0 C--O 1.214 -0.79 0 N-CA-C 104.239 -2.504 . . . . 10.0 104.239 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.437 ' HE3' ' CE2' ' A' ' 106' ' ' TRP . 0.0 OUTLIER -83.47 149.96 26.31 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-N 114.387 -1.278 . . . . 10.0 111.447 -179.868 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 24.4 mtt180 -144.56 137.52 26.84 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 120.466 1.485 . . . . 10.0 114.237 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -150.18 133.61 16.49 Favored 'General case' 0 CA--C 1.507 -0.701 0 N-CA-C 107.073 -1.454 . . . . 10.0 107.073 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 40.74 44.73 1.93 Allowed 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 116.943 2.201 . . . . 10.0 116.943 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 91.95 -11.96 70.76 Favored Glycine 0 CA--C 1.533 1.201 0 O-C-N 120.711 -1.243 . . . . 10.0 115.935 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 92.7 t -90.28 154.74 3.13 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 N-CA-C 107.385 -1.339 . . . . 10.0 107.385 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 34.5 m -144.57 92.35 2.29 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-O 124.728 2.204 . . . . 10.0 111.062 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -79.93 144.18 33.58 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-N 112.847 -1.978 . . . . 10.0 106.615 -179.839 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.18 101.01 5.4 Favored 'General case' 0 CA--C 1.504 -0.818 0 O-C-N 125.127 1.517 . . . . 10.0 110.948 -179.806 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.79 156.47 18.02 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 122.715 1.245 . . . . 10.0 108.625 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.457 HG21 ' CE1' ' A' ' 116' ' ' HIS . 11.0 p -143.73 137.29 24.67 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-O 117.296 -1.335 . . . . 10.0 107.756 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . 0.668 ' CE2' ' CE3' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -138.61 -169.98 2.73 Favored 'General case' 0 C--N 1.315 -0.894 0 O-C-N 125.138 1.524 . . . . 10.0 108.751 -179.858 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . 0.287 16.3 tptp -142.97 129.43 20.08 Favored 'General case' 0 C--N 1.32 -0.714 0 O-C-N 119.362 -2.086 . . . . 10.0 105.962 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 11.5 mtpt -81.47 110.55 16.98 Favored 'General case' 0 CA--C 1.503 -0.84 0 CA-C-O 123.464 1.602 . . . . 10.0 111.856 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 2.5 t -92.53 -0.45 10.02 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 114.773 -1.103 . . . . 10.0 109.091 179.679 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 12.1 m80 . . . . . 0 N--CA 1.434 -1.271 0 CA-C-N 113.938 -1.483 . . . . 10.0 111.572 179.79 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo . . . . . 0 N--CA 1.48 0.726 0 N-CA-C 115.044 1.132 . . . . 10.0 115.044 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 1.8 t 72.18 104.31 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.244 0.775 0 O-C-N 125.864 1.978 . . . . 10.0 109.0 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -150.55 81.03 1.35 Allowed 'General case' 0 CA--C 1.54 0.587 0 O-C-N 125.218 1.574 . . . . 10.0 108.934 179.671 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -70.73 -33.71 71.12 Favored 'General case' 0 C--O 1.224 -0.26 0 C-N-CA 125.653 1.581 . . . . 10.0 112.363 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 30.1 t-20 -46.38 94.49 0.01 OUTLIER 'General case' 0 C--O 1.243 0.711 0 O-C-N 124.613 1.196 . . . . 10.0 111.305 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -148.96 -114.23 0.73 Allowed Glycine 0 N--CA 1.443 -0.859 0 N-CA-C 119.2 2.44 . . . . 10.0 119.2 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -155.64 -166.37 2.21 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 104.912 -2.255 . . . . 10.0 104.912 -179.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.464 ' NE1' ' CB ' ' A' ' 39' ' ' ASP 0.359 41.9 p90 -157.93 -170.44 3.16 Favored 'General case' 0 C--N 1.311 -1.077 0 C-N-CA 125.228 1.411 . . . . 10.0 113.966 -178.104 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.487 ' HE3' ' CG1' ' A' ' 133' ' ' VAL . 5.7 ttmt 166.19 98.95 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 111.733 -2.485 . . . . 10.0 109.07 176.676 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.528 ' HA ' ' CD1' ' A' ' 130' ' ' PHE . 0.0 OUTLIER -53.85 137.49 38.43 Favored 'General case' 0 N--CA 1.442 -0.836 0 N-CA-C 115.72 1.748 . . . . 10.0 115.72 -179.746 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -108.65 -55.53 2.38 Favored 'General case' 0 C--O 1.246 0.878 0 N-CA-C 108.394 -0.965 . . . . 10.0 108.394 -179.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -169.24 145.62 3.39 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 123.646 1.688 . . . . 10.0 115.337 -179.985 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -119.17 157.31 28.2 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 111.407 -2.633 . . . . 10.0 104.094 179.735 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -152.58 170.86 19.16 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 117.353 -1.308 . . . . 10.0 111.711 179.867 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 47.87 38.19 8.58 Favored 'General case' 0 C--O 1.243 0.738 0 O-C-N 125.063 1.477 . . . . 10.0 111.699 -179.855 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -76.0 -33.67 59.7 Favored 'General case' 0 C--N 1.34 0.178 0 CA-C-N 114.342 -1.299 . . . . 10.0 114.328 -179.546 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -77.08 -34.88 56.93 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 122.344 1.069 . . . . 10.0 112.557 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -76.89 -25.37 52.96 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 113.754 -1.566 . . . . 10.0 109.124 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -65.91 -44.29 85.63 Favored 'General case' 0 CA--C 1.55 0.948 0 O-C-N 126.122 2.139 . . . . 10.0 110.01 179.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 19.6 mt -76.37 -23.58 54.14 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 119.578 1.081 . . . . 10.0 112.825 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.43 -25.56 67.58 Favored 'General case' 0 C--O 1.244 0.807 0 O-C-N 125.479 1.737 . . . . 10.0 109.001 -179.752 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.7 -45.06 72.62 Favored 'General case' 0 N--CA 1.466 0.341 0 O-C-N 124.829 1.331 . . . . 10.0 111.47 -179.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.9 mt -85.07 -15.85 42.62 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 120.018 -1.676 . . . . 10.0 112.115 -179.669 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 19.3 t0 65.79 70.93 0.43 Allowed 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 114.642 1.349 . . . . 10.0 114.642 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.474 ' CG2' HD23 ' A' ' 29' ' ' LEU . 0.9 OUTLIER -103.65 167.34 2.64 Favored 'Isoleucine or valine' 0 C--N 1.344 0.367 0 N-CA-C 108.996 -0.742 . . . . 10.0 108.996 -179.825 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -51.57 160.02 0.68 Allowed 'General case' 0 C--O 1.244 0.77 0 O-C-N 125.148 1.53 . . . . 10.0 114.331 -179.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 39.3 t -76.18 -25.54 16.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 115.038 1.495 . . . . 10.0 115.038 -179.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -74.81 -33.62 62.24 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 114.482 -1.235 . . . . 10.0 112.629 179.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.474 HD23 ' CG2' ' A' ' 25' ' ' VAL . 13.1 tp -68.75 -26.25 65.14 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 122.003 0.906 . . . . 10.0 112.737 179.782 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.54 -22.21 51.43 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 113.395 -1.729 . . . . 10.0 113.682 179.869 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.9 tptm -73.13 -46.72 49.49 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 124.621 1.168 . . . . 10.0 110.195 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.472 HG21 ' CE2' ' A' ' 57' ' ' PHE . 5.8 mm -61.69 -57.29 12.77 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 O-C-N 125.531 1.769 . . . . 10.0 111.498 -179.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -48.87 -66.23 0.43 Allowed 'General case' 0 C--N 1.319 -0.725 0 O-C-N 126.524 2.39 . . . . 10.0 113.255 179.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -59.74 83.3 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.453 0 O-C-N 119.481 -2.012 . . . . 10.0 115.194 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.439 ' CD1' HD21 ' A' ' 36' ' ' LEU . 0.8 OUTLIER 159.69 -29.87 0.0 OUTLIER 'General case' 0 N--CA 1.445 -0.696 0 O-C-N 125.407 1.692 . . . . 10.0 109.61 179.95 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.439 HD21 ' CD1' ' A' ' 35' ' ' LEU . 35.0 mt -79.39 145.21 33.5 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 119.581 -0.848 . . . . 10.0 112.964 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.2 mttt -129.89 103.11 17.36 Favored Pre-proline 0 N--CA 1.466 0.346 0 N-CA-C 107.129 -1.434 . . . . 10.0 107.129 -179.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 0.2 OUTLIER -82.66 155.5 15.85 Favored 'Trans proline' 0 N--CA 1.448 -1.198 1 C-N-CA 126.599 4.866 . . . . 10.0 117.384 179.999 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.464 ' CB ' ' NE1' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -107.86 159.4 16.55 Favored 'General case' 0 C--N 1.313 -0.984 0 O-C-N 128.661 3.725 . . . . 10.0 106.538 179.752 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.45 ' HG3' ' CZ ' ' A' ' 130' ' ' PHE . 2.4 mtpm? -144.82 109.98 5.15 Favored 'General case' 0 N--CA 1.435 -1.197 0 C-N-CA 117.837 -1.545 . . . . 10.0 113.54 -179.543 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.448 ' HB2' ' CZ3' ' A' ' 8' ' ' TRP . 1.0 OUTLIER -96.19 146.71 24.46 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 102.602 -3.11 . . . . 10.0 102.602 179.086 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 13.0 mt -132.26 139.44 50.11 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 O-C-N 124.902 1.376 . . . . 10.0 111.007 179.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 49.5 t -132.18 114.04 22.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 113.03 -1.896 . . . . 10.0 106.248 179.742 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.422 ' HG2' ' CG ' ' A' ' 49' ' ' MET . 0.0 OUTLIER -115.86 135.17 54.25 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 108.043 -1.095 . . . . 10.0 108.043 179.603 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -142.52 101.29 3.85 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 107.148 -1.426 . . . . 10.0 107.148 -179.756 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 61.14 -121.33 26.09 Favored Glycine 0 C--O 1.243 0.717 0 CA-C-O 123.154 1.419 . . . . 10.0 110.228 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -103.01 37.49 1.95 Allowed 'General case' 0 N--CA 1.472 0.668 0 O-C-N 121.907 -0.761 . . . . 10.0 109.259 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 20.5 m80 -147.39 129.35 15.38 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 106.955 -1.498 . . . . 10.0 106.955 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.422 ' CG ' ' HG2' ' A' ' 44' ' ' GLN . 2.6 ttm -133.89 158.11 44.27 Favored 'General case' 0 C--O 1.215 -0.728 0 N-CA-C 114.279 1.215 . . . . 10.0 114.279 179.802 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 35.1 mt -134.19 136.48 53.25 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.98 0 N-CA-C 105.191 -2.152 . . . . 10.0 105.191 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.2 mp -122.18 143.86 33.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 N-CA-C 104.528 -2.397 . . . . 10.0 104.528 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.41 ' HG2' HG13 ' A' ' 61' ' ' ILE . 5.1 mtt180 -133.37 109.96 9.71 Favored 'General case' 0 C--O 1.212 -0.913 0 O-C-N 125.79 1.932 . . . . 10.0 115.295 -179.934 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.9 m -90.23 125.14 35.38 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 100.554 -3.869 . . . . 10.0 100.554 -179.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -120.2 33.56 5.55 Favored 'General case' 0 C--N 1.319 -0.723 1 N-CA-C 122.555 4.28 . . . . 10.0 122.555 -179.631 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 43.0 t -69.45 177.86 2.7 Favored 'General case' 0 C--N 1.323 -0.572 0 O-C-N 120.143 -1.598 . . . . 10.0 107.046 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.5 m -108.61 64.36 0.61 Allowed 'General case' 0 C--N 1.328 -0.356 0 O-C-N 125.819 1.949 . . . . 10.0 112.05 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.472 ' CE2' HG21 ' A' ' 32' ' ' ILE . 0.8 OUTLIER -173.47 -62.23 0.02 OUTLIER 'General case' 0 C--N 1.347 0.475 0 CA-C-N 113.758 -1.565 . . . . 10.0 107.504 -179.891 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 5.6 mtp180 -118.81 110.4 17.17 Favored 'General case' 0 C--N 1.328 -0.345 0 O-C-N 124.569 1.168 . . . . 10.0 112.412 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -114.71 91.44 3.62 Favored 'General case' 0 C--N 1.327 -0.381 0 O-C-N 124.807 1.317 . . . . 10.0 112.258 -179.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 54.4 p90 -110.82 134.22 52.7 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 103.07 -2.937 . . . . 10.0 103.07 -179.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.41 HG13 ' HG2' ' A' ' 52' ' ' ARG . 1.4 mp -112.11 158.18 12.63 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.362 0 O-C-N 123.98 0.8 . . . . 10.0 111.912 179.801 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.459 ' HE2' ' CZ ' ' A' ' 64' ' ' PHE . 1.2 mmm -134.93 152.0 51.35 Favored 'General case' 0 C--N 1.322 -0.614 0 O-C-N 125.056 1.472 . . . . 10.0 107.517 179.774 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -134.38 90.44 2.67 Favored 'General case' 0 C--N 1.309 -1.156 0 N-CA-C 102.182 -3.266 . . . . 10.0 102.182 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.484 ' CZ ' HG23 ' A' ' 86' ' ' VAL . 1.0 OUTLIER -81.88 171.06 14.92 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 117.106 2.262 . . . . 10.0 117.106 179.916 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.98 93.09 2.21 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 103.812 -2.662 . . . . 10.0 103.812 -179.78 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.43 ' CG1' ' HB2' ' A' ' 88' ' ' TRP . 22.6 t -49.47 145.53 1.22 Allowed 'Isoleucine or valine' 0 C--O 1.246 0.901 0 CA-C-N 114.439 -1.255 . . . . 10.0 109.407 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 69.78 -3.17 9.84 Favored Glycine 0 C--O 1.213 -1.205 0 N-CA-C 116.571 1.389 . . . . 10.0 116.571 179.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.5 tttt -109.9 146.94 34.3 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 119.212 1.506 . . . . 10.0 111.846 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.36 164.98 3.87 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 107.479 -1.304 . . . . 10.0 107.479 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -166.96 117.32 0.89 Allowed 'General case' 0 N--CA 1.439 -1.006 0 O-C-N 124.629 1.206 . . . . 10.0 113.473 -179.79 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -76.89 154.1 34.06 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 117.454 -1.698 . . . . 10.0 106.722 -179.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -140.92 72.37 1.39 Allowed 'General case' 0 C--O 1.22 -0.494 0 N-CA-C 115.537 1.68 . . . . 10.0 115.537 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -78.22 121.51 24.47 Favored 'General case' 0 N--CA 1.439 -0.977 0 N-CA-C 106.552 -1.647 . . . . 10.0 106.552 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 5.7 mt -110.96 67.79 0.65 Allowed 'General case' 0 C--N 1.318 -0.777 0 O-C-N 126.628 2.455 . . . . 10.0 114.692 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 1.4 p -88.44 66.39 8.26 Favored 'General case' 0 C--O 1.241 0.635 0 N-CA-C 105.527 -2.027 . . . . 10.0 105.527 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -156.25 -43.46 0.02 OUTLIER Glycine 0 C--O 1.241 0.583 0 C-N-CA 117.608 -2.234 . . . . 10.0 112.318 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 55.4 mt -113.5 -29.66 2.25 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.912 0 CA-C-N 119.257 1.529 . . . . 10.0 110.96 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -145.67 15.09 1.41 Allowed 'General case' 0 C--O 1.239 0.506 0 N-CA-C 114.053 1.131 . . . . 10.0 114.053 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 38.27 83.34 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 115.253 1.575 . . . . 10.0 115.253 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -141.49 -176.08 4.6 Favored 'General case' 0 C--N 1.316 -0.876 0 O-C-N 127.344 2.903 . . . . 10.0 111.965 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.14 156.82 27.34 Favored 'General case' 0 N--CA 1.445 -0.707 0 N-CA-C 103.656 -2.72 . . . . 10.0 103.656 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 1.5 p -166.84 -176.8 3.58 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 106.08 -1.822 . . . . 10.0 106.08 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 33.0 mtp -127.66 95.63 4.29 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 100.243 -3.984 . . . . 10.0 100.243 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 59.6 m -95.87 139.3 32.28 Favored 'General case' 0 CA--C 1.513 -0.471 0 N-CA-C 117.149 2.277 . . . . 10.0 117.149 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 19.8 m -133.21 97.47 3.99 Favored 'General case' 0 N--CA 1.437 -1.122 0 N-CA-C 106.89 -1.522 . . . . 10.0 106.89 179.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.484 HG23 ' CZ ' ' A' ' 64' ' ' PHE . 2.5 t -76.64 97.87 1.71 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.466 0 N-CA-C 104.657 -2.349 . . . . 10.0 104.657 -179.924 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.0 t -89.7 170.39 10.49 Favored 'General case' 0 C--N 1.316 -0.857 0 O-C-N 124.946 1.404 . . . . 10.0 108.959 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . 0.43 ' HB2' ' CG1' ' A' ' 66' ' ' VAL . 5.8 t90 -123.88 96.7 5.05 Favored 'General case' 0 C--O 1.24 0.579 0 N-CA-C 107.203 -1.406 . . . . 10.0 107.203 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -57.3 -64.51 0.86 Allowed 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 103.433 -2.803 . . . . 10.0 103.433 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 141.88 115.1 1.11 Allowed Glycine 0 CA--C 1.499 -0.914 0 N-CA-C 103.973 -3.651 . . . . 10.0 103.973 179.79 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 20.1 t0 87.9 -30.83 0.04 OUTLIER 'General case' 0 N--CA 1.448 -0.55 0 O-C-N 125.894 1.585 . . . . 10.0 109.834 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 8.5 mtmt -125.06 139.82 53.46 Favored 'General case' 0 C--N 1.32 -0.682 0 O-C-N 121.215 -0.928 . . . . 10.0 110.239 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -91.04 108.38 19.83 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 103.107 -2.923 . . . . 10.0 103.107 -179.899 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -121.29 138.64 54.15 Favored 'General case' 0 C--O 1.216 -0.706 0 O-C-N 125.136 1.522 . . . . 10.0 114.077 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 19.3 p -138.42 152.75 48.64 Favored 'General case' 0 C--N 1.321 -0.667 0 O-C-N 125.022 1.451 . . . . 10.0 108.396 -179.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 2.9 t -109.66 -54.83 5.3 Favored 'Isoleucine or valine' 0 C--O 1.247 0.922 0 N-CA-C 107.143 -1.429 . . . . 10.0 107.143 179.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.44 ' CG ' ' HB3' ' A' ' 104' ' ' ARG . 0.0 OUTLIER 71.08 111.99 0.06 Allowed 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 123.802 1.763 . . . . 10.0 109.263 179.926 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.33 67.2 7.18 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-O 123.578 1.656 . . . . 10.0 115.012 179.711 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -92.04 147.91 18.95 Favored Glycine 0 C--O 1.218 -0.86 0 N-CA-C 107.754 -2.138 . . . . 10.0 107.754 179.759 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -48.38 -25.99 1.86 Allowed 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 116.993 2.22 . . . . 10.0 116.993 179.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.55 -158.56 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.804 0 CA-C-N 119.788 1.176 . . . . 10.0 113.688 179.799 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -117.01 -24.93 7.38 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 126.186 1.795 . . . . 10.0 114.0 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -117.0 10.58 15.26 Favored Glycine 0 C--N 1.342 0.865 0 N-CA-C 116.757 1.463 . . . . 10.0 116.757 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.44 ' HB3' ' CG ' ' A' ' 97' ' ' GLN . 24.2 mmm-85 -55.34 143.16 29.4 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 119.031 1.416 . . . . 10.0 113.404 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 120.07 146.02 7.59 Favored Glycine 0 C--O 1.217 -0.922 0 O-C-N 124.576 1.173 . . . . 10.0 111.376 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -124.96 176.34 6.72 Favored 'General case' 0 CA--C 1.509 -0.623 0 O-C-N 120.854 -1.38 . . . . 10.0 109.961 179.871 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 76.7 m -145.74 132.74 20.27 Favored 'General case' 0 CA--C 1.509 -0.63 0 CA-C-O 118.799 -0.62 . . . . 10.0 109.593 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -123.92 126.58 46.61 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 123.929 0.891 . . . . 10.0 111.741 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 8.5 p90 -145.4 149.34 34.56 Favored 'General case' 0 C--O 1.213 -0.848 0 C-N-CA 124.301 1.04 . . . . 10.0 110.919 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 44.1 mt -89.82 147.18 5.38 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 O-C-N 125.541 1.776 . . . . 10.0 114.81 -179.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -131.74 75.05 1.62 Allowed 'General case' 0 C--O 1.24 0.589 0 N-CA-C 107.047 -1.464 . . . . 10.0 107.047 179.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 43.53 81.73 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.544 0 CA-C-O 118.176 -1.346 . . . . 10.0 110.71 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 71.15 23.78 4.04 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 118.277 -0.868 . . . . 10.0 110.947 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -143.0 103.1 4.12 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 114.774 1.398 . . . . 10.0 114.774 -179.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.415 ' CB ' ' HB2' ' A' ' 130' ' ' PHE . 0.8 OUTLIER -63.18 123.89 19.78 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 103.86 -2.644 . . . . 10.0 103.86 -179.97 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -134.32 99.43 4.38 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 106.906 -1.516 . . . . 10.0 106.906 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 13.8 tp -89.23 149.22 23.2 Favored 'General case' 0 C--N 1.314 -0.935 0 O-C-N 125.665 1.853 . . . . 10.0 113.43 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -133.96 124.09 25.74 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 104.999 -2.223 . . . . 10.0 104.999 -179.856 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.01 131.77 53.36 Favored 'General case' 0 C--N 1.319 -0.757 0 O-C-N 120.834 -1.166 . . . . 10.0 108.423 -179.693 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 77.2 mtm-85 -125.88 145.66 50.16 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 122.568 1.175 . . . . 10.0 110.49 179.712 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -153.62 115.04 4.18 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 106.465 -1.68 . . . . 10.0 106.465 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 45.95 57.08 5.43 Favored 'General case' 0 C--O 1.245 0.843 0 O-C-N 126.154 2.159 . . . . 10.0 116.697 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 87.69 -22.18 18.64 Favored Glycine 0 CA--C 1.534 1.278 0 N-CA-C 116.543 1.377 . . . . 10.0 116.543 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 2.6 t -75.64 151.73 6.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 CA-C-N 119.478 1.639 . . . . 10.0 109.556 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 12.8 m -136.56 86.12 2.19 Favored 'General case' 0 C--N 1.318 -0.782 0 O-C-N 124.473 1.108 . . . . 10.0 110.811 179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 30.6 p -98.66 154.48 17.92 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 112.337 -2.21 . . . . 10.0 105.062 -179.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.01 146.38 27.75 Favored 'General case' 0 C--O 1.221 -0.445 0 CA-C-O 123.374 1.559 . . . . 10.0 114.397 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -113.11 124.58 52.9 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 114.035 -1.439 . . . . 10.0 111.133 179.902 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 55.2 t -105.57 138.4 30.86 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.82 0 CA-C-N 113.41 -1.723 . . . . 10.0 107.203 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . 0.528 ' CD1' ' HA ' ' A' ' 10' ' ' MET . 15.3 m-85 -128.93 -177.68 4.31 Favored 'General case' 0 C--O 1.215 -0.72 0 C-N-CA 124.996 1.319 . . . . 10.0 110.452 -179.619 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.414 ' CB ' ' HD2' ' A' ' 9' ' ' LYS . 0.0 OUTLIER -134.1 99.37 4.39 Favored 'General case' 0 C--O 1.24 0.597 0 CA-C-N 113.972 -1.467 . . . . 10.0 107.454 179.852 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -68.07 98.3 0.76 Allowed 'General case' 0 CA--C 1.508 -0.659 0 C-N-CA 117.345 -1.742 . . . . 10.0 107.623 179.888 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . 0.487 ' CG1' ' HE3' ' A' ' 9' ' ' LYS . 20.2 m -76.15 -4.26 5.95 Favored 'Isoleucine or valine' 0 C--O 1.241 0.62 0 C-N-CA 118.689 -1.204 . . . . 10.0 112.574 -179.696 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 66.5 t-80 . . . . . 0 C--N 1.325 -0.493 0 O-C-N 125.623 1.827 . . . . 10.0 111.751 179.766 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo . . . . . 0 N--CA 1.478 0.576 0 N-CA-C 109.031 -1.18 . . . . 10.0 109.031 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 1.6 t 69.19 98.12 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 N-CA-C 108.672 -0.862 . . . . 10.0 108.672 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -86.05 -9.24 57.1 Favored 'General case' 0 C--O 1.216 -0.661 0 C-N-CA 119.4 -0.92 . . . . 10.0 110.859 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.477 ' CE1' HD12 ' A' ' 93' ' ' LEU . 43.1 m-85 62.72 -67.11 0.08 Allowed 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 115.968 1.84 . . . . 10.0 115.968 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -49.64 149.05 2.58 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.1 0.96 . . . . 10.0 111.854 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 170.15 -61.9 0.18 Allowed Glycine 0 N--CA 1.438 -1.203 0 O-C-N 125.082 1.489 . . . . 10.0 116.386 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -177.18 -166.65 0.14 Allowed 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 102.805 -3.035 . . . . 10.0 102.805 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.542 ' CZ3' ' HB3' ' A' ' 39' ' ' ASP 0.257 0.5 OUTLIER -153.36 -44.57 0.09 Allowed 'General case' 0 N--CA 1.442 -0.857 0 CA-C-O 116.663 -1.637 . . . . 10.0 115.108 -178.036 . . . . . . . . 4 4 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.49 ' HA ' ' CE3' ' A' ' 8' ' ' TRP . 1.3 pttt 12.46 98.94 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.001 1 O-C-N 129.45 4.218 . . . . 10.0 111.859 -177.201 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.415 ' HE2' ' HB3' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -61.72 157.58 17.5 Favored 'General case' 0 N--CA 1.441 -0.878 0 O-C-N 118.087 -2.883 . . . . 10.0 116.058 -179.891 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -111.89 -51.01 2.88 Favored 'General case' 0 C--O 1.245 0.859 0 CA-C-N 112.703 -2.044 . . . . 10.0 107.311 -179.692 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.1 p -146.45 -172.9 4.06 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 115.51 1.67 . . . . 10.0 115.51 179.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -169.16 133.84 1.48 Allowed 'General case' 0 C--O 1.22 -0.497 0 O-C-N 126.92 2.638 . . . . 10.0 106.961 -179.621 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -155.39 159.4 39.86 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-O 122.38 1.086 . . . . 10.0 111.497 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 72.16 5.7 5.37 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 116.103 1.89 . . . . 10.0 116.103 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -57.58 -23.75 52.48 Favored 'General case' 0 CA--C 1.551 0.991 0 N-CA-C 115.054 1.501 . . . . 10.0 115.054 179.577 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -79.54 -41.54 27.07 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-O 123.979 1.847 . . . . 10.0 110.762 -179.757 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.99 -27.2 63.53 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 122.486 1.136 . . . . 10.0 110.343 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -67.84 -58.11 5.14 Favored 'General case' 0 C--O 1.242 0.706 0 C-N-CA 124.521 1.128 . . . . 10.0 108.951 -179.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.59 -22.49 65.37 Favored 'General case' 0 C--O 1.211 -0.93 0 O-C-N 120.034 -1.666 . . . . 10.0 111.491 179.573 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.7 ttm-85 -75.4 -35.0 61.11 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 106.866 -1.531 . . . . 10.0 106.866 -179.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.14 -44.67 91.45 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 127.123 2.764 . . . . 10.0 112.435 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 26.5 mt -78.33 -34.15 48.75 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 125.493 1.517 . . . . 10.0 112.02 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 80.64 48.33 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.108 0 O-C-N 127.011 2.694 . . . . 10.0 113.529 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 27.9 m -82.85 164.46 2.77 Favored 'Isoleucine or valine' 0 C--O 1.242 0.71 0 O-C-N 124.996 1.435 . . . . 10.0 107.141 -179.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 9.0 m-20 -36.71 148.37 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.436 0 O-C-N 125.778 1.923 . . . . 10.0 115.213 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -70.63 -35.68 62.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 116.412 2.005 . . . . 10.0 116.412 -179.67 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -72.53 -21.06 61.23 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 123.517 1.627 . . . . 10.0 110.851 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.89 -41.96 77.59 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 119.31 -2.119 . . . . 10.0 111.733 179.632 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 15.8 ttp180 -56.5 -36.41 69.12 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 127.016 2.126 . . . . 10.0 113.51 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.8 tmtp? -68.53 -38.79 81.14 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 112.855 -1.975 . . . . 10.0 111.234 179.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 66.8 mt -75.36 -58.84 3.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 114.035 -1.439 . . . . 10.0 109.94 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -48.98 -31.97 8.35 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 116.335 1.976 . . . . 10.0 116.335 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -65.68 -18.24 65.18 Favored 'General case' 0 CA--C 1.516 -0.332 0 O-C-N 125.084 1.49 . . . . 10.0 110.888 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 53.1 mt -105.96 -7.38 18.17 Favored 'General case' 0 N--CA 1.448 -0.552 0 O-C-N 125.358 1.661 . . . . 10.0 113.44 -179.544 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -96.26 154.69 17.12 Favored 'General case' 0 C--O 1.219 -0.525 0 N-CA-C 114.203 1.186 . . . . 10.0 114.203 179.754 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.415 ' HB3' ' HE2' ' A' ' 10' ' ' MET . 3.6 mtmt -139.93 100.32 7.29 Favored Pre-proline 0 C--N 1.327 -0.413 0 N-CA-C 104.717 -2.327 . . . . 10.0 104.717 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_exo -70.02 167.47 24.7 Favored 'Trans proline' 0 C--O 1.24 0.6 1 C-N-CA 125.74 4.293 . . . . 10.0 116.322 -179.711 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.542 ' HB3' ' CZ3' ' A' ' 8' ' ' TRP . 2.9 p30 -124.71 166.72 15.66 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 106.207 -1.775 . . . . 10.0 106.207 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.94 90.04 1.43 Allowed 'General case' 0 N--CA 1.434 -1.254 0 CA-C-O 122.93 1.348 . . . . 10.0 112.848 179.903 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -85.72 103.94 14.97 Favored 'General case' 0 N--CA 1.442 -0.859 0 N-CA-C 105.232 -2.136 . . . . 10.0 105.232 179.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 10.2 mt -91.28 146.56 6.08 Favored 'Isoleucine or valine' 0 C--O 1.248 0.979 0 CA-C-N 113.691 -1.595 . . . . 10.0 109.384 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -151.44 121.53 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.817 0 CA-C-O 123.875 1.798 . . . . 10.0 109.466 -179.849 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.11 147.42 40.24 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 119.31 -2.119 . . . . 10.0 110.969 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -131.74 73.74 1.55 Allowed 'General case' 0 C--O 1.225 -0.217 0 CA-C-O 124.387 2.041 . . . . 10.0 106.375 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 88.81 -117.1 4.79 Favored Glycine 0 CA--C 1.533 1.189 0 N-CA-C 107.381 -2.288 . . . . 10.0 107.381 179.596 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -91.83 -13.83 30.77 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 118.142 -1.423 . . . . 10.0 108.062 -179.898 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 45.4 t-80 -81.01 138.38 36.04 Favored 'General case' 0 CA--C 1.518 -0.272 0 O-C-N 120.831 -1.168 . . . . 10.0 108.262 179.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 3.1 ttt -134.78 142.1 46.61 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.45 1.094 . . . . 10.0 110.923 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 8.8 mt -127.02 124.48 64.61 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.682 0 N-CA-C 106.573 -1.64 . . . . 10.0 106.573 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.438 ' N ' ' CD1' ' A' ' 51' ' ' ILE . 0.3 OUTLIER -106.84 100.17 10.11 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.901 0 N-CA-C 106.939 -1.504 . . . . 10.0 106.939 179.686 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.437 ' HG2' ' CD1' ' A' ' 61' ' ' ILE . 0.0 OUTLIER -93.58 127.55 39.3 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-O 122.136 0.969 . . . . 10.0 111.107 -179.868 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 57.5 m -106.69 121.43 44.33 Favored 'General case' 0 C--O 1.219 -0.507 0 N-CA-C 102.789 -3.041 . . . . 10.0 102.789 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.2 mp -104.1 58.05 0.72 Allowed 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 119.57 3.174 . . . . 10.0 119.57 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.8 t -83.36 172.53 12.41 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 104.475 -2.417 . . . . 10.0 104.475 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' THR . . . . . 0.429 HG21 ' CD1' ' A' ' 57' ' ' PHE . 9.6 t -106.09 -39.4 5.98 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.874 0.845 . . . . 10.0 109.648 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.429 ' CD1' HG21 ' A' ' 56' ' ' THR . 48.1 m-85 -72.38 -21.8 61.23 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 116.949 -1.501 . . . . 10.0 108.12 179.732 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 18.7 ptt-85 -151.7 -170.84 3.76 Favored 'General case' 0 C--N 1.328 -0.361 0 O-C-N 126.678 2.486 . . . . 10.0 111.698 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -179.51 82.21 0.01 OUTLIER 'General case' 0 C--O 1.243 0.733 0 CA-C-N 114.479 -1.237 . . . . 10.0 111.257 -179.624 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.413 ' CD1' ' O ' ' A' ' 60' ' ' TYR . 0.1 OUTLIER -93.22 127.84 38.95 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 124.991 2.329 . . . . 10.0 106.797 -179.702 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.437 ' CD1' ' HG2' ' A' ' 52' ' ' ARG . 17.9 mm -108.67 137.69 39.29 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.818 0 O-C-N 118.201 -2.812 . . . . 10.0 111.001 -179.746 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 20.4 mtm -110.66 162.83 14.36 Favored 'General case' 0 CA--C 1.515 -0.37 0 O-C-N 126.411 2.32 . . . . 10.0 108.983 179.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -144.48 78.3 1.57 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 102.126 -3.287 . . . . 10.0 102.126 179.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.425 ' CD2' HG11 ' A' ' 86' ' ' VAL . 1.9 m-30 -85.53 125.11 32.82 Favored 'General case' 0 N--CA 1.445 -0.699 0 O-C-N 126.045 2.091 . . . . 10.0 114.657 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 25.8 tt0 -105.72 139.55 40.14 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 111.94 -2.391 . . . . 10.0 105.703 -179.821 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -93.85 121.25 44.34 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-O 123.726 1.727 . . . . 10.0 108.67 -179.79 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 97.56 -12.74 64.62 Favored Glycine 0 C--O 1.213 -1.212 0 O-C-N 120.422 -1.423 . . . . 10.0 113.993 179.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.77 138.98 41.06 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 115.948 1.832 . . . . 10.0 115.948 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -80.16 135.95 36.4 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-O 122.317 1.056 . . . . 10.0 110.579 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -116.12 167.63 10.82 Favored 'General case' 0 C--O 1.248 1.0 0 CA-C-O 118.256 -0.878 . . . . 10.0 110.263 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 19.8 tt0 -137.44 82.63 1.94 Allowed 'General case' 0 C--N 1.317 -0.828 0 O-C-N 125.89 1.994 . . . . 10.0 108.443 -179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -73.18 133.59 44.1 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 116.677 2.103 . . . . 10.0 116.677 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -104.46 -13.8 15.93 Favored 'General case' 0 C--O 1.221 -0.414 0 N-CA-C 106.372 -1.714 . . . . 10.0 106.372 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 61.09 -84.36 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 118.812 -0.613 . . . . 10.0 112.066 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 29.4 m 55.05 60.8 3.24 Favored 'General case' 0 C--N 1.32 -0.704 0 O-C-N 126.169 2.168 . . . . 10.0 108.682 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 172.26 137.47 2.35 Favored Glycine 0 N--CA 1.44 -1.056 0 O-C-N 126.886 2.616 . . . . 10.0 108.123 -179.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 11.3 mt 72.46 -64.91 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 N-CA-C 104.21 -2.515 . . . . 10.0 104.21 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -107.52 -80.05 0.57 Allowed 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 117.017 -1.468 . . . . 10.0 112.186 -179.885 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 21.1 p-10 122.39 28.83 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.699 0 O-C-N 128.203 3.439 . . . . 10.0 117.779 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.95 164.48 13.63 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 123.081 1.419 . . . . 10.0 111.096 179.614 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 38.3 mttt -114.74 179.16 4.03 Favored 'General case' 0 CA--C 1.509 -0.606 0 O-C-N 119.72 -1.862 . . . . 10.0 107.805 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 5.6 p 175.79 170.67 0.37 Allowed 'General case' 0 CA--C 1.503 -0.848 0 CA-C-O 123.288 1.518 . . . . 10.0 110.475 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -117.55 108.72 15.83 Favored 'General case' 0 N--CA 1.443 -0.824 0 N-CA-C 100.692 -3.818 . . . . 10.0 100.692 179.629 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 3.0 m -115.1 150.25 36.26 Favored 'General case' 0 CA--C 1.499 -1.019 0 N-CA-C 118.608 2.818 . . . . 10.0 118.608 -179.348 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 2.8 m -142.5 114.4 8.12 Favored 'General case' 0 CA--C 1.5 -0.967 0 CA-C-N 114.249 -1.341 . . . . 10.0 108.613 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.425 HG11 ' CD2' ' A' ' 64' ' ' PHE . 5.6 t -89.22 136.08 24.37 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 N-CA-C 101.591 -3.485 . . . . 10.0 101.591 -179.797 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 46.9 t -134.48 176.24 8.8 Favored 'General case' 0 N--CA 1.444 -0.728 0 O-C-N 124.989 1.43 . . . . 10.0 109.358 -179.772 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -125.96 92.13 3.53 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 104.495 -2.409 . . . . 10.0 104.495 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -87.52 83.56 7.25 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 100.885 -3.746 . . . . 10.0 100.885 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 62.9 -105.62 1.06 Allowed Glycine 0 C--O 1.237 0.3 0 N-CA-C 106.456 -2.658 . . . . 10.0 106.456 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -114.33 60.62 0.67 Allowed 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 114.123 -1.038 . . . . 10.0 112.133 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 7.3 mtmt -158.83 139.08 12.27 Favored 'General case' 0 C--O 1.24 0.595 0 O-C-N 120.441 -1.412 . . . . 10.0 110.191 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.477 HD12 ' CE1' ' A' ' 4' ' ' PHE . 0.2 OUTLIER -95.47 94.58 7.88 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 105.931 -1.877 . . . . 10.0 105.931 179.91 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -104.03 137.81 41.46 Favored 'General case' 0 CA--C 1.506 -0.741 0 O-C-N 126.215 2.197 . . . . 10.0 110.519 179.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 19.1 m -142.89 129.16 19.89 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 126.655 2.472 . . . . 10.0 113.678 -179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 96.2 t -116.28 122.98 70.91 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 N-CA-C 105.583 -2.006 . . . . 10.0 105.583 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -105.6 107.72 18.87 Favored 'General case' 0 C--O 1.238 0.452 0 O-C-N 125.783 1.927 . . . . 10.0 107.994 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 40.3 tttt -87.22 120.74 28.82 Favored 'General case' 0 C--O 1.221 -0.419 0 C-N-CA 120.088 -0.645 . . . . 10.0 112.453 179.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -143.22 -151.28 5.45 Favored Glycine 0 N--CA 1.447 -0.577 0 CA-C-O 123.252 1.473 . . . . 10.0 110.302 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -81.22 -1.49 45.02 Favored 'General case' 0 C--O 1.243 0.723 0 O-C-N 119.917 -1.931 . . . . 10.0 114.576 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 14.2 mttp -93.37 -166.72 1.57 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 124.599 2.142 . . . . 10.0 113.486 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -132.96 30.97 3.94 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 114.015 -1.448 . . . . 10.0 112.074 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 177.51 33.63 0.05 OUTLIER Glycine 0 N--CA 1.443 -0.861 0 CA-C-O 116.835 -2.092 . . . . 10.0 118.118 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.37 135.86 36.46 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 119.168 1.484 . . . . 10.0 109.304 179.732 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 148.17 148.16 4.69 Favored Glycine 0 N--CA 1.446 -0.686 0 N-CA-C 109.25 -1.54 . . . . 10.0 109.25 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -116.03 -178.67 3.46 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 117.538 0.669 . . . . 10.0 110.057 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.1 m -158.49 126.92 5.35 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 105.068 -2.197 . . . . 10.0 105.068 179.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -110.35 127.97 55.33 Favored 'General case' 0 C--O 1.219 -0.503 0 O-C-N 125.908 2.005 . . . . 10.0 110.306 -179.839 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 1.6 t-105 -135.54 146.39 48.0 Favored 'General case' 0 C--O 1.214 -0.801 0 N-CA-C 107.465 -1.309 . . . . 10.0 107.465 -179.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 17.7 mt -113.81 116.89 53.92 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 N-CA-C 117.662 2.468 . . . . 10.0 117.662 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -81.72 179.17 7.94 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 112.595 -2.093 . . . . 10.0 106.321 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -52.51 99.57 0.04 OUTLIER Glycine 0 C--O 1.221 -0.715 0 N-CA-C 108.375 -1.89 . . . . 10.0 108.375 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 53.75 30.64 11.52 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 123.62 1.676 . . . . 10.0 112.848 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -146.77 109.96 4.76 Favored 'General case' 0 CA--C 1.502 -0.894 0 CA-C-O 124.925 2.297 . . . . 10.0 113.409 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.442 HD12 ' CG ' ' A' ' 130' ' ' PHE . 2.6 tm? -74.92 131.19 40.51 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 104.315 -2.476 . . . . 10.0 104.315 -179.849 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 9.3 t-160 -128.41 91.11 3.18 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 107.725 -1.213 . . . . 10.0 107.725 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 6.5 tt -95.19 142.77 27.24 Favored 'General case' 0 N--CA 1.44 -0.953 0 O-C-N 124.759 1.287 . . . . 10.0 111.498 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 16.2 pm0 -128.56 133.91 48.5 Favored 'General case' 0 C--O 1.216 -0.708 0 N-CA-C 108.011 -1.107 . . . . 10.0 108.011 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 48.1 mtt -112.62 162.02 16.16 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-O 123.366 1.555 . . . . 10.0 108.164 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 2.7 mtm180 -158.65 148.5 19.47 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 113.952 -1.476 . . . . 10.0 109.49 179.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -171.17 122.34 0.56 Allowed 'General case' 0 CA--C 1.504 -0.801 0 O-C-N 123.588 0.555 . . . . 10.0 109.766 179.595 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 61.34 31.6 19.25 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 126.306 1.843 . . . . 10.0 114.486 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 97.9 -15.38 61.77 Favored Glycine 0 CA--C 1.536 1.404 0 CA-C-O 117.032 -1.982 . . . . 10.0 116.792 -179.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 19.8 m -94.73 -179.78 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 CA-C-N 119.171 1.485 . . . . 10.0 111.003 179.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 1.1 m -149.93 133.89 16.99 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 122.19 0.995 . . . . 10.0 113.213 179.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -123.12 142.39 50.93 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 105.126 -2.176 . . . . 10.0 105.126 179.911 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.26 145.86 36.09 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 114.176 1.176 . . . . 10.0 114.176 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.09 109.19 10.29 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 113.951 -1.477 . . . . 10.0 111.984 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 84.8 t -72.27 123.06 26.04 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 N-CA-C 105.142 -2.17 . . . . 10.0 105.142 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . 0.442 ' CG ' HD12 ' A' ' 115' ' ' LEU . 2.7 m-85 -103.25 161.97 13.37 Favored 'General case' 0 C--N 1.316 -0.866 0 C-N-CA 124.685 1.194 . . . . 10.0 108.73 -179.656 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -137.61 102.71 4.83 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 122.449 1.118 . . . . 10.0 108.217 -179.734 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.27 128.22 35.47 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-O 122.155 0.979 . . . . 10.0 110.253 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 1.3 t -101.38 -21.65 5.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 C-N-CA 124.641 1.176 . . . . 10.0 109.486 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 54.7 t60 . . . . . 0 C--O 1.251 1.164 0 O-C-N 124.746 1.279 . . . . 10.0 114.11 -179.985 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . 0.272 72.8 Cg_exo . . . . . 0 C--O 1.237 0.442 0 CA-C-O 123.665 1.444 . . . . 10.0 111.137 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -138.31 41.43 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 114.364 -1.289 . . . . 10.0 110.862 179.702 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -44.12 130.6 6.11 Favored 'General case' 0 C--O 1.24 0.571 0 C-N-CA 124.715 1.206 . . . . 10.0 111.033 -179.785 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -98.19 -20.77 17.09 Favored 'General case' 0 C--O 1.24 0.602 0 N-CA-C 115.687 1.736 . . . . 10.0 115.687 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -56.3 116.77 3.25 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 117.061 -1.447 . . . . 10.0 112.03 -179.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -132.22 -158.78 9.09 Favored Glycine 0 CA--C 1.534 1.227 0 CA-C-O 123.193 1.441 . . . . 10.0 115.681 -179.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -160.57 82.76 0.68 Allowed 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 100.377 -3.934 . . . . 10.0 100.377 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.649 ' CG ' ' N ' ' A' ' 9' ' ' LYS 0.284 0.2 OUTLIER -61.32 -160.09 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 127.106 2.163 . . . . 10.0 111.941 -179.706 . . . . . . . . 4 4 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.649 ' N ' ' CG ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER 153.09 74.4 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.611 0 O-C-N 126.295 2.247 . . . . 10.0 106.174 176.539 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 27.9 ttm -36.26 139.89 0.15 Allowed 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 112.179 -2.282 . . . . 10.0 115.379 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.3 tp -95.09 -38.66 10.52 Favored 'General case' 0 C--N 1.317 -0.832 0 O-C-N 126.708 2.505 . . . . 10.0 106.424 -179.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -178.22 162.0 1.51 Allowed 'General case' 0 C--N 1.345 0.412 0 CA-C-O 123.528 1.632 . . . . 10.0 112.977 179.776 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -121.04 165.79 14.79 Favored 'General case' 0 CA--C 1.51 -0.569 0 CA-C-N 112.651 -2.068 . . . . 10.0 106.326 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -157.91 129.89 6.97 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.823 -0.626 . . . . 10.0 111.046 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 69.73 44.1 0.9 Allowed 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 125.443 1.497 . . . . 10.0 113.469 -179.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.487 ' CE2' HD12 ' A' ' 20' ' ' LEU . 81.2 t80 -76.92 -39.92 49.09 Favored 'General case' 0 CA--C 1.55 0.96 0 O-C-N 125.453 1.721 . . . . 10.0 109.231 179.771 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -71.14 -36.89 72.25 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 114.306 -1.315 . . . . 10.0 112.118 179.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -70.29 -33.18 71.26 Favored 'General case' 0 N--CA 1.442 -0.865 0 O-C-N 125.588 1.805 . . . . 10.0 108.948 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -71.97 -38.22 69.77 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 113.758 -1.565 . . . . 10.0 110.439 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.487 HD12 ' CE2' ' A' ' 16' ' ' PHE . 80.4 mt -71.59 -25.8 62.34 Favored 'General case' 0 C--O 1.213 -0.832 0 O-C-N 121.645 -0.659 . . . . 10.0 110.583 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.26 -29.29 60.12 Favored 'General case' 0 C--O 1.243 0.714 0 CA-C-O 123.143 1.449 . . . . 10.0 107.775 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.36 -28.41 69.74 Favored 'General case' 0 C--O 1.212 -0.872 0 C-N-CA 125.463 1.505 . . . . 10.0 112.722 179.725 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.473 HD23 ' CB ' ' A' ' 121' ' ' ALA . 22.3 mt -104.92 -6.19 20.36 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.631 1.172 . . . . 10.0 111.124 179.839 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 42.9 m-20 48.71 58.97 4.72 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 125.897 1.679 . . . . 10.0 114.177 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 26.2 m -93.39 161.29 2.58 Favored 'Isoleucine or valine' 0 C--O 1.243 0.754 0 N-CA-C 106.555 -1.646 . . . . 10.0 106.555 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -41.59 142.15 0.66 Allowed 'General case' 0 CA--C 1.544 0.745 0 CA-C-O 123.817 1.77 . . . . 10.0 113.452 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 52.9 t -67.07 -26.26 36.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 N-CA-C 115.875 1.805 . . . . 10.0 115.875 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -73.89 -26.9 60.79 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 119.673 -0.811 . . . . 10.0 111.697 179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.8 -44.3 73.86 Favored 'General case' 0 C--N 1.317 -0.813 0 O-C-N 125.774 1.921 . . . . 10.0 114.646 179.743 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.07 -31.28 69.92 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-O 123.864 1.792 . . . . 10.0 112.065 -179.49 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 14.8 mttt -77.3 -33.64 55.65 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 113.465 -1.698 . . . . 10.0 110.86 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.4 mp -77.26 -39.77 28.78 Favored 'Isoleucine or valine' 0 C--O 1.243 0.759 0 CA-C-N 114.922 -1.036 . . . . 10.0 111.032 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -81.5 -19.35 42.44 Favored 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 116.069 1.877 . . . . 10.0 116.069 -179.711 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -76.37 -14.86 60.06 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 122.551 1.167 . . . . 10.0 110.63 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 14.6 mt -83.21 -9.67 59.02 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 123.793 0.837 . . . . 10.0 113.066 -179.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 21.0 mt -116.52 165.38 13.3 Favored 'General case' 0 CA--C 1.507 -0.675 0 CA-C-O 122.588 1.185 . . . . 10.0 109.066 -179.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.53 99.17 8.71 Favored Pre-proline 0 N--CA 1.481 1.099 0 N-CA-C 103.163 -2.902 . . . . 10.0 103.163 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_exo -51.16 -174.95 0.01 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.382 0 C-N-CA 124.693 3.596 . . . . 10.0 115.521 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.541 ' HB2' ' CZ2' ' A' ' 8' ' ' TRP . 0.5 OUTLIER -139.54 -174.77 3.98 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-N 113.096 -1.866 . . . . 10.0 108.222 -179.929 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.7 mttm -173.63 122.79 0.35 Allowed 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 119.109 0.868 . . . . 10.0 111.01 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -121.19 121.0 36.82 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 119.82 1.191 . . . . 10.0 108.424 179.388 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.424 ' CG2' ' HE1' ' A' ' 49' ' ' MET . 2.4 mt -97.07 142.01 14.78 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.923 0 O-C-N 124.861 1.351 . . . . 10.0 111.223 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 56.1 t -147.28 138.14 17.73 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.998 0 N-CA-C 104.964 -2.235 . . . . 10.0 104.964 -179.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -143.29 126.08 16.1 Favored 'General case' 0 C--O 1.211 -0.93 0 N-CA-C 106.058 -1.83 . . . . 10.0 106.058 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -104.24 23.87 12.4 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-O 122.965 1.364 . . . . 10.0 107.568 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 87.83 106.27 0.94 Allowed Glycine 0 C--N 1.336 0.539 0 N-CA-C 110.138 -1.185 . . . . 10.0 110.138 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 57.27 31.58 20.33 Favored 'General case' 0 C--N 1.321 -0.654 0 O-C-N 124.829 0.958 . . . . 10.0 110.088 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -162.36 92.99 0.84 Allowed 'General case' 0 C--O 1.213 -0.818 0 N-CA-C 103.189 -2.893 . . . . 10.0 103.189 179.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.424 ' HE1' ' CG2' ' A' ' 42' ' ' ILE . 4.9 ttm -105.34 142.64 34.74 Favored 'General case' 0 C--N 1.316 -0.875 0 O-C-N 126.389 2.306 . . . . 10.0 116.588 -179.592 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 6.0 mm -128.28 130.91 69.5 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.732 0 N-CA-C 106.273 -1.751 . . . . 10.0 106.273 -179.751 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.406 HD13 ' CG ' ' A' ' 49' ' ' MET . 1.3 mp -121.58 113.61 39.89 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.07 0 O-C-N 126.87 2.607 . . . . 10.0 106.059 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.8 mtp180 -111.61 98.75 7.65 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 113.924 1.083 . . . . 10.0 113.924 -179.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 32.4 m -96.25 89.3 5.06 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 104.736 -2.32 . . . . 10.0 104.736 -179.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.73 44.43 0.01 OUTLIER 'General case' 0 C--N 1.315 -0.905 1 N-CA-C 122.824 4.379 . . . . 10.0 122.824 -179.709 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 36.1 t -64.95 138.56 58.44 Favored 'General case' 0 C--O 1.242 0.695 0 N-CA-C 103.622 -2.733 . . . . 10.0 103.622 -179.735 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 15.9 p -87.39 -37.27 17.21 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 121.389 1.904 . . . . 10.0 108.401 179.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 22.0 t80 -53.46 -35.81 60.92 Favored 'General case' 0 C--O 1.242 0.688 0 O-C-N 125.979 2.049 . . . . 10.0 110.076 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -174.82 90.04 0.06 Allowed 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 115.577 -0.738 . . . . 10.0 112.243 -179.845 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -46.16 144.58 1.91 Allowed 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.61 1.194 . . . . 10.0 113.554 179.775 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -122.72 89.19 3.07 Favored 'General case' 0 CA--C 1.503 -0.859 0 N-CA-C 103.236 -2.876 . . . . 10.0 103.236 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 19.7 mm -90.13 128.38 42.1 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 O-C-N 120.217 -1.552 . . . . 10.0 110.943 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 1.7 mtm -125.65 142.6 51.43 Favored 'General case' 0 C--N 1.341 0.226 0 N-CA-C 105.303 -2.11 . . . . 10.0 105.303 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -140.95 96.56 3.02 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 100.73 -3.804 . . . . 10.0 100.73 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.469 ' CD2' HG21 ' A' ' 86' ' ' VAL . 1.5 m-30 -110.86 167.27 10.36 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 117.623 2.453 . . . . 10.0 117.623 179.772 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -126.68 99.9 5.98 Favored 'General case' 0 C--O 1.241 0.624 0 CA-C-N 111.389 -2.642 . . . . 10.0 104.223 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 33.3 t -43.8 112.4 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 CA-C-N 114.225 -1.352 . . . . 10.0 112.424 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.99 30.9 60.55 Favored Glycine 0 CA--C 1.528 0.901 0 O-C-N 126.63 2.456 . . . . 10.0 115.758 -179.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.6 tmmm? -107.79 2.38 23.56 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 115.783 1.772 . . . . 10.0 115.783 -179.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 59.6 tt0 61.84 138.04 0.01 OUTLIER 'General case' 0 C--N 1.311 -1.074 0 O-C-N 128.354 3.534 . . . . 10.0 113.526 179.505 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 56.4 m-85 -141.26 143.89 34.37 Favored 'General case' 0 C--N 1.319 -0.721 0 O-C-N 121.046 -1.034 . . . . 10.0 110.47 -179.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -109.93 90.33 3.28 Favored 'General case' 0 C--N 1.321 -0.638 0 O-C-N 126.057 2.098 . . . . 10.0 110.23 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -78.89 134.98 36.87 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 113.982 -1.463 . . . . 10.0 114.672 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -129.82 95.23 3.91 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 106.205 -1.776 . . . . 10.0 106.205 179.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -68.56 -167.23 0.09 Allowed 'General case' 0 C--N 1.322 -0.607 0 O-C-N 125.0 1.438 . . . . 10.0 112.718 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -158.61 -70.55 0.09 Allowed 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 107.809 -1.182 . . . . 10.0 107.809 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -92.28 -173.41 41.88 Favored Glycine 0 N--CA 1.434 -1.448 0 O-C-N 126.965 2.666 . . . . 10.0 111.579 -179.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 78.5 mt 75.03 -92.03 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 O-C-N 126.225 1.779 . . . . 10.0 107.704 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -115.7 -48.58 2.76 Favored 'General case' 0 C--N 1.318 -0.775 0 C-N-CA 124.287 1.035 . . . . 10.0 109.967 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.9 128.25 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 118.171 2.656 . . . . 10.0 118.171 179.785 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 6.4 ttm105 -177.81 144.49 0.36 Allowed 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 114.544 -1.207 . . . . 10.0 110.742 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 1.8 mtpp -96.18 148.78 22.35 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 104.327 -2.472 . . . . 10.0 104.327 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 1.8 p -168.23 168.72 11.39 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 107.224 -1.399 . . . . 10.0 107.224 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 7.0 mtt -115.29 92.12 3.82 Favored 'General case' 0 C--O 1.245 0.818 0 N-CA-C 102.051 -3.314 . . . . 10.0 102.051 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.2 m -88.37 115.57 25.96 Favored 'General case' 0 CA--C 1.504 -0.814 0 O-C-N 119.498 -2.001 . . . . 10.0 113.38 179.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 11.2 m -119.8 111.35 17.88 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-N 114.594 -1.184 . . . . 10.0 108.857 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.469 HG21 ' CD2' ' A' ' 64' ' ' PHE . 1.3 t -84.79 119.86 34.36 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 N-CA-C 101.296 -3.594 . . . . 10.0 101.296 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.4 p -145.03 141.93 29.32 Favored 'General case' 0 C--O 1.217 -0.621 0 CA-C-O 124.407 2.051 . . . . 10.0 114.82 -179.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -72.39 137.96 46.89 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 113.368 -1.742 . . . . 10.0 109.488 179.339 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -97.94 8.94 43.93 Favored 'General case' 0 CA--C 1.506 -0.716 0 N-CA-C 103.401 -2.815 . . . . 10.0 103.401 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 129.66 -29.8 3.72 Favored Glycine 0 CA--C 1.497 -1.062 0 N-CA-C 103.392 -3.883 . . . . 10.0 103.392 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -157.6 -51.28 0.07 Allowed 'General case' 0 C--O 1.24 0.563 0 CA-C-N 118.011 0.906 . . . . 10.0 109.857 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -61.39 160.92 10.04 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-O 117.396 -1.288 . . . . 10.0 110.442 -179.915 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 49.0 tp -104.26 116.06 31.51 Favored 'General case' 0 N--CA 1.442 -0.851 0 N-CA-C 104.757 -2.312 . . . . 10.0 104.757 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . 0.439 ' N ' HE21 ' A' ' 94' ' ' GLN . 0.0 OUTLIER -124.45 142.52 51.25 Favored 'General case' 0 CA--C 1.501 -0.942 0 N-CA-C 115.799 1.777 . . . . 10.0 115.799 -179.753 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -134.81 157.69 46.12 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 116.851 -1.547 . . . . 10.0 107.653 179.849 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 8.3 t -130.56 -67.1 0.58 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.755 0 C-N-CA 118.329 -1.348 . . . . 10.0 110.924 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 72.86 116.18 0.05 Allowed 'General case' 0 C--O 1.245 0.849 0 N-CA-C 105.506 -2.035 . . . . 10.0 105.506 -179.504 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.412 ' HA ' ' NH2' ' A' ' 104' ' ' ARG . 5.2 ptpp? -107.47 170.74 7.79 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 114.88 1.437 . . . . 10.0 114.88 -179.527 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 176.86 -124.14 0.94 Allowed Glycine 0 N--CA 1.447 -0.568 0 O-C-N 124.723 1.264 . . . . 10.0 110.653 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -130.31 22.07 5.21 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 114.977 1.473 . . . . 10.0 114.977 179.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -110.7 177.2 4.75 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 116.084 1.883 . . . . 10.0 116.084 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -90.9 120.6 32.05 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 128.625 2.77 . . . . 10.0 108.959 179.651 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 86.49 -97.49 2.24 Favored Glycine 0 C--O 1.22 -0.72 0 O-C-N 119.808 -1.807 . . . . 10.0 115.214 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.412 ' NH2' ' HA ' ' A' ' 98' ' ' LYS . 21.3 mtm-85 59.82 165.76 0.06 Allowed 'General case' 0 N--CA 1.441 -0.876 0 N-CA-C 114.896 1.443 . . . . 10.0 114.896 -179.699 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 74.43 166.52 15.59 Favored Glycine 0 N--CA 1.444 -0.792 0 CA-C-N 112.036 -2.347 . . . . 10.0 112.903 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -112.46 -173.81 2.33 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 124.565 1.146 . . . . 10.0 109.757 -179.793 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' THR . . . . . 0.404 ' HB ' ' CG ' ' A' ' 118' ' ' GLU . 55.9 m -162.35 123.34 2.57 Favored 'General case' 0 C--O 1.214 -0.814 0 CA-C-O 118.304 -0.855 . . . . 10.0 110.259 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 10.0 mt-30 -120.17 124.9 46.87 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 118.258 -0.877 . . . . 10.0 112.462 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -134.15 164.64 26.9 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 106.519 -1.66 . . . . 10.0 106.519 179.704 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 37.5 mt -129.28 136.21 59.99 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 N-CA-C 116.282 1.956 . . . . 10.0 116.282 -179.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -109.24 -162.17 0.8 Allowed 'General case' 0 CA--C 1.522 -0.117 0 C-N-CA 125.869 1.668 . . . . 10.0 107.356 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -77.48 103.11 1.8 Allowed Glycine 0 CA--C 1.528 0.868 0 O-C-N 125.741 1.901 . . . . 10.0 108.833 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 9.6 t70 50.07 17.41 0.3 Allowed 'General case' 0 C--N 1.324 -0.504 0 O-C-N 127.151 2.324 . . . . 10.0 111.812 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -137.28 88.8 2.38 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 120.5 1.5 . . . . 10.0 110.716 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.418 HD12 ' N ' ' A' ' 116' ' ' HIS . 0.9 OUTLIER -60.48 134.06 56.7 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 105.198 -2.149 . . . . 10.0 105.198 -179.946 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . 0.418 ' N ' HD12 ' A' ' 115' ' ' LEU . 3.6 t60 -119.2 99.05 6.47 Favored 'General case' 0 C--O 1.213 -0.859 0 O-C-N 118.96 -2.337 . . . . 10.0 109.156 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.417 ' HG ' ' N ' ' A' ' 118' ' ' GLU . 0.2 OUTLIER -96.29 149.15 21.99 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 114.449 -1.25 . . . . 10.0 111.197 -179.887 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.417 ' N ' ' HG ' ' A' ' 117' ' ' LEU . 16.6 pt-20 -146.01 128.56 16.05 Favored 'General case' 0 CA--C 1.505 -0.757 0 O-C-N 125.205 1.566 . . . . 10.0 108.621 179.716 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -113.51 125.73 54.53 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 114.117 -1.402 . . . . 10.0 108.026 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.425 ' HD3' ' N ' ' A' ' 120' ' ' ARG . 0.0 OUTLIER -121.43 160.8 23.38 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-O 125.584 2.611 . . . . 10.0 115.534 -179.943 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . 0.473 ' CB ' HD23 ' A' ' 23' ' ' LEU . . . -179.03 137.49 0.14 Allowed 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 112.698 -2.046 . . . . 10.0 110.579 179.798 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 46.85 31.54 1.5 Allowed 'General case' 0 C--O 1.246 0.896 0 CA-C-N 113.596 -1.638 . . . . 10.0 114.5 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 93.61 -15.38 63.17 Favored Glycine 0 N--CA 1.444 -0.78 0 C-N-CA 124.36 0.981 . . . . 10.0 115.533 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 3.0 t -94.04 131.32 41.27 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 CA-C-N 119.589 1.695 . . . . 10.0 109.983 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 36.4 m -115.43 118.84 34.34 Favored 'General case' 0 N--CA 1.445 -0.709 0 O-C-N 125.991 2.057 . . . . 10.0 113.21 179.457 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -99.58 155.02 17.81 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 105.195 -2.15 . . . . 10.0 105.195 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 25.0 mtmt -145.54 159.29 43.32 Favored 'General case' 0 CA--C 1.507 -0.677 0 O-C-N 120.999 -1.063 . . . . 10.0 110.88 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -140.19 125.36 18.68 Favored 'General case' 0 C--N 1.321 -0.636 0 O-C-N 125.45 1.719 . . . . 10.0 108.235 -179.67 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 2.5 t -85.66 108.31 17.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 N-CA-C 105.873 -1.899 . . . . 10.0 105.873 179.561 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . 0.409 ' HB2' ' HB3' ' A' ' 115' ' ' LEU . 3.9 m-85 -86.06 151.98 23.26 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 115.631 -0.713 . . . . 10.0 110.781 -179.741 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 17.6 tptt -130.31 85.72 2.32 Favored 'General case' 0 C--N 1.321 -0.651 0 O-C-N 126.854 2.596 . . . . 10.0 108.991 -179.768 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.47 104.54 0.13 Allowed 'General case' 0 C--O 1.235 0.341 0 O-C-N 125.723 1.889 . . . . 10.0 109.837 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 1.4 p -73.88 -24.67 19.76 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.492 0 C-N-CA 118.593 -1.243 . . . . 10.0 110.662 179.599 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 35.1 t-80 . . . . . 0 N--CA 1.441 -0.913 0 CA-C-O 115.871 -2.014 . . . . 10.0 110.814 -179.853 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo . . . . . 0 N--CA 1.485 0.986 0 CA-C-O 122.851 1.105 . . . . 10.0 113.769 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -137.26 169.49 19.41 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 O-C-N 119.46 -2.025 . . . . 10.0 109.773 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.06 -73.01 0.15 Allowed 'General case' 0 N--CA 1.443 -0.793 0 N-CA-C 112.742 0.645 . . . . 10.0 112.742 -179.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 62.8 -73.2 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 O-C-N 125.469 1.73 . . . . 10.0 111.99 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -35.32 111.17 0.12 Allowed 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.457 1.503 . . . . 10.0 113.04 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -157.23 -140.7 3.0 Favored Glycine 0 N--CA 1.445 -0.7 0 C-N-CA 118.861 -1.638 . . . . 10.0 114.069 179.56 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 93.1 m-85 -160.36 65.8 0.33 Allowed 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 104.499 -2.408 . . . . 10.0 104.499 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.589 ' CD2' ' CD1' ' A' ' 115' ' ' LEU . 8.5 m0 -68.03 105.95 2.2 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 118.34 -1.344 . . . . 10.0 108.464 179.715 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.5 pttp -81.93 12.27 4.25 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 117.196 -1.383 . . . . 10.0 110.666 -179.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.415 ' HG2' ' N ' ' A' ' 11' ' ' LEU . 0.0 OUTLIER 62.94 140.26 0.02 OUTLIER 'General case' 0 C--N 1.311 -1.084 0 CA-C-O 124.199 1.952 . . . . 10.0 116.15 179.58 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.415 ' N ' ' HG2' ' A' ' 10' ' ' MET . 4.1 tt -108.83 -50.15 3.05 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 120.306 -1.496 . . . . 10.0 108.967 -179.847 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -174.15 157.6 2.87 Favored 'General case' 0 C--O 1.241 0.632 0 C-N-CA 119.544 -0.863 . . . . 10.0 112.773 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -116.2 161.0 19.61 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 127.205 2.202 . . . . 10.0 107.402 -179.711 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 -123.39 -89.39 0.59 Allowed 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 114.218 1.192 . . . . 10.0 114.218 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -80.61 46.82 0.89 Allowed 'General case' 0 N--CA 1.469 0.512 0 O-C-N 124.572 1.17 . . . . 10.0 113.271 -179.701 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -66.36 -36.76 83.69 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 113.85 1.056 . . . . 10.0 113.85 179.555 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -76.55 -32.93 58.5 Favored 'General case' 0 CA--C 1.515 -0.397 0 O-C-N 118.783 -2.448 . . . . 10.0 111.423 179.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -79.61 -24.74 41.76 Favored 'General case' 0 C--O 1.219 -0.502 0 N-CA-C 107.165 -1.421 . . . . 10.0 107.165 179.796 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 42.4 t80 -68.16 -41.12 82.0 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-O 117.44 -1.267 . . . . 10.0 110.848 -179.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 84.5 mt -78.35 -21.89 48.8 Favored 'General case' 0 C--O 1.214 -0.769 0 CA-C-O 123.69 1.71 . . . . 10.0 112.747 -179.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.25 -42.61 88.31 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 113.66 -1.609 . . . . 10.0 108.415 -179.774 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.57 -21.54 65.43 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 126.17 1.788 . . . . 10.0 110.795 -179.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 35.3 mt -95.78 -9.55 31.39 Favored 'General case' 0 C--O 1.241 0.622 0 C-N-CA 124.746 1.218 . . . . 10.0 108.981 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 62.59 38.57 12.21 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-O 116.697 -1.62 . . . . 10.0 112.086 179.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.432 HG13 ' CD2' ' A' ' 29' ' ' LEU . 2.1 t -91.18 154.33 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.82 0 N-CA-C 107.421 -1.326 . . . . 10.0 107.421 179.547 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.26 0.0 OUTLIER -58.08 163.17 2.96 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 127.071 2.732 . . . . 10.0 116.948 -179.687 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 68.9 t -71.97 -26.32 25.21 Favored 'Isoleucine or valine' 0 C--O 1.236 0.372 0 N-CA-C 113.964 1.098 . . . . 10.0 113.964 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.88 -38.16 76.29 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 123.615 0.766 . . . . 10.0 111.105 179.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.432 ' CD2' HG13 ' A' ' 25' ' ' VAL . 8.1 tt -79.32 -24.17 42.98 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 122.373 1.082 . . . . 10.0 108.562 179.448 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -78.78 -41.92 29.27 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 114.837 -1.074 . . . . 10.0 108.881 179.787 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.4 tttt -63.76 -48.31 77.49 Favored 'General case' 0 N--CA 1.442 -0.865 0 C-N-CA 125.135 1.374 . . . . 10.0 113.504 -179.524 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 11.8 mm -72.37 -38.06 59.85 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.575 0 O-C-N 119.707 -1.871 . . . . 10.0 113.783 -179.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -68.15 -37.52 81.14 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 115.835 1.791 . . . . 10.0 115.835 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -57.98 -31.38 66.86 Favored 'General case' 0 C--O 1.216 -0.71 0 N-CA-C 115.075 1.509 . . . . 10.0 115.075 -179.806 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 40.4 mt -81.31 -25.32 36.56 Favored 'General case' 0 C--O 1.217 -0.647 0 CA-C-O 122.172 0.987 . . . . 10.0 113.553 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 11.6 mt -96.58 157.79 15.74 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.572 -0.74 . . . . 10.0 112.866 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 30.1 mttm -145.74 146.02 27.58 Favored Pre-proline 0 N--CA 1.48 1.039 0 N-CA-C 102.422 -3.177 . . . . 10.0 102.422 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 0.1 OUTLIER -100.46 -172.24 0.11 Allowed 'Trans proline' 0 CA--C 1.543 0.952 0 C-N-CA 122.636 2.224 . . . . 10.0 117.427 -179.785 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -142.96 136.69 28.78 Favored 'General case' 0 C--N 1.315 -0.921 0 O-C-N 127.54 3.025 . . . . 10.0 104.329 179.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.523 ' HB2' ' CE2' ' A' ' 130' ' ' PHE . 0.1 OUTLIER -119.58 112.13 18.95 Favored 'General case' 0 N--CA 1.438 -1.051 0 C-N-CA 119.417 -0.913 . . . . 10.0 112.503 -179.933 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -105.4 132.04 52.08 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 102.162 -3.273 . . . . 10.0 102.162 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.496 HG13 ' CH2' ' A' ' 8' ' ' TRP . 0.9 OUTLIER -115.01 161.97 13.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 118.554 0.616 . . . . 10.0 110.274 -179.918 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.6 t -144.5 123.17 6.33 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.854 0 N-CA-C 105.412 -2.07 . . . . 10.0 105.412 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -119.9 104.2 9.98 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 122.739 1.257 . . . . 10.0 111.584 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -99.69 86.16 3.27 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 104.498 -2.408 . . . . 10.0 104.498 -179.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 70.03 -112.41 4.37 Favored Glycine 0 C--N 1.34 0.803 0 N-CA-C 106.684 -2.566 . . . . 10.0 106.684 -179.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -107.17 -12.35 15.41 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 119.811 -0.756 . . . . 10.0 110.154 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 13.2 m170 -74.42 109.48 7.93 Favored 'General case' 0 N--CA 1.445 -0.723 0 O-C-N 120.88 -1.137 . . . . 10.0 109.043 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.403 ' N ' ' O ' ' A' ' 64' ' ' PHE . 2.8 ttt -87.84 140.02 29.93 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 114.395 1.257 . . . . 10.0 114.395 -179.876 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 6.9 mt -134.99 110.8 12.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 N-CA-C 102.913 -2.995 . . . . 10.0 102.913 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -100.69 132.96 45.37 Favored 'Isoleucine or valine' 0 C--O 1.241 0.612 0 N-CA-C 106.472 -1.677 . . . . 10.0 106.472 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.16 88.44 2.42 Favored 'General case' 0 N--CA 1.438 -1.025 0 O-C-N 125.377 1.673 . . . . 10.0 110.426 179.695 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 24.3 m -80.2 112.75 17.82 Favored 'General case' 0 C--N 1.318 -0.78 1 N-CA-C 99.913 -4.106 . . . . 10.0 99.913 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.1 mt -78.85 61.91 3.2 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 117.317 2.34 . . . . 10.0 117.317 -179.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.7 m -90.61 84.6 5.93 Favored 'General case' 0 C--O 1.242 0.698 0 CA-C-N 112.143 -2.299 . . . . 10.0 106.044 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -66.36 111.03 3.31 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 106.248 -1.76 . . . . 10.0 106.248 179.814 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 68.8 t80 153.89 -62.34 0.0 OUTLIER 'General case' 0 C--O 1.241 0.646 0 O-C-N 128.06 3.35 . . . . 10.0 105.14 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.407 ' HA ' ' NE ' ' A' ' 58' ' ' ARG . 10.2 tpp180 -152.52 75.52 1.11 Allowed 'General case' 0 N--CA 1.444 -0.727 0 O-C-N 125.195 1.559 . . . . 10.0 110.072 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -63.13 177.84 0.56 Allowed 'General case' 0 CA--C 1.541 0.606 0 O-C-N 126.162 2.163 . . . . 10.0 114.053 -179.759 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 49.6 m-85 -102.25 -132.76 0.29 Allowed 'General case' 0 C--N 1.308 -1.196 0 O-C-N 128.613 3.696 . . . . 10.0 101.24 179.349 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 6.7 mt 108.56 122.33 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.3 -1.561 0 O-C-N 128.48 3.612 . . . . 10.0 111.306 179.548 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 4.6 mmt -150.69 170.07 20.09 Favored 'General case' 0 CA--C 1.532 0.275 0 O-C-N 127.555 3.034 . . . . 10.0 104.376 -179.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -134.62 63.85 1.61 Allowed 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 101.459 -3.534 . . . . 10.0 101.459 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.403 ' O ' ' N ' ' A' ' 49' ' ' MET . 1.5 m-30 -65.11 165.68 10.82 Favored 'General case' 0 C--N 1.342 0.256 0 N-CA-C 116.908 2.188 . . . . 10.0 116.908 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 63.3 mt-30 -136.06 125.01 24.18 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 106.208 -1.775 . . . . 10.0 106.208 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.452 ' HA ' ' CG1' ' A' ' 86' ' ' VAL . 0.9 OUTLIER -69.41 134.9 29.38 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 CA-C-O 123.092 1.425 . . . . 10.0 112.291 -179.644 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.58 -16.33 41.16 Favored Glycine 0 N--CA 1.439 -1.135 0 O-C-N 120.002 -1.686 . . . . 10.0 114.307 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 4.1 mttp -91.42 132.33 36.29 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 122.433 1.111 . . . . 10.0 111.815 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -74.55 125.26 28.24 Favored 'General case' 0 CA--C 1.53 0.179 0 O-C-N 120.977 -1.077 . . . . 10.0 109.689 -179.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -121.0 -167.11 1.43 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.187 -0.46 . . . . 10.0 110.83 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -156.75 116.41 3.49 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-O 121.877 0.846 . . . . 10.0 109.408 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -79.01 108.37 12.45 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 118.146 -1.421 . . . . 10.0 114.446 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -61.37 -29.7 70.07 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 124.889 1.368 . . . . 10.0 111.404 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 68.43 -78.38 0.04 OUTLIER 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 116.022 1.86 . . . . 10.0 116.022 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 1.7 m 15.68 82.65 0.01 OUTLIER 'General case' 0 C--N 1.313 -0.993 1 O-C-N 129.704 4.377 . . . . 10.0 111.601 -179.649 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 179.78 -57.38 0.08 OUTLIER Glycine 0 N--CA 1.438 -1.204 0 CA-C-O 117.122 -1.932 . . . . 10.0 110.37 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.1 mt -118.34 106.4 19.61 Favored 'Isoleucine or valine' 0 C--O 1.242 0.683 0 N-CA-C 104.135 -2.543 . . . . 10.0 104.135 -179.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 82.33 -51.08 0.21 Allowed 'General case' 0 CA--C 1.54 0.573 0 O-C-N 125.734 1.896 . . . . 10.0 112.293 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 74.55 102.43 0.07 Allowed 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 116.09 1.885 . . . . 10.0 116.09 179.857 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 18.0 ttp85 -163.64 121.93 1.92 Allowed 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 122.159 0.98 . . . . 10.0 109.818 179.739 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.16 152.39 30.75 Favored 'General case' 0 CA--C 1.508 -0.665 0 N-CA-C 103.424 -2.806 . . . . 10.0 103.424 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 2.8 m -143.17 -168.55 2.83 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 124.145 0.978 . . . . 10.0 108.593 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 9.1 mmm -133.14 97.56 4.03 Favored 'General case' 0 C--N 1.315 -0.9 1 N-CA-C 98.333 -4.691 . . . . 10.0 98.333 179.674 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.2 m -108.93 131.71 54.77 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 116.937 2.199 . . . . 10.0 116.937 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 3.2 m -123.85 131.49 53.59 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 104.76 -2.311 . . . . 10.0 104.76 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.452 ' CG1' ' HA ' ' A' ' 66' ' ' VAL . 0.3 OUTLIER -98.86 150.35 5.03 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.999 0 N-CA-C 101.379 -3.563 . . . . 10.0 101.379 179.778 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.3 m -157.4 160.23 38.18 Favored 'General case' 0 C--N 1.319 -0.75 0 O-C-N 125.564 1.79 . . . . 10.0 114.798 -179.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 7.6 p90 -118.3 136.23 53.82 Favored 'General case' 0 N--CA 1.465 0.311 0 O-C-N 124.083 0.864 . . . . 10.0 109.097 -179.69 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -101.33 -57.9 1.99 Allowed 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 103.075 -2.935 . . . . 10.0 103.075 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -155.3 -120.84 0.72 Allowed Glycine 0 N--CA 1.434 -1.441 0 N-CA-C 105.18 -3.168 . . . . 10.0 105.18 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -70.42 -18.37 63.01 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 118.971 1.386 . . . . 10.0 110.565 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 9.0 mtmt -88.41 -174.36 4.57 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 106.796 -1.557 . . . . 10.0 106.796 -179.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -151.18 124.83 9.03 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 104.698 -2.334 . . . . 10.0 104.698 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 8.9 mm-40 -111.52 160.68 16.93 Favored 'General case' 0 CA--C 1.502 -0.872 0 CA-C-N 113.51 -1.677 . . . . 10.0 113.914 -179.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 4.2 t -140.78 135.45 31.5 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 118.29 -0.862 . . . . 10.0 109.453 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 44.3 t -119.92 91.34 1.8 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.74 0 O-C-N 126.941 2.651 . . . . 10.0 106.919 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -91.94 72.24 5.61 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 123.901 1.81 . . . . 10.0 112.306 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 31.1 tttp -71.82 90.96 1.12 Allowed 'General case' 0 C--O 1.225 -0.23 0 O-C-N 120.194 -1.566 . . . . 10.0 109.409 179.588 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -139.83 82.17 0.25 Allowed Glycine 0 C--O 1.226 -0.396 0 N-CA-C 108.258 -1.937 . . . . 10.0 108.258 -179.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 59.12 178.36 0.08 Allowed 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 114.791 1.404 . . . . 10.0 114.791 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 37.5 mttt 55.26 175.24 0.03 OUTLIER 'General case' 0 C--O 1.24 0.563 0 N-CA-C 116.241 1.941 . . . . 10.0 116.241 179.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -107.12 116.65 32.29 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 126.383 1.873 . . . . 10.0 108.493 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 90.32 66.48 1.2 Allowed Glycine 0 C--O 1.224 -0.495 0 N-CA-C 116.22 1.248 . . . . 10.0 116.22 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.78 136.43 48.71 Favored 'General case' 0 N--CA 1.444 -0.749 0 O-C-N 124.356 0.68 . . . . 10.0 111.489 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 143.66 163.31 9.8 Favored Glycine 0 N--CA 1.441 -0.972 0 O-C-N 126.411 2.32 . . . . 10.0 108.636 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 32.0 m0 -119.81 174.37 6.48 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 119.053 1.426 . . . . 10.0 112.43 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 16.0 m -151.64 128.33 10.84 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 109.561 -0.533 . . . . 10.0 109.561 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 59.8 mm-40 -106.44 156.6 18.37 Favored 'General case' 0 C--N 1.319 -0.729 0 O-C-N 125.95 2.031 . . . . 10.0 111.346 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 1.5 t90 -171.98 119.3 0.42 Allowed 'General case' 0 N--CA 1.478 0.953 0 CA-C-O 123.297 1.523 . . . . 10.0 106.978 -179.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 60.6 mt -98.7 152.06 4.43 Favored 'Isoleucine or valine' 0 C--O 1.241 0.647 0 N-CA-C 117.367 2.358 . . . . 10.0 117.367 -179.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -130.15 -168.67 2.0 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 103.391 -2.818 . . . . 10.0 103.391 -179.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -68.0 -59.15 6.67 Favored Glycine 0 N--CA 1.469 0.856 0 O-C-N 120.678 -1.264 . . . . 10.0 110.035 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -117.8 9.63 13.01 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 119.655 1.727 . . . . 10.0 113.292 179.719 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -128.53 -159.75 0.97 Allowed 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 115.618 1.71 . . . . 10.0 115.618 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.589 ' CD1' ' CD2' ' A' ' 8' ' ' TRP . 0.4 OUTLIER -171.86 134.53 0.79 Allowed 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 106.451 -1.685 . . . . 10.0 106.451 179.904 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -117.38 86.64 2.55 Favored 'General case' 0 C--O 1.236 0.372 0 O-C-N 125.044 1.465 . . . . 10.0 109.41 -179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 1.5 tp -95.26 148.0 22.87 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.059 -1.089 . . . . 10.0 108.059 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -127.12 157.22 40.27 Favored 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 106.924 -1.51 . . . . 10.0 106.924 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 18.9 mtm -142.68 114.42 8.07 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 123.715 1.721 . . . . 10.0 108.694 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 5.9 ttp180 -104.64 129.8 52.74 Favored 'General case' 0 CA--C 1.506 -0.734 0 CA-C-O 122.37 1.081 . . . . 10.0 112.9 179.405 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -148.39 118.87 7.4 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 114.423 -1.262 . . . . 10.0 107.799 -179.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 37.68 47.45 0.82 Allowed 'General case' 0 C--O 1.243 0.76 0 O-C-N 126.626 2.454 . . . . 10.0 117.344 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 91.06 -4.26 81.15 Favored Glycine 0 C--N 1.337 0.585 0 C-N-CA 119.022 -1.561 . . . . 10.0 114.011 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -96.95 151.62 4.11 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.514 0 N-CA-C 107.624 -1.25 . . . . 10.0 107.624 179.695 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 2.9 m -134.66 102.54 5.32 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 113.954 -1.475 . . . . 10.0 111.875 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -115.1 134.41 55.19 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 105.844 -1.91 . . . . 10.0 105.844 179.892 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 14.0 mtmm -127.3 125.13 40.31 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 115.444 1.646 . . . . 10.0 115.444 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 1.2 mm100 -99.21 113.52 25.83 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-N 114.389 -1.278 . . . . 10.0 109.697 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 8.0 t -96.74 127.25 49.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 N-CA-C 104.666 -2.346 . . . . 10.0 104.666 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . 0.523 ' CE2' ' HB2' ' A' ' 40' ' ' LYS . 8.1 m-30 -110.25 144.67 38.59 Favored 'General case' 0 N--CA 1.441 -0.891 0 C-N-CA 124.188 0.995 . . . . 10.0 112.678 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 6.3 tptm -127.72 92.4 3.48 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 105.765 -1.939 . . . . 10.0 105.765 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 11.0 ptpt -53.38 129.85 33.33 Favored 'General case' 0 CA--C 1.503 -0.83 0 CA-C-O 125.736 2.684 . . . . 10.0 111.259 -179.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -83.7 -3.0 7.27 Favored 'Isoleucine or valine' 0 C--O 1.236 0.342 0 O-C-N 120.041 -1.662 . . . . 10.0 111.69 -179.92 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . 0.407 ' CD2' ' C ' ' A' ' 134' ' ' HIS . 4.5 t60 . . . . . 0 C--N 1.314 -0.937 0 O-C-N 125.47 1.731 . . . . 10.0 110.684 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo . . . . . 0 N--CA 1.482 0.81 0 CA-C-O 117.03 -1.321 . . . . 10.0 112.307 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 5.2 p 23.97 59.64 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 O-C-N 127.828 3.205 . . . . 10.0 113.503 -179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 43.1 p-10 -117.85 55.66 0.87 Allowed 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 124.26 1.981 . . . . 10.0 109.286 -179.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 41.9 m-85 -54.05 -13.51 0.82 Allowed 'General case' 0 C--O 1.242 0.662 0 CA-C-O 116.616 -1.659 . . . . 10.0 114.568 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -53.92 131.32 39.92 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-O 124.34 2.019 . . . . 10.0 113.793 179.623 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 155.14 165.0 13.58 Favored Glycine 0 CA--C 1.528 0.902 0 O-C-N 119.778 -1.826 . . . . 10.0 114.002 179.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . 0.475 ' N ' ' CD1' ' A' ' 7' ' ' TYR . 1.9 m-30 -104.73 121.78 44.31 Favored 'General case' 0 C--O 1.243 0.755 0 CA-C-O 116.565 -1.683 . . . . 10.0 106.756 179.61 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.651 ' CE2' ' HB2' ' A' ' 40' ' ' LYS . 1.1 p-90 -113.59 145.88 40.58 Favored 'General case' 0 N--CA 1.44 -0.955 0 CA-C-O 123.37 1.557 . . . . 10.0 115.042 179.601 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.5 ptpp? -121.85 120.0 33.24 Favored 'General case' 0 N--CA 1.437 -1.097 0 N-CA-C 105.16 -2.163 . . . . 10.0 105.16 -179.422 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.506 ' HB3' ' CZ3' ' A' ' 8' ' ' TRP . 6.7 ptm -68.66 142.14 55.16 Favored 'General case' 0 CA--C 1.506 -0.727 0 O-C-N 118.834 -2.416 . . . . 10.0 115.697 -179.596 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 12.1 tp -97.75 -33.88 11.11 Favored 'General case' 0 CA--C 1.508 -0.652 0 O-C-N 120.303 -1.498 . . . . 10.0 109.609 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -152.57 152.08 31.42 Favored 'General case' 0 CA--C 1.515 -0.399 0 N-CA-C 115.388 1.625 . . . . 10.0 115.388 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -134.9 132.6 38.7 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 106.807 -1.553 . . . . 10.0 106.807 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -132.29 162.59 30.63 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 119.249 0.931 . . . . 10.0 113.023 179.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 2.7 m120 37.65 25.81 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.472 0 O-C-N 126.918 2.636 . . . . 10.0 116.851 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -65.35 -31.99 73.4 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 118.862 -2.399 . . . . 10.0 114.218 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -65.77 -41.82 91.59 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 115.437 1.643 . . . . 10.0 115.437 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -79.82 -22.08 43.46 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 107.007 -1.479 . . . . 10.0 107.007 179.666 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.411 ' CZ ' HD12 ' A' ' 23' ' ' LEU . 2.9 t80 -66.84 -36.94 83.49 Favored 'General case' 0 CA--C 1.55 0.958 0 O-C-N 121.023 -1.048 . . . . 10.0 111.137 -179.582 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 20.5 mt -71.69 -39.18 70.38 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 125.356 1.462 . . . . 10.0 111.015 179.82 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 22.4 ttp180 -71.84 -28.18 63.38 Favored 'General case' 0 C--O 1.244 0.806 0 O-C-N 124.859 1.349 . . . . 10.0 110.704 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.36 -42.97 95.94 Favored 'General case' 0 C--O 1.212 -0.873 0 C-N-CA 124.266 1.026 . . . . 10.0 113.652 -179.814 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.411 HD12 ' CZ ' ' A' ' 19' ' ' TYR . 0.3 OUTLIER -91.84 -22.97 19.83 Favored 'General case' 0 C--N 1.345 0.374 0 CA-C-O 122.216 1.008 . . . . 10.0 113.461 -179.966 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.6 t0 66.29 70.55 0.41 Allowed 'General case' 0 N--CA 1.481 1.078 0 O-C-N 119.644 -1.91 . . . . 10.0 112.173 179.423 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -93.34 -51.35 11.31 Favored 'Isoleucine or valine' 0 C--O 1.242 0.675 0 N-CA-C 106.337 -1.727 . . . . 10.0 106.337 -179.822 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 177.92 152.26 0.27 Allowed 'General case' 0 C--O 1.243 0.749 0 N-CA-C 116.788 2.144 . . . . 10.0 116.788 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.41 ' CG1' ' N ' ' A' ' 28' ' ' ALA . 0.3 OUTLIER -74.53 -37.76 44.62 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 C-N-CA 125.464 1.505 . . . . 10.0 113.75 -179.601 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.41 ' N ' ' CG1' ' A' ' 27' ' ' VAL . . . -76.4 -31.79 58.16 Favored 'General case' 0 C--N 1.319 -0.729 0 O-C-N 126.147 2.154 . . . . 10.0 112.959 179.896 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.1 tp -68.28 -29.57 68.39 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.9 0.704 . . . . 10.0 112.9 179.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.41 -30.5 70.28 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 113.307 0.855 . . . . 10.0 113.307 -179.803 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.62 -37.89 41.12 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 113.242 -1.799 . . . . 10.0 110.289 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 48.1 mt -77.37 -48.38 24.63 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 O-C-N 119.746 -1.846 . . . . 10.0 112.821 -179.387 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -55.8 -33.91 64.84 Favored 'General case' 0 C--O 1.216 -0.692 0 CA-C-O 117.699 -1.143 . . . . 10.0 113.799 179.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -69.39 -9.57 54.11 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 115.078 1.51 . . . . 10.0 115.078 179.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.5 mt -104.57 14.17 30.39 Favored 'General case' 0 C--N 1.315 -0.907 0 O-C-N 124.973 1.421 . . . . 10.0 111.188 179.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -128.85 147.76 50.84 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.095 0.958 . . . . 10.0 110.572 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 4.6 mttt -129.88 73.35 81.51 Favored Pre-proline 0 C--O 1.218 -0.562 0 N-CA-C 106.27 -1.752 . . . . 10.0 106.27 -179.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 9.0 Cg_endo -52.93 128.52 29.15 Favored 'Trans proline' 0 N--CA 1.451 -1.004 0 O-C-N 125.418 2.272 . . . . 10.0 116.104 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -106.48 142.53 35.99 Favored 'General case' 0 C--N 1.316 -0.854 0 O-C-N 128.458 3.599 . . . . 10.0 104.724 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.651 ' HB2' ' CE2' ' A' ' 8' ' ' TRP . 1.4 ttmt -112.6 177.79 4.51 Favored 'General case' 0 C--O 1.21 -0.991 0 O-C-N 124.796 1.31 . . . . 10.0 112.262 -179.601 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -158.26 120.7 3.71 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 104.887 -2.264 . . . . 10.0 104.887 -179.479 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 19.0 mm -103.14 152.6 5.89 Favored 'Isoleucine or valine' 0 C--O 1.242 0.69 0 O-C-N 125.555 1.785 . . . . 10.0 112.622 179.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 62.4 t -154.25 98.72 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 CA-C-N 113.369 -1.741 . . . . 10.0 108.538 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -98.61 118.61 35.7 Favored 'General case' 0 C--N 1.311 -1.068 0 C-N-CA 125.056 1.342 . . . . 10.0 107.532 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -93.58 18.76 9.46 Favored 'General case' 0 C--O 1.24 0.587 0 CA-C-O 117.429 -1.272 . . . . 10.0 108.032 -179.82 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 113.77 -100.28 1.04 Allowed Glycine 0 CA--C 1.523 0.536 0 N-CA-C 107.634 -2.187 . . . . 10.0 107.634 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -86.1 -29.04 23.65 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 121.493 -1.004 . . . . 10.0 109.322 179.854 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -95.78 121.79 37.88 Favored 'General case' 0 CA--C 1.509 -0.609 0 N-CA-C 107.777 -1.194 . . . . 10.0 107.777 179.834 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 9.0 ttt -114.64 124.2 51.22 Favored 'General case' 0 CA--C 1.504 -0.827 0 CA-C-O 123.102 1.43 . . . . 10.0 112.285 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 30.7 mm -108.81 122.05 62.83 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.29 0 N-CA-C 107.393 -1.336 . . . . 10.0 107.393 -179.764 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.415 ' CG2' ' HD3' ' A' ' 40' ' ' LYS . 1.5 mm -107.87 135.97 44.78 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 N-CA-C 105.253 -2.129 . . . . 10.0 105.253 179.881 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 12.7 mtm-85 -133.7 122.58 23.6 Favored 'General case' 0 CA--C 1.51 -0.582 0 C-N-CA 119.978 -0.689 . . . . 10.0 112.361 -179.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 58.3 m -98.42 129.38 45.05 Favored 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 102.492 -3.151 . . . . 10.0 102.492 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 8.8 mt -117.71 54.24 0.91 Allowed 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 119.398 3.111 . . . . 10.0 119.398 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 60.6 p -73.54 -172.75 1.27 Allowed 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 103.864 -2.643 . . . . 10.0 103.864 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 8.0 p -120.56 -13.42 8.78 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-O 118.667 -0.682 . . . . 10.0 111.973 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -81.16 -46.38 14.97 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.36 -0.978 . . . . 10.0 108.36 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.37 143.21 16.25 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-O 123.906 1.813 . . . . 10.0 112.879 -179.856 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -87.82 142.84 27.49 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 114.067 -1.424 . . . . 10.0 107.964 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -149.87 118.48 6.54 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 126.689 2.493 . . . . 10.0 105.206 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -109.44 -175.13 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.313 -1.006 0 O-C-N 124.943 1.402 . . . . 10.0 112.598 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.409 ' HB2' ' HB ' ' A' ' 51' ' ' ILE . 2.3 mtm -143.21 -179.58 6.48 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 106.931 -1.507 . . . . 10.0 106.931 -179.772 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 64.7 t0 -162.12 80.92 0.55 Allowed 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 102.889 -3.004 . . . . 10.0 102.889 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 2.0 m-30 -88.67 166.15 14.29 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 125.2 1.562 . . . . 10.0 112.207 179.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.25 126.0 15.17 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 103.8 -2.667 . . . . 10.0 103.8 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.0 p -89.88 133.8 30.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 O-C-N 124.658 1.224 . . . . 10.0 108.453 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 91.1 -12.3 69.56 Favored Glycine 0 C--O 1.219 -0.811 0 C-N-CA 120.168 -1.015 . . . . 10.0 115.251 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.2 mttm -109.3 -173.19 2.21 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 117.44 0.62 . . . . 10.0 112.359 179.844 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -131.32 139.93 49.65 Favored 'General case' 0 C--N 1.314 -0.94 0 O-C-N 125.223 1.577 . . . . 10.0 107.533 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 10.5 p90 -154.5 135.33 13.68 Favored 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 118.597 -1.241 . . . . 10.0 110.173 179.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.13 155.86 22.4 Favored 'General case' 0 C--O 1.222 -0.393 0 N-CA-C 106.316 -1.735 . . . . 10.0 106.316 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -156.24 116.76 3.71 Favored 'General case' 0 N--CA 1.438 -1.071 0 N-CA-C 117.614 2.45 . . . . 10.0 117.614 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 -83.29 91.65 7.34 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 105.236 -2.135 . . . . 10.0 105.236 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 13.0 mt -62.15 3.43 0.17 Allowed 'General case' 0 N--CA 1.438 -1.068 0 N-CA-C 117.88 2.548 . . . . 10.0 117.88 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 50.8 p -41.97 109.65 0.14 Allowed 'General case' 0 C--O 1.24 0.575 0 O-C-N 125.76 1.913 . . . . 10.0 108.98 179.699 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 134.9 -30.25 2.86 Favored Glycine 0 CA--C 1.525 0.706 0 CA-C-N 113.21 -1.813 . . . . 10.0 109.8 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.5 mm -128.3 -17.1 2.36 Favored 'Isoleucine or valine' 0 C--O 1.247 0.938 0 CA-C-N 117.774 0.787 . . . . 10.0 111.43 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -144.44 -40.49 0.27 Allowed 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 117.641 -1.171 . . . . 10.0 113.195 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 93.53 -23.22 0.06 Allowed 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 126.987 2.115 . . . . 10.0 113.651 -179.824 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -94.7 166.71 11.87 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 117.367 -1.301 . . . . 10.0 112.932 -179.758 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.86 168.57 12.59 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 103.143 -2.91 . . . . 10.0 103.143 -179.919 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -153.06 -170.83 3.74 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 113.914 -1.494 . . . . 10.0 110.282 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.6 mmt -119.98 49.36 1.41 Allowed 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 101.387 -3.56 . . . . 10.0 101.387 179.772 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 42.3 m -44.93 104.23 0.04 OUTLIER 'General case' 0 N--CA 1.439 -1.003 0 N-CA-C 119.243 3.053 . . . . 10.0 119.243 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 22.7 m -102.34 133.99 46.37 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 105.359 -2.089 . . . . 10.0 105.359 -179.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -117.57 109.87 28.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 102.956 -2.979 . . . . 10.0 102.956 -179.828 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 17.3 m -104.05 166.42 10.42 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 115.888 -0.596 . . . . 10.0 111.484 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 11.5 p-90 -126.61 55.09 1.55 Allowed 'General case' 0 CA--C 1.511 -0.544 0 CA-C-O 125.027 2.346 . . . . 10.0 109.991 -179.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -66.4 109.25 2.65 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 101.343 -3.577 . . . . 10.0 101.343 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 81.93 -154.4 33.78 Favored Glycine 0 N--CA 1.446 -0.696 0 N-CA-C 108.273 -1.931 . . . . 10.0 108.273 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -103.46 42.42 1.17 Allowed 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 123.073 1.416 . . . . 10.0 109.846 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 7.2 mtmt -122.27 -166.16 1.37 Allowed 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 113.195 -1.821 . . . . 10.0 108.228 179.82 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 5.2 tt -141.33 102.57 4.25 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 105.573 -2.01 . . . . 10.0 105.573 -179.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -113.77 118.99 35.83 Favored 'General case' 0 CA--C 1.507 -0.674 0 O-C-N 120.81 -1.181 . . . . 10.0 112.84 179.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 19.9 p -127.51 148.41 50.32 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 112.828 0.677 . . . . 10.0 112.828 179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 88.9 t -126.33 125.75 68.09 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.75 0 N-CA-C 106.399 -1.704 . . . . 10.0 106.399 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 59.3 mt-30 -107.84 57.96 0.62 Allowed 'General case' 0 C--N 1.317 -0.822 0 O-C-N 126.654 2.471 . . . . 10.0 110.997 -179.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 1.5 mmmm -9.41 -92.23 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.602 0 O-C-N 128.032 3.333 . . . . 10.0 115.754 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 43.73 38.06 4.16 Favored Glycine 0 N--CA 1.44 -1.044 0 CA-C-O 118.025 -1.431 . . . . 10.0 113.054 179.551 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 68.03 -141.01 0.11 Allowed 'General case' 0 C--N 1.32 -0.698 0 O-C-N 125.723 1.484 . . . . 10.0 111.09 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 2.1 mmmm 57.32 174.1 0.05 OUTLIER 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 117.293 2.331 . . . . 10.0 117.293 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 45.8 mm-40 -82.06 -44.26 16.82 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 126.589 1.956 . . . . 10.0 109.423 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -113.26 -102.33 2.55 Favored Glycine 0 N--CA 1.444 -0.812 0 CA-C-O 122.641 1.134 . . . . 10.0 115.776 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 2.4 mtt180 63.19 91.83 0.07 Allowed 'General case' 0 CA--C 1.535 0.383 0 O-C-N 120.765 -1.432 . . . . 10.0 114.166 179.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 166.3 155.68 9.01 Favored Glycine 0 N--CA 1.447 -0.631 0 O-C-N 126.284 2.24 . . . . 10.0 108.163 -179.796 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' TRP . . . . . 0.411 ' CE3' ' HE3' ' A' ' 119' ' ' MET . 1.6 m0 -114.43 169.29 9.15 Favored 'General case' 0 CA--C 1.505 -0.75 0 O-C-N 125.314 1.244 . . . . 10.0 109.969 179.888 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 2.2 m -149.65 118.38 6.6 Favored 'General case' 0 CA--C 1.506 -0.728 0 N-CA-C 107.577 -1.268 . . . . 10.0 107.577 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -112.55 117.07 31.31 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.986 -179.719 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 1.5 p90 -137.07 140.59 42.1 Favored 'General case' 0 C--O 1.217 -0.607 0 N-CA-C 107.201 -1.407 . . . . 10.0 107.201 179.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 60.7 mt -96.18 159.76 2.92 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.004 0 N-CA-C 114.506 1.299 . . . . 10.0 114.506 179.609 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -166.97 113.32 0.79 Allowed 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 116.939 -1.505 . . . . 10.0 107.208 -179.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 53.51 40.78 62.9 Favored Glycine 0 N--CA 1.464 0.544 0 N-CA-C 106.447 -2.661 . . . . 10.0 106.447 179.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 64.0 9.41 4.59 Favored 'General case' 0 CA--C 1.552 1.054 0 CA-C-O 117.396 -1.287 . . . . 10.0 111.035 179.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -100.27 90.61 4.4 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 124.06 0.85 . . . . 10.0 110.184 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.432 ' HB3' ' HB2' ' A' ' 130' ' ' PHE . 12.1 tp -57.83 118.96 5.87 Favored 'General case' 0 N--CA 1.444 -0.764 0 N-CA-C 106.887 -1.523 . . . . 10.0 106.887 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . 0.412 ' CE1' HG13 ' A' ' 129' ' ' VAL . 1.4 m-70 -112.83 103.22 11.21 Favored 'General case' 0 CA--C 1.5 -0.968 0 O-C-N 125.772 1.92 . . . . 10.0 107.401 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 42.4 tp -93.55 143.9 25.87 Favored 'General case' 0 C--O 1.241 0.615 0 O-C-N 119.282 -2.136 . . . . 10.0 113.385 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 66.6 tt0 -130.32 123.57 30.29 Favored 'General case' 0 C--O 1.217 -0.607 0 CA-C-O 117.636 -1.173 . . . . 10.0 109.661 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.411 ' HE3' ' CE3' ' A' ' 106' ' ' TRP . 6.5 mtt -116.63 153.45 32.26 Favored 'General case' 0 C--O 1.239 0.546 0 O-C-N 124.295 0.997 . . . . 10.0 110.599 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 1.1 mmm-85 -147.6 139.99 24.52 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 117.935 -1.031 . . . . 10.0 110.644 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -153.98 117.09 4.52 Favored 'General case' 0 N--CA 1.443 -0.805 0 O-C-N 124.527 1.142 . . . . 10.0 111.342 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 56.28 39.88 30.05 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 116.953 2.205 . . . . 10.0 116.953 179.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 87.79 -6.43 83.47 Favored Glycine 0 CA--C 1.539 1.546 0 CA-C-O 118.663 -1.076 . . . . 10.0 112.272 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 2.0 t -98.9 131.92 45.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 125.213 1.405 . . . . 10.0 108.206 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 94.3 m -111.67 140.2 46.5 Favored 'General case' 0 N--CA 1.446 -0.642 0 O-C-N 125.724 1.89 . . . . 10.0 110.822 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -129.16 145.46 51.31 Favored 'General case' 0 C--O 1.221 -0.417 0 N-CA-C 106.043 -1.836 . . . . 10.0 106.043 -179.911 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 2.2 mtmm -137.44 141.83 41.61 Favored 'General case' 0 C--N 1.328 -0.343 0 O-C-N 120.431 -1.418 . . . . 10.0 114.141 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -132.99 130.46 39.52 Favored 'General case' 0 CA--C 1.503 -0.854 0 O-C-N 125.209 1.568 . . . . 10.0 109.815 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.412 HG13 ' CE1' ' A' ' 116' ' ' HIS . 0.0 OUTLIER -106.15 96.33 4.52 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.379 0 C-N-CA 124.005 0.922 . . . . 10.0 110.543 179.92 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . 0.488 ' CZ ' ' CZ2' ' A' ' 8' ' ' TRP . 5.5 m-85 -83.86 175.98 9.23 Favored 'General case' 0 C--N 1.321 -0.631 0 O-C-N 126.637 2.461 . . . . 10.0 109.054 -179.766 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 23.4 tptp -148.27 98.39 2.91 Favored 'General case' 0 N--CA 1.44 -0.935 0 N-CA-C 106.852 -1.536 . . . . 10.0 106.852 179.754 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 7.7 ttpt -63.5 122.9 17.41 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 125.636 1.835 . . . . 10.0 108.795 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 24.6 t -102.45 -57.3 4.57 Favored 'Isoleucine or valine' 0 C--O 1.244 0.809 0 N-CA-C 113.911 1.078 . . . . 10.0 113.911 179.665 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 3.3 t-80 . . . . . 0 C--O 1.244 0.8 0 C-N-CA 118.086 -1.446 . . . . 10.0 113.828 179.824 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo . . . . . 0 CA--C 1.533 0.455 0 CA-C-O 117.174 -1.261 . . . . 10.0 109.459 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 21.5 t -6.23 69.69 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.243 0.73 0 O-C-N 128.787 3.804 . . . . 10.0 114.118 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -75.69 129.6 37.37 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 114.734 -1.121 . . . . 10.0 108.654 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 2.8 m-30 -72.41 -28.18 62.82 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 115.999 1.851 . . . . 10.0 115.999 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.4 p30 -68.13 139.32 56.16 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-N 120.921 1.691 . . . . 10.0 114.389 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -156.5 -93.12 0.09 OUTLIER Glycine 0 C--O 1.216 -1.006 0 N-CA-C 119.114 2.406 . . . . 10.0 119.114 -179.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . 0.546 ' HA ' ' CE3' ' A' ' 8' ' ' TRP . 0.8 OUTLIER 172.7 170.91 0.12 Allowed 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 103.501 -2.778 . . . . 10.0 103.501 179.362 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.63 ' CD1' ' HB2' ' A' ' 39' ' ' ASP 0.331 32.0 p90 -152.05 159.25 43.75 Favored 'General case' 0 N--CA 1.441 -0.899 0 N-CA-C 115.459 1.651 . . . . 10.0 115.459 -178.116 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.497 ' HD3' ' CG ' ' A' ' 132' ' ' LYS . 2.3 pttp -167.28 88.38 0.3 Allowed 'General case' 0 C--O 1.216 -0.709 0 O-C-N 127.879 3.237 . . . . 10.0 108.313 175.844 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.423 ' HE2' ' HD2' ' A' ' 38' ' ' PRO . 2.1 ttp -54.49 140.12 35.44 Favored 'General case' 0 CA--C 1.509 -0.616 0 N-CA-C 116.521 2.045 . . . . 10.0 116.521 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.8 tp -101.73 -42.95 6.0 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 114.448 -1.251 . . . . 10.0 108.07 179.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -162.0 161.71 28.62 Favored 'General case' 0 C--O 1.244 0.792 0 O-C-N 125.377 1.673 . . . . 10.0 115.446 179.663 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -135.43 173.25 11.93 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 105.247 -2.131 . . . . 10.0 105.247 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -162.19 151.84 16.17 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 119.889 -1.757 . . . . 10.0 115.497 179.616 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 57.51 27.46 14.07 Favored 'General case' 0 C--N 1.324 -0.541 0 O-C-N 127.084 2.74 . . . . 10.0 115.582 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.4 ' CD1' ' N ' ' A' ' 16' ' ' PHE . 0.0 OUTLIER -56.55 -29.56 62.09 Favored 'General case' 0 C--O 1.244 0.784 0 C-N-CA 126.045 1.738 . . . . 10.0 114.932 179.931 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -78.66 -43.43 26.15 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 120.414 1.461 . . . . 10.0 109.169 179.186 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.08 -21.95 63.1 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-O 117.834 -1.079 . . . . 10.0 110.884 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -72.76 -36.04 67.59 Favored 'General case' 0 CA--C 1.552 1.052 0 O-C-N 124.79 1.306 . . . . 10.0 109.783 -179.911 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 75.0 mt -74.17 -27.96 61.07 Favored 'General case' 0 C--O 1.22 -0.454 0 CA-C-N 114.022 -1.444 . . . . 10.0 111.207 -179.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.5 ttt180 -73.47 -23.48 60.08 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 114.099 -1.409 . . . . 10.0 110.057 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.24 -24.62 62.22 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 122.258 1.028 . . . . 10.0 112.205 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.5 mt -109.71 -1.28 18.1 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 114.222 -1.354 . . . . 10.0 114.444 -179.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 55.68 72.06 0.51 Allowed 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 118.884 0.766 . . . . 10.0 111.415 179.717 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.412 HG22 ' N ' ' A' ' 26' ' ' ASN . 2.2 p -94.58 -109.94 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.24 0.563 0 CA-C-O 117.084 -1.436 . . . . 10.0 107.416 179.965 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.412 ' N ' HG22 ' A' ' 25' ' ' VAL . 0.9 OUTLIER -148.37 161.99 40.46 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-N 120.437 1.471 . . . . 10.0 113.582 179.761 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -77.25 -20.0 14.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 O-C-N 125.876 1.985 . . . . 10.0 114.017 -179.6 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -77.32 -34.18 55.39 Favored 'General case' 0 C--O 1.242 0.677 0 O-C-N 125.274 1.609 . . . . 10.0 109.326 179.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.404 ' CD2' HG23 ' A' ' 25' ' ' VAL . 44.8 tp -77.91 -40.01 41.14 Favored 'General case' 0 C--O 1.222 -0.392 0 C-N-CA 118.393 -1.323 . . . . 10.0 113.487 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 8.8 mtm-85 -59.09 -23.26 61.92 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 125.65 1.58 . . . . 10.0 114.163 179.714 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.7 ttpp -76.53 -43.25 40.07 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 117.844 -1.074 . . . . 10.0 109.971 179.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -79.52 -40.94 21.91 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 O-C-N 125.709 1.881 . . . . 10.0 109.807 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -55.4 -58.6 7.06 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-O 121.83 0.824 . . . . 10.0 112.094 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -64.89 82.28 0.04 OUTLIER 'General case' 0 C--N 1.342 0.265 0 CA-C-N 113.775 -1.557 . . . . 10.0 110.247 179.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 162.77 -32.59 0.0 OUTLIER 'General case' 0 N--CA 1.444 -0.77 0 O-C-N 126.112 2.132 . . . . 10.0 111.144 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.5 mt -88.98 155.38 19.53 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 124.372 1.045 . . . . 10.0 111.096 179.562 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.1 pttt -138.35 105.64 7.82 Favored Pre-proline 0 C--N 1.319 -0.723 0 N-CA-C 103.911 -2.625 . . . . 10.0 103.911 179.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.423 ' HD2' ' HE2' ' A' ' 10' ' ' MET . 95.8 Cg_exo -51.15 -166.68 0.0 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.327 0 C-N-CA 125.04 3.827 . . . . 10.0 119.123 179.785 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.63 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 4.7 p30 -153.22 167.79 28.13 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 112.724 -2.035 . . . . 10.0 106.522 -179.555 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.454 ' HB2' ' CZ ' ' A' ' 130' ' ' PHE . 0.3 OUTLIER -149.97 121.07 7.74 Favored 'General case' 0 CA--C 1.497 -1.085 0 C-N-CA 116.994 -1.882 . . . . 10.0 112.819 -179.433 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.558 ' HA ' ' CE3' ' A' ' 8' ' ' TRP . 2.4 tt0 -110.36 103.12 11.73 Favored 'General case' 0 CA--C 1.509 -0.611 0 O-C-N 119.95 -1.719 . . . . 10.0 106.91 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 67.6 mt -93.44 130.13 42.89 Favored 'Isoleucine or valine' 0 C--O 1.243 0.737 0 CA-C-N 115.115 -0.948 . . . . 10.0 108.906 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -119.13 122.65 69.76 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.934 0 N-CA-C 107.04 -1.467 . . . . 10.0 107.04 -179.885 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -143.78 107.05 4.54 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 105.921 -1.881 . . . . 10.0 105.921 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -81.03 -51.44 8.5 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 123.281 1.515 . . . . 10.0 107.822 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -155.15 -83.93 0.04 OUTLIER Glycine 0 C--N 1.345 1.06 0 N-CA-C 108.916 -1.674 . . . . 10.0 108.916 -179.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -111.27 -1.61 16.01 Favored 'General case' 0 N--CA 1.443 -0.817 0 O-C-N 121.124 -1.221 . . . . 10.0 109.658 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 65.9 m170 -107.5 102.87 12.1 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 109.085 -0.709 . . . . 10.0 109.085 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 2.5 ttt -95.15 151.13 19.47 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 116.495 2.035 . . . . 10.0 116.495 -179.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 19.4 mt -145.64 127.42 8.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 105.939 -1.874 . . . . 10.0 105.939 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.4 mp -112.2 123.66 68.15 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 CA-C-N 114.664 -1.153 . . . . 10.0 108.328 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.409 ' HD2' HG12 ' A' ' 61' ' ' ILE . 4.9 tpt180 -114.34 86.6 2.46 Favored 'General case' 0 C--N 1.319 -0.744 0 C-N-CA 124.714 1.206 . . . . 10.0 111.581 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 93.7 m -87.63 131.47 34.42 Favored 'General case' 0 N--CA 1.444 -0.728 0 N-CA-C 103.033 -2.951 . . . . 10.0 103.033 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 3.9 mt -105.51 66.56 0.74 Allowed 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 120.497 3.517 . . . . 10.0 120.497 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 43.8 m -76.84 116.57 17.62 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 102.706 -3.072 . . . . 10.0 102.706 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -57.58 -17.87 16.6 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 108.043 -1.095 . . . . 10.0 108.043 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -117.93 105.7 12.18 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 106.86 -1.533 . . . . 10.0 106.86 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 6.0 mmt-85 61.52 92.14 0.05 Allowed 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 114.385 -1.279 . . . . 10.0 112.816 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -40.85 150.21 0.07 Allowed 'General case' 0 CA--C 1.532 0.277 0 O-C-N 126.707 2.504 . . . . 10.0 113.067 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -132.33 98.0 4.27 Favored 'General case' 0 C--N 1.311 -1.072 0 N-CA-C 103.012 -2.958 . . . . 10.0 103.012 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.409 HG12 ' HD2' ' A' ' 52' ' ' ARG . 1.7 mp -135.18 146.84 29.61 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.055 0 N-CA-C 115.164 1.542 . . . . 10.0 115.164 179.785 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.4 ' N ' ' CG2' ' A' ' 61' ' ' ILE . 0.0 OUTLIER -147.09 -171.49 3.79 Favored 'General case' 0 C--O 1.216 -0.689 0 N-CA-C 106.318 -1.734 . . . . 10.0 106.318 179.905 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -167.64 123.79 1.09 Allowed 'General case' 0 C--O 1.223 -0.312 0 N-CA-C 100.923 -3.732 . . . . 10.0 100.923 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.449 ' CE1' ' CE1' ' A' ' 70' ' ' PHE . 12.7 m-85 -123.42 -175.0 3.09 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 115.144 1.535 . . . . 10.0 115.144 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -133.71 95.3 3.44 Favored 'General case' 0 N--CA 1.443 -0.782 0 N-CA-C 103.729 -2.693 . . . . 10.0 103.729 179.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.522 HG11 ' CE2' ' A' ' 88' ' ' TRP . 9.4 t -53.27 137.68 13.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 O-C-N 124.971 1.419 . . . . 10.0 109.046 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 76.64 15.44 81.56 Favored Glycine 0 N--CA 1.443 -0.877 0 CA-C-O 117.462 -1.744 . . . . 10.0 113.113 -179.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 3.8 tppt? -139.41 132.32 29.33 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 125.308 1.443 . . . . 10.0 112.116 -179.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -69.83 148.95 48.42 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 118.153 -0.927 . . . . 10.0 109.474 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.449 ' CE1' ' CE1' ' A' ' 64' ' ' PHE . 3.6 p90 -155.17 161.59 41.18 Favored 'General case' 0 C--O 1.245 0.841 0 O-C-N 124.894 1.372 . . . . 10.0 107.813 -179.787 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -100.6 123.32 44.65 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.518 -0.919 . . . . 10.0 108.518 179.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -75.01 78.03 2.2 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 114.696 -1.138 . . . . 10.0 113.639 -179.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -60.92 133.56 56.22 Favored 'General case' 0 C--N 1.316 -0.891 0 C-N-CA 119.126 -1.03 . . . . 10.0 108.247 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.0 tp -147.58 99.57 3.13 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 117.67 -1.157 . . . . 10.0 113.071 179.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.4 t -127.5 78.78 1.84 Allowed 'General case' 0 N--CA 1.443 -0.797 0 O-C-N 124.723 1.265 . . . . 10.0 108.837 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 153.25 110.94 0.43 Allowed Glycine 0 C--O 1.244 0.775 0 C-N-CA 120.006 -1.092 . . . . 10.0 110.671 179.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.6 mt 69.71 106.22 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 N-CA-C 107.527 -1.286 . . . . 10.0 107.527 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 87.64 -33.95 0.03 OUTLIER 'General case' 0 C--O 1.242 0.662 0 O-C-N 127.492 2.995 . . . . 10.0 114.319 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.2 p30 35.04 97.62 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.808 0 C-N-CA 126.956 2.103 . . . . 10.0 116.286 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.469 ' CD ' ' CZ ' ' A' ' 104' ' ' ARG . 13.6 ttp180 -124.8 -65.62 1.02 Allowed 'General case' 0 CA--C 1.512 -0.493 0 O-C-N 119.629 -1.919 . . . . 10.0 115.196 -179.902 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 76.02 120.95 0.05 OUTLIER 'General case' 0 N--CA 1.439 -1.017 0 N-CA-C 103.882 -2.636 . . . . 10.0 103.882 179.658 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -155.63 -174.46 4.98 Favored 'General case' 0 CA--C 1.512 -0.486 0 N-CA-C 108.953 -0.758 . . . . 10.0 108.953 179.898 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 4.0 ptm -121.76 148.33 44.79 Favored 'General case' 0 N--CA 1.438 -1.028 0 N-CA-C 100.237 -3.986 . . . . 10.0 100.237 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.2 m -155.68 150.29 26.12 Favored 'General case' 0 CA--C 1.501 -0.914 0 N-CA-C 114.611 1.337 . . . . 10.0 114.611 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 16.4 m -133.69 106.71 7.51 Favored 'General case' 0 N--CA 1.438 -1.052 0 O-C-N 120.965 -1.085 . . . . 10.0 109.059 -179.779 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.8 m -90.01 147.06 5.46 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.61 0 N-CA-C 103.205 -2.887 . . . . 10.0 103.205 179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -163.83 169.51 18.16 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 126.479 2.362 . . . . 10.0 114.207 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . 0.522 ' CE2' HG11 ' A' ' 66' ' ' VAL . 2.6 m-90 -97.83 122.86 41.44 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 124.096 0.958 . . . . 10.0 110.467 179.693 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -99.49 -63.21 1.15 Allowed 'General case' 0 C--O 1.247 0.944 0 N-CA-C 101.93 -3.359 . . . . 10.0 101.93 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -160.53 92.92 0.12 Allowed Glycine 0 CA--C 1.498 -1.011 0 N-CA-C 108.34 -1.904 . . . . 10.0 108.34 179.769 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 57.53 30.69 19.12 Favored 'General case' 0 C--N 1.318 -0.773 0 O-C-N 124.951 1.03 . . . . 10.0 113.054 -179.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.4 mtpt -148.42 166.15 28.99 Favored 'General case' 0 C--O 1.238 0.49 0 N-CA-C 109.282 -0.636 . . . . 10.0 109.282 -179.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.2 tt -117.57 116.65 27.52 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 105.032 -2.211 . . . . 10.0 105.032 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 25.0 mm100 -106.9 156.86 18.24 Favored 'General case' 0 N--CA 1.445 -0.724 0 O-C-N 118.411 -2.681 . . . . 10.0 111.429 179.759 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -148.02 142.48 26.39 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 118.946 -1.101 . . . . 10.0 112.126 -179.676 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 57.6 t -131.68 106.92 12.42 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 CA-C-N 114.128 -1.397 . . . . 10.0 109.133 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -91.72 114.92 27.59 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 106.144 -1.799 . . . . 10.0 106.144 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.01 -85.37 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 116.651 -1.642 . . . . 10.0 113.734 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 40.66 -142.92 0.69 Allowed Glycine 0 CA--C 1.528 0.887 0 O-C-N 125.284 1.615 . . . . 10.0 112.475 -179.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.448 ' H ' ' NH1' ' A' ' 104' ' ' ARG . 3.1 mm-40 -105.19 -159.27 0.7 Allowed 'General case' 0 C--N 1.315 -0.929 0 O-C-N 126.785 2.109 . . . . 10.0 110.461 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 68.22 -166.22 0.19 Allowed 'General case' 0 C--N 1.316 -0.855 0 O-C-N 126.333 2.271 . . . . 10.0 113.636 179.875 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -135.18 12.33 3.56 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 125.249 1.419 . . . . 10.0 114.445 -179.854 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -149.76 41.7 0.81 Allowed Glycine 0 N--CA 1.467 0.701 0 N-CA-C 116.151 1.22 . . . . 10.0 116.151 179.749 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.469 ' CZ ' ' CD ' ' A' ' 80' ' ' ARG . 70.2 mtt180 -91.73 129.4 37.71 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 113.829 1.048 . . . . 10.0 113.829 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 148.41 159.72 8.64 Favored Glycine 0 N--CA 1.462 0.379 0 C-N-CA 117.369 -2.348 . . . . 10.0 110.668 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 16.2 m0 -123.41 171.19 9.63 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 124.818 1.247 . . . . 10.0 109.75 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 3.4 m -153.35 112.98 3.85 Favored 'General case' 0 C--O 1.212 -0.91 0 N-CA-C 106.466 -1.679 . . . . 10.0 106.466 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -93.81 170.64 9.41 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 122.252 1.025 . . . . 10.0 112.567 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 2.0 t90 -176.37 108.56 0.08 Allowed 'General case' 0 C--O 1.219 -0.525 0 N-CA-C 106.935 -1.506 . . . . 10.0 106.935 179.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 54.1 mt -92.6 129.63 42.9 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 CA-C-O 124.275 1.988 . . . . 10.0 111.294 -179.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -110.48 -164.26 0.91 Allowed 'General case' 0 C--O 1.242 0.659 0 N-CA-C 106.803 -1.554 . . . . 10.0 106.803 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -96.78 108.06 3.61 Favored Glycine 0 CA--C 1.522 0.506 0 N-CA-C 107.541 -2.224 . . . . 10.0 107.541 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 78.25 12.29 1.7 Allowed 'General case' 0 C--O 1.214 -0.774 0 N-CA-C 108.461 -0.94 . . . . 10.0 108.461 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -149.79 149.88 31.18 Favored 'General case' 0 CA--C 1.509 -0.632 0 CA-C-O 123.195 1.474 . . . . 10.0 110.849 179.747 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.413 ' HB3' ' HB2' ' A' ' 130' ' ' PHE . 11.9 tp -116.83 121.27 41.03 Favored 'General case' 0 C--O 1.241 0.611 0 N-CA-C 104.3 -2.481 . . . . 10.0 104.3 -179.744 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 59.7 t-80 -114.13 117.14 30.38 Favored 'General case' 0 C--O 1.213 -0.849 0 N-CA-C 106.881 -1.526 . . . . 10.0 106.881 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -128.62 154.26 46.41 Favored 'General case' 0 CA--C 1.51 -0.567 0 O-C-N 126.0 2.063 . . . . 10.0 110.704 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -143.36 126.48 16.46 Favored 'General case' 0 CA--C 1.495 -1.161 0 N-CA-C 106.747 -1.575 . . . . 10.0 106.747 179.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 28.7 mtp -107.97 126.75 53.08 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 113.68 -1.6 . . . . 10.0 113.006 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.82 142.38 51.54 Favored 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 118.725 -1.19 . . . . 10.0 110.17 -179.931 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -158.49 127.55 5.58 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.42 -0.956 . . . . 10.0 108.42 179.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 34.86 56.84 0.75 Allowed 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 117.881 2.548 . . . . 10.0 117.881 179.903 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 77.09 11.32 85.67 Favored Glycine 0 C--N 1.317 -0.482 0 N-CA-C 116.763 1.465 . . . . 10.0 116.763 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 22.5 t -124.26 130.81 73.55 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.335 0 N-CA-C 108.124 -1.065 . . . . 10.0 108.124 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 1.6 m -119.23 108.53 14.76 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 126.553 2.408 . . . . 10.0 114.152 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.51 144.59 25.45 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 106.331 -1.729 . . . . 10.0 106.331 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -144.55 179.49 7.25 Favored 'General case' 0 C--O 1.22 -0.454 0 O-C-N 125.414 1.696 . . . . 10.0 112.477 -179.947 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -169.76 145.25 3.0 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-N 114.45 -1.25 . . . . 10.0 108.402 -179.718 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -111.96 98.59 7.24 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 O-C-N 124.687 1.242 . . . . 10.0 108.007 179.769 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . 0.454 ' CZ ' ' HB2' ' A' ' 40' ' ' LYS . 5.6 m-85 -74.0 169.67 17.01 Favored 'General case' 0 C--O 1.214 -0.767 0 O-C-N 125.734 1.896 . . . . 10.0 107.435 179.894 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.438 ' C ' ' HD2' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -145.15 57.72 1.27 Allowed 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 122.999 1.38 . . . . 10.0 111.068 -179.76 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . 0.564 ' HB3' ' CA ' ' A' ' 8' ' ' TRP . 0.9 OUTLIER -162.14 -144.86 0.1 Allowed 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 104.728 -2.323 . . . . 10.0 104.728 179.588 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . 0.447 ' CB ' ' O ' ' A' ' 132' ' ' LYS . 0.4 OUTLIER 97.01 30.12 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.308 -1.201 0 O-C-N 127.708 3.13 . . . . 10.0 109.284 -179.911 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 51.1 t-80 . . . . . 0 N--CA 1.441 -0.879 0 CA-C-N 112.446 -2.161 . . . . 10.0 109.831 179.666 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo . . . . . 0 C--O 1.243 0.774 0 CA-C-O 120.884 0.285 . . . . 10.0 112.286 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.453 ' CG1' ' CE1' ' A' ' 4' ' ' PHE . 22.1 t -116.27 99.99 9.49 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 CA-C-N 114.566 -1.197 . . . . 10.0 107.956 -179.827 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -96.4 104.66 16.64 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 124.927 1.392 . . . . 10.0 108.885 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.453 ' CE1' ' CG1' ' A' ' 2' ' ' VAL . 3.4 m-30 -89.99 -16.9 28.89 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 117.211 2.3 . . . . 10.0 117.211 -179.905 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -39.28 146.27 0.09 Allowed 'General case' 0 C--O 1.244 0.787 0 O-C-N 126.358 2.287 . . . . 10.0 113.433 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -179.53 -138.02 3.17 Favored Glycine 0 C--O 1.227 -0.323 0 N-CA-C 118.573 2.189 . . . . 10.0 118.573 -179.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . 0.413 ' CB ' HG11 ' A' ' 133' ' ' VAL . 50.0 m-85 -144.9 -175.88 4.85 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 119.604 -2.116 . . . . 10.0 106.616 -179.655 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.54 ' CE3' ' HB3' ' A' ' 39' ' ' ASP 0.287 11.5 p-90 -158.97 -177.32 6.42 Favored 'General case' 0 C--O 1.214 -0.766 0 N-CA-C 113.883 1.068 . . . . 10.0 113.883 -179.262 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 11.5 ptmt 157.3 97.67 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.557 0 O-C-N 127.663 3.102 . . . . 10.0 107.167 178.454 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.464 ' CE ' ' HB2' ' A' ' 13' ' ' ASN . 3.8 ppp? -61.01 139.32 58.08 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-O 117.711 -1.138 . . . . 10.0 112.29 -179.536 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.1 tt -96.97 -38.27 9.86 Favored 'General case' 0 C--N 1.32 -0.68 0 O-C-N 125.876 1.985 . . . . 10.0 108.289 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -163.27 136.05 5.45 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 116.724 2.12 . . . . 10.0 116.724 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . 0.464 ' HB2' ' CE ' ' A' ' 10' ' ' MET . 29.6 t30 -134.03 152.42 51.84 Favored 'General case' 0 C--O 1.239 0.538 0 O-C-N 125.888 1.992 . . . . 10.0 107.712 -179.795 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -173.76 170.66 3.93 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 118.612 -0.709 . . . . 10.0 112.372 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 66.95 20.6 10.48 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 127.644 2.377 . . . . 10.0 113.725 179.347 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -67.04 -30.72 70.88 Favored 'General case' 0 CA--C 1.548 0.876 0 CA-C-N 114.62 -1.173 . . . . 10.0 112.418 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -71.24 -42.46 68.82 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-O 122.395 1.093 . . . . 10.0 111.891 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -75.17 -25.14 58.08 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 114.108 -1.406 . . . . 10.0 107.262 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 10.2 t80 -75.5 -43.39 49.36 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 118.335 -0.84 . . . . 10.0 111.016 -179.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 50.6 mt -72.2 -21.84 61.36 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 113.02 0.748 . . . . 10.0 113.02 -179.621 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.4 ttm-85 -74.4 -24.68 59.15 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 114.49 -1.232 . . . . 10.0 108.833 179.809 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.16 -32.53 69.04 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 122.587 1.184 . . . . 10.0 110.607 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 51.5 mt -100.5 -7.92 23.67 Favored 'General case' 0 C--O 1.236 0.379 0 O-C-N 119.669 -1.894 . . . . 10.0 110.668 179.785 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.403 ' OD1' ' N ' ' A' ' 24' ' ' ASP . 0.3 OUTLIER 51.35 62.85 2.5 Favored 'General case' 0 C--O 1.245 0.864 0 O-C-N 124.085 0.865 . . . . 10.0 111.935 179.854 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 20.8 m -94.29 39.71 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 N-CA-C 104.054 -2.572 . . . . 10.0 104.054 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 65.55 154.63 0.08 Allowed 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 115.719 1.748 . . . . 10.0 115.719 -179.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 15.5 m -72.11 -22.07 20.91 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.656 0 N-CA-C 114.886 1.439 . . . . 10.0 114.886 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -73.65 -27.08 61.06 Favored 'General case' 0 C--O 1.234 0.28 0 O-C-N 124.838 1.336 . . . . 10.0 111.468 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.27 -30.56 57.87 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 119.556 -0.858 . . . . 10.0 112.96 179.833 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.72 -22.89 61.56 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-O 124.189 1.947 . . . . 10.0 110.214 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.33 -41.51 33.42 Favored 'General case' 0 N--CA 1.444 -0.728 0 N-CA-C 107.384 -1.339 . . . . 10.0 107.384 -179.733 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.2 mp -72.58 -35.5 51.0 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.512 0 O-C-N 127.315 2.884 . . . . 10.0 110.499 -179.742 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.32 -31.05 43.09 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 113.18 -1.827 . . . . 10.0 113.22 179.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -56.97 -30.57 64.2 Favored 'General case' 0 C--N 1.318 -0.765 0 O-C-N 119.753 -1.842 . . . . 10.0 115.213 179.672 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -110.81 40.59 1.98 Allowed 'General case' 0 C--N 1.322 -0.596 0 O-C-N 124.563 1.164 . . . . 10.0 109.511 179.877 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -117.08 131.56 56.89 Favored 'General case' 0 CA--C 1.515 -0.396 0 C-N-CA 124.386 1.074 . . . . 10.0 109.686 179.952 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -143.97 100.79 4.96 Favored Pre-proline 0 N--CA 1.47 0.546 0 N-CA-C 106.776 -1.564 . . . . 10.0 106.776 179.821 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -98.94 168.47 0.56 Allowed 'Trans proline' 0 N--CA 1.447 -1.247 0 C-N-CA 124.606 3.537 . . . . 10.0 116.458 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.54 ' HB3' ' CE3' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -121.87 -174.29 2.84 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 105.723 -1.955 . . . . 10.0 105.723 -179.725 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.467 ' HB2' ' CE2' ' A' ' 130' ' ' PHE . 2.5 mttt -156.48 105.56 2.27 Favored 'General case' 0 CA--C 1.501 -0.923 0 C-N-CA 118.475 -1.29 . . . . 10.0 112.833 -179.944 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -97.64 107.86 20.45 Favored 'General case' 0 C--N 1.341 0.234 0 N-CA-C 102.682 -3.081 . . . . 10.0 102.682 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 86.0 mt -89.27 141.68 13.95 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.022 0 CA-C-O 118.845 -0.598 . . . . 10.0 110.511 -179.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -134.8 158.97 41.79 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 O-C-N 124.727 1.267 . . . . 10.0 107.677 -179.883 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.472 ' CG ' ' HB3' ' A' ' 48' ' ' HIS . 0.0 OUTLIER -129.41 136.93 50.57 Favored 'General case' 0 C--N 1.323 -0.584 0 O-C-N 125.961 2.038 . . . . 10.0 111.566 -179.653 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -133.8 -143.94 0.22 Allowed 'General case' 0 C--O 1.243 0.739 0 CA-C-O 114.776 -2.535 . . . . 10.0 107.791 -179.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . 0.423 ' O ' ' NE2' ' A' ' 65' ' ' GLN . . . -42.1 138.28 2.59 Favored Glycine 0 CA--C 1.534 1.237 0 N-CA-C 104.587 -3.405 . . . . 10.0 104.587 179.959 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.487 ' CB ' ' HB3' ' A' ' 65' ' ' GLN . 11.3 m-20 59.19 -115.2 0.76 Allowed 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 102.595 -3.113 . . . . 10.0 102.595 -176.82 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . 0.54 ' CD2' ' HB ' ' A' ' 66' ' ' VAL . 0.1 OUTLIER 164.27 85.04 0.0 OUTLIER 'General case' 0 CA--C 1.5 -0.97 0 O-C-N 126.487 2.367 . . . . 10.0 112.611 175.31 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.44 ' HB3' ' HB3' ' A' ' 64' ' ' PHE . 36.4 ttm -169.38 83.07 0.13 Allowed 'General case' 0 N--CA 1.435 -1.22 0 N-CA-C 115.771 1.767 . . . . 10.0 115.771 175.416 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 1.3 mp -117.46 107.22 21.64 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.172 0 N-CA-C 102.208 -3.256 . . . . 10.0 102.208 179.533 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.432 ' N ' ' CD1' ' A' ' 51' ' ' ILE . 0.2 OUTLIER -106.3 108.12 24.35 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.952 0 N-CA-C 109.243 -0.651 . . . . 10.0 109.243 -179.999 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.4 ' HG3' HD12 ' A' ' 61' ' ' ILE . 19.9 ttp180 -101.55 110.24 22.2 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.694 -1.139 . . . . 10.0 113.519 -179.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 20.7 m -97.77 122.93 41.45 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 102.24 -3.244 . . . . 10.0 102.24 -179.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -125.83 61.62 1.25 Allowed 'General case' 0 C--N 1.324 -0.51 1 N-CA-C 121.917 4.043 . . . . 10.0 121.917 -179.795 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.0 m -65.5 -175.94 0.3 Allowed 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 125.908 1.683 . . . . 10.0 107.976 -179.755 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 58.7 p -105.15 -20.93 13.36 Favored 'General case' 0 C--O 1.242 0.69 0 CA-C-O 117.388 -1.291 . . . . 10.0 109.927 179.698 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -73.48 -56.64 4.78 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 122.892 1.329 . . . . 10.0 108.609 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.42 -165.06 1.9 Allowed 'General case' 0 C--O 1.244 0.814 0 CA-C-N 114.183 -1.371 . . . . 10.0 110.089 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -156.84 133.28 9.94 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-O 123.965 1.841 . . . . 10.0 111.849 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -109.9 125.48 52.85 Favored 'General case' 0 CA--C 1.501 -0.929 0 N-CA-C 102.398 -3.186 . . . . 10.0 102.398 179.751 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.4 HD12 ' HG3' ' A' ' 52' ' ' ARG . 1.1 mt -132.73 158.46 43.28 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.706 0 O-C-N 118.237 -2.789 . . . . 10.0 116.102 -179.663 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -141.23 155.23 46.05 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 104.406 -2.442 . . . . 10.0 104.406 -179.911 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -131.67 69.61 1.47 Allowed 'General case' 0 C--N 1.311 -1.066 1 N-CA-C 99.436 -4.283 . . . . 10.0 99.436 179.884 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.44 ' HB3' ' HB3' ' A' ' 49' ' ' MET . 2.2 m-85 -69.78 -172.91 0.55 Allowed 'General case' 0 C--O 1.241 0.657 0 CA-C-N 113.383 -1.735 . . . . 10.0 113.546 179.772 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.487 ' HB3' ' CB ' ' A' ' 47' ' ' ASP . 22.6 mt-30 -171.58 121.32 0.5 Allowed 'General case' 0 C--N 1.317 -0.838 0 C-N-CA 128.001 2.52 . . . . 10.0 107.092 -179.404 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.54 ' HB ' ' CD2' ' A' ' 48' ' ' HIS . 24.8 t -58.89 156.32 2.29 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 C-N-CA 125.961 1.704 . . . . 10.0 113.231 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.453 ' N ' ' CG1' ' A' ' 66' ' ' VAL . . . 63.58 11.26 41.02 Favored Glycine 0 C--O 1.218 -0.889 0 N-CA-C 118.38 2.112 . . . . 10.0 118.38 179.791 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.4 ' HG2' ' CE1' ' A' ' 70' ' ' PHE . 9.0 tttp -124.26 148.63 47.23 Favored 'General case' 0 C--O 1.22 -0.459 0 CA-C-N 118.105 0.953 . . . . 10.0 112.241 179.901 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 53.4 tt0 -91.12 136.58 32.99 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 125.402 1.688 . . . . 10.0 109.076 -179.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.4 ' CE1' ' HG2' ' A' ' 68' ' ' LYS . 6.7 m-85 -122.53 179.02 4.74 Favored 'General case' 0 C--N 1.318 -0.797 0 C-N-CA 124.566 1.146 . . . . 10.0 108.358 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -154.03 67.98 0.75 Allowed 'General case' 0 C--N 1.317 -0.811 0 O-C-N 127.205 2.815 . . . . 10.0 111.198 -179.754 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -51.71 126.7 18.52 Favored 'General case' 0 N--CA 1.442 -0.847 0 N-CA-C 112.355 0.502 . . . . 10.0 112.355 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -70.68 -20.02 62.73 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.785 0.802 . . . . 10.0 110.227 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.481 ' HB2' ' CB ' ' A' ' 79' ' ' ASP . 0.0 OUTLIER -156.75 127.46 6.69 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 116.395 1.998 . . . . 10.0 116.395 -179.959 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.455 ' N ' ' HA ' ' A' ' 79' ' ' ASP . 18.3 m -96.43 123.59 40.14 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-O 124.116 1.913 . . . . 10.0 111.194 -179.591 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 52.48 -133.22 39.05 Favored Glycine 0 N--CA 1.441 -0.994 0 N-CA-C 107.172 -2.371 . . . . 10.0 107.172 179.797 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -107.38 -11.85 10.48 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 N-CA-C 106.843 -1.54 . . . . 10.0 106.843 179.374 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -82.17 -4.97 58.09 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-N 113.67 -1.604 . . . . 10.0 109.262 179.848 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . 0.481 ' CB ' ' HB2' ' A' ' 74' ' ' LEU . 4.0 m-20 39.68 -128.15 0.35 Allowed 'General case' 0 C--N 1.316 -0.88 0 C-N-CA 128.314 2.646 . . . . 10.0 115.953 -179.596 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 16.9 ttt85 84.8 114.37 0.05 Allowed 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 120.481 1.491 . . . . 10.0 107.231 -179.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 5.4 mmtp -57.19 141.84 44.96 Favored 'General case' 0 C--N 1.316 -0.873 0 O-C-N 127.156 2.785 . . . . 10.0 105.583 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 72.8 m -152.12 149.66 29.04 Favored 'General case' 0 C--O 1.213 -0.86 0 O-C-N 125.412 1.695 . . . . 10.0 109.601 -179.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.6 mtm -100.69 114.54 28.36 Favored 'General case' 0 C--O 1.241 0.617 1 N-CA-C 100.163 -4.014 . . . . 10.0 100.163 179.869 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 98.8 m -112.12 135.53 52.66 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 115.844 1.794 . . . . 10.0 115.844 179.734 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -131.3 145.22 51.79 Favored 'General case' 0 C--N 1.343 0.287 0 N-CA-C 108.134 -1.061 . . . . 10.0 108.134 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 1.2 t -113.23 172.88 3.1 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.986 0 N-CA-C 104.02 -2.585 . . . . 10.0 104.02 179.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -169.49 169.11 9.05 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 120.526 1.512 . . . . 10.0 113.96 179.783 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -106.81 122.62 46.76 Favored 'General case' 0 C--O 1.224 -0.24 0 O-C-N 125.844 1.965 . . . . 10.0 106.905 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.419 ' HB3' ' HB2' ' A' ' 92' ' ' LYS . 24.5 t0 -107.69 3.89 25.15 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 101.381 -3.563 . . . . 10.0 101.381 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 111.47 -96.46 0.88 Allowed Glycine 0 C--O 1.24 0.51 0 N-CA-C 104.066 -3.614 . . . . 10.0 104.066 -179.719 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 8.9 p30 -84.83 -35.78 22.06 Favored 'General case' 0 C--O 1.222 -0.373 0 C-N-CA 119.641 -0.824 . . . . 10.0 109.657 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.419 ' HB2' ' HB3' ' A' ' 89' ' ' ASP . 1.6 mtmm -82.17 142.6 32.07 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 124.009 0.924 . . . . 10.0 111.843 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.418 HD21 ' HE1' ' A' ' 49' ' ' MET . 9.8 tp -119.22 100.72 7.5 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 104.254 -2.499 . . . . 10.0 104.254 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -123.92 168.07 13.28 Favored 'General case' 0 CA--C 1.497 -1.073 0 N-CA-C 114.985 1.476 . . . . 10.0 114.985 179.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 19.9 p -131.67 -173.03 3.01 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-N 113.547 -1.66 . . . . 10.0 110.026 179.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 7.0 t -134.76 -74.08 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.744 0 C-N-CA 125.062 1.345 . . . . 10.0 109.475 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 87.78 118.45 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.569 0 O-C-N 127.273 2.858 . . . . 10.0 110.423 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.8 mmtt -88.96 114.2 25.32 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 125.386 1.474 . . . . 10.0 114.247 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . 0.483 ' N ' HH22 ' A' ' 104' ' ' ARG . . . -153.32 -160.05 9.47 Favored Glycine 0 CA--C 1.523 0.573 0 N-CA-C 108.753 -1.739 . . . . 10.0 108.753 -179.911 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 14.4 tm-20 -86.63 -14.51 42.5 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 116.645 2.091 . . . . 10.0 116.645 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 15.3 mmtt -81.78 178.44 8.32 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 113.273 0.842 . . . . 10.0 113.273 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 3.7 pm0 -121.71 28.89 7.42 Favored 'General case' 0 CA--C 1.509 -0.6 0 C-N-CA 125.933 1.693 . . . . 10.0 110.517 179.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -159.19 -18.4 0.03 OUTLIER Glycine 0 N--CA 1.462 0.383 0 CA-C-O 116.554 -2.248 . . . . 10.0 118.481 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.483 HH22 ' N ' ' A' ' 99' ' ' GLY . 24.0 mtm-85 -47.4 144.82 2.75 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 120.209 2.004 . . . . 10.0 109.017 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 129.65 152.11 7.47 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 107.592 -2.203 . . . . 10.0 107.592 -179.786 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -124.95 -170.97 2.26 Favored 'General case' 0 C--O 1.239 0.531 0 C-N-CA 125.223 1.409 . . . . 10.0 109.916 179.713 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 3.1 m -161.39 117.75 2.18 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-O 117.307 -1.33 . . . . 10.0 109.55 179.724 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 -93.45 128.17 39.42 Favored 'General case' 0 C--N 1.318 -0.772 0 O-C-N 126.796 2.56 . . . . 10.0 107.287 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 4.5 t90 -139.55 101.47 4.23 Favored 'General case' 0 CA--C 1.511 -0.521 0 O-C-N 120.505 -1.372 . . . . 10.0 112.271 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.429 HD13 ' CE2' ' A' ' 4' ' ' PHE . 72.2 mt -85.64 119.4 34.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 O-C-N 126.405 2.316 . . . . 10.0 114.069 179.689 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -132.25 148.09 52.44 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 104.301 -2.481 . . . . 10.0 104.301 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 26.73 -103.16 0.01 OUTLIER Glycine 0 N--CA 1.445 -0.737 0 O-C-N 128.161 3.413 . . . . 10.0 111.926 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -116.05 24.77 11.19 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 125.766 1.509 . . . . 10.0 112.251 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -139.99 163.19 33.33 Favored 'General case' 0 CA--C 1.501 -0.912 0 CA-C-O 123.502 1.62 . . . . 10.0 114.13 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 4.5 mt -124.6 108.78 12.42 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 104.781 -2.303 . . . . 10.0 104.781 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -94.85 73.95 3.57 Favored 'General case' 0 C--N 1.313 -1.006 0 C-N-CA 119.332 -0.947 . . . . 10.0 109.33 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 8.9 tt -66.89 153.68 42.88 Favored 'General case' 0 N--CA 1.45 -0.456 0 O-C-N 126.355 2.285 . . . . 10.0 112.71 179.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -141.51 138.49 32.81 Favored 'General case' 0 C--O 1.214 -0.807 0 O-C-N 125.037 1.461 . . . . 10.0 109.986 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -136.21 121.44 19.12 Favored 'General case' 0 C--N 1.322 -0.596 0 O-C-N 124.738 1.274 . . . . 10.0 111.013 179.781 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -123.19 152.99 40.69 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 114.842 -1.072 . . . . 10.0 111.161 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -165.07 130.38 2.62 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 104.829 -2.286 . . . . 10.0 104.829 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 47.22 30.27 1.4 Allowed 'General case' 0 C--N 1.321 -0.672 0 O-C-N 125.345 1.653 . . . . 10.0 111.977 -179.884 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 86.58 -8.41 75.21 Favored Glycine 0 CA--C 1.535 1.335 0 C-N-CA 119.604 -1.284 . . . . 10.0 114.497 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 22.1 t -86.08 124.24 40.12 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 CA-C-N 118.723 1.262 . . . . 10.0 108.517 -179.787 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 5.4 m -103.42 120.6 41.14 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-O 123.943 1.83 . . . . 10.0 114.39 -179.813 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -124.92 129.4 50.29 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 112.443 -2.162 . . . . 10.0 105.272 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -115.46 173.77 6.35 Favored 'General case' 0 C--O 1.24 0.597 0 N-CA-C 115.319 1.6 . . . . 10.0 115.319 179.784 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -151.87 88.71 1.41 Allowed 'General case' 0 CA--C 1.512 -0.519 0 CA-C-N 113.012 -1.904 . . . . 10.0 110.3 179.832 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 38.5 t -70.17 119.13 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 N-CA-C 104.874 -2.269 . . . . 10.0 104.874 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . 0.467 ' CE2' ' HB2' ' A' ' 40' ' ' LYS . 0.3 OUTLIER -101.03 174.86 5.81 Favored 'General case' 0 C--O 1.218 -0.562 0 CA-C-O 123.687 1.708 . . . . 10.0 108.94 179.758 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 2.3 tptm -143.22 88.88 2.05 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 113.578 -1.646 . . . . 10.0 106.616 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 22.9 ttpt -65.08 98.0 0.28 Allowed 'General case' 0 CA--C 1.504 -0.796 0 C-N-CA 118.008 -1.477 . . . . 10.0 107.709 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . 0.447 ' CG1' ' N ' ' A' ' 134' ' ' HIS . 7.1 p -53.66 -37.25 31.0 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.353 0 CA-C-N 114.417 -1.265 . . . . 10.0 110.209 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . 0.447 ' N ' ' CG1' ' A' ' 133' ' ' VAL . 1.9 t-160 . . . . . 0 N--CA 1.438 -1.064 0 O-C-N 126.049 2.093 . . . . 10.0 111.511 -179.981 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.246 0.915 0 N-CA-C 114.778 1.03 . . . . 10.0 114.778 . . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.58 -13.82 14.99 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 O-C-N 124.409 1.068 . . . . 10.0 111.811 -179.886 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -46.71 129.47 11.32 Favored 'General case' 0 C--O 1.217 -0.611 0 CA-C-N 114.456 -1.247 . . . . 10.0 111.751 179.993 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.412 ' CE2' ' CD1' ' A' ' 93' ' ' LEU . 19.8 m-30 -90.11 -9.67 47.49 Favored 'General case' 0 C--N 1.319 -0.74 0 O-C-N 127.881 3.238 . . . . 10.0 116.326 -179.906 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 71.8 m-20 -43.57 143.8 0.9 Allowed 'General case' 0 N--CA 1.471 0.619 0 O-C-N 127.253 2.845 . . . . 10.0 111.905 179.97 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . 0.435 ' HA2' ' HA ' ' A' ' 134' ' ' HIS . . . -146.58 -177.49 21.23 Favored Glycine 0 C--N 1.346 1.12 0 N-CA-C 119.669 2.628 . . . . 10.0 119.669 -179.569 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -151.48 46.44 0.8 Allowed 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 103.839 -2.652 . . . . 10.0 103.839 -179.582 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.618 ' CZ3' ' CB ' ' A' ' 39' ' ' ASP 0.397 30.2 p-90 -37.61 169.61 0.0 OUTLIER 'General case' 0 C--O 1.211 -0.931 0 C-N-CA 127.19 2.196 . . . . 10.0 115.272 179.331 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.455 ' HE3' ' HB2' ' A' ' 132' ' ' LYS . 0.0 OUTLIER -157.55 150.49 23.26 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 111.633 -2.531 . . . . 10.0 104.473 174.976 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.3 ppp? -106.4 168.37 9.2 Favored 'General case' 0 C--O 1.24 0.561 0 O-C-N 119.834 -1.791 . . . . 10.0 112.67 -179.777 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -137.3 -59.9 0.68 Allowed 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 105.719 -1.956 . . . . 10.0 105.719 -179.902 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 61.8 p -161.85 173.68 14.21 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 124.689 2.185 . . . . 10.0 112.623 179.771 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . 0.42 ' OD1' ' N ' ' A' ' 13' ' ' ASN . 3.1 p-10 -126.16 161.35 27.87 Favored 'General case' 0 CA--C 1.513 -0.481 0 CA-C-N 112.67 -2.059 . . . . 10.0 108.088 -179.597 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 35.9 tp10 -149.0 134.8 18.86 Favored 'General case' 0 C--O 1.215 -0.722 0 O-C-N 119.539 -1.975 . . . . 10.0 113.519 179.676 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 61.25 27.84 17.49 Favored 'General case' 0 C--O 1.244 0.78 0 C-N-CA 125.015 1.326 . . . . 10.0 111.846 -179.958 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.526 ' CD2' HD13 ' A' ' 20' ' ' LEU . 40.2 t80 -69.16 -27.62 65.69 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 114.797 1.406 . . . . 10.0 114.797 -179.399 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -76.61 -29.07 56.37 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 120.205 -1.559 . . . . 10.0 112.778 179.916 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -79.37 -28.18 41.94 Favored 'General case' 0 C--O 1.219 -0.505 0 CA-C-N 114.512 -1.222 . . . . 10.0 109.445 -179.948 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.502 ' CE1' HD13 ' A' ' 23' ' ' LEU . 0.2 OUTLIER -65.9 -43.67 87.55 Favored 'General case' 0 CA--C 1.555 1.172 0 O-C-N 125.489 1.743 . . . . 10.0 108.978 -179.998 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.526 HD13 ' CD2' ' A' ' 16' ' ' PHE . 0.7 OUTLIER -76.82 -23.22 52.8 Favored 'General case' 0 C--O 1.22 -0.462 0 O-C-N 126.146 2.154 . . . . 10.0 112.609 179.707 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.89 -26.01 40.39 Favored 'General case' 0 C--N 1.321 -0.662 0 O-C-N 126.224 2.202 . . . . 10.0 108.816 179.531 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.89 -27.64 64.97 Favored 'General case' 0 C--O 1.218 -0.57 0 C-N-CA 125.976 1.711 . . . . 10.0 112.984 179.781 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.502 HD13 ' CE1' ' A' ' 19' ' ' TYR . 0.0 OUTLIER -113.27 9.64 18.37 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 114.197 -1.365 . . . . 10.0 109.886 179.567 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 38.41 72.19 0.14 Allowed 'General case' 0 C--N 1.322 -0.6 0 O-C-N 126.697 2.498 . . . . 10.0 114.957 179.466 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 3.8 m -88.78 170.05 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-O 117.027 -1.463 . . . . 10.0 108.841 -179.661 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 9.0 m120 -53.98 152.63 5.58 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 117.913 -1.042 . . . . 10.0 111.502 179.48 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 2.5 p -71.6 -23.1 22.29 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.855 0 N-CA-C 117.284 2.327 . . . . 10.0 117.284 -179.632 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -79.82 -32.04 40.67 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 114.43 -1.259 . . . . 10.0 109.919 -179.806 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 54.3 tp -70.75 -44.72 66.18 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 114.64 1.348 . . . . 10.0 114.64 -179.732 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.468 ' HG3' ' CD1' ' A' ' 20' ' ' LEU . 18.4 ttp180 -56.86 -36.72 70.37 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 126.254 1.822 . . . . 10.0 114.377 179.813 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.87 -32.66 61.93 Favored 'General case' 0 C--O 1.218 -0.585 0 O-C-N 126.274 2.234 . . . . 10.0 110.588 179.806 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 20.7 mm -77.41 -41.04 29.52 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.453 0 O-C-N 125.489 1.743 . . . . 10.0 109.261 -179.739 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -80.35 -6.25 57.69 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.785 -0.643 . . . . 10.0 112.399 179.828 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -93.46 -30.42 15.06 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 115.294 1.59 . . . . 10.0 115.294 -179.785 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.423 HD11 ' N ' ' A' ' 36' ' ' LEU . 0.3 OUTLIER -92.33 -14.06 29.32 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 120.017 1.281 . . . . 10.0 110.456 179.893 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.423 ' N ' HD11 ' A' ' 35' ' ' LEU . 0.0 OUTLIER -80.42 118.26 21.89 Favored 'General case' 0 CA--C 1.514 -0.423 0 C-N-CA 125.677 1.591 . . . . 10.0 109.468 -179.735 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.7 135.75 19.7 Favored Pre-proline 0 C--N 1.318 -0.783 0 N-CA-C 106.495 -1.668 . . . . 10.0 106.495 -179.975 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_exo -90.7 179.18 1.83 Allowed 'Trans proline' 0 N--CA 1.447 -1.258 0 C-N-CA 124.268 3.312 . . . . 10.0 119.545 -179.443 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.618 ' CB ' ' CZ3' ' A' ' 8' ' ' TRP . 0.3 OUTLIER -149.39 143.84 26.0 Favored 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 127.636 2.375 . . . . 10.0 104.724 179.72 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.573 ' C ' ' CD1' ' A' ' 8' ' ' TRP . 1.2 tptt -97.56 -143.22 0.3 Allowed 'General case' 0 C--N 1.305 -1.335 0 CA-C-O 114.672 -2.585 . . . . 10.0 106.905 -179.42 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.452 ' N ' ' CD1' ' A' ' 8' ' ' TRP . 0.2 OUTLIER 152.92 117.32 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.938 0 O-C-N 127.728 3.143 . . . . 10.0 102.77 178.586 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 6.3 mm -121.86 145.76 28.01 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.981 0 O-C-N 124.701 1.251 . . . . 10.0 113.602 179.451 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 67.0 t -147.48 100.36 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 O-C-N 125.911 2.007 . . . . 10.0 106.35 179.898 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -112.01 116.91 31.33 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 124.668 1.187 . . . . 10.0 108.665 179.862 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -118.86 125.73 50.18 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 104.799 -2.297 . . . . 10.0 104.799 -179.942 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 61.32 -115.29 7.68 Favored Glycine 0 C--O 1.223 -0.532 0 N-CA-C 108.951 -1.66 . . . . 10.0 108.951 -179.723 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -112.58 -20.84 11.57 Favored 'General case' 0 C--N 1.321 -0.652 0 O-C-N 121.693 -0.887 . . . . 10.0 110.609 -179.854 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 46.1 m170 -82.45 119.08 23.74 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 107.802 -1.184 . . . . 10.0 107.802 -179.954 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 17.5 ttp -104.21 155.18 18.95 Favored 'General case' 0 C--N 1.32 -0.684 0 O-C-N 126.664 2.478 . . . . 10.0 114.454 179.961 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 4.8 mt -145.7 122.8 4.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 106.419 -1.697 . . . . 10.0 106.419 -179.937 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.5 mp -119.23 131.41 72.0 Favored 'Isoleucine or valine' 0 C--O 1.242 0.699 0 N-CA-C 104.683 -2.34 . . . . 10.0 104.683 179.823 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.84 98.66 6.01 Favored 'General case' 0 N--CA 1.442 -0.872 0 CA-C-N 114.971 -1.013 . . . . 10.0 111.571 -179.76 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 89.2 m -72.33 139.88 48.2 Favored 'General case' 0 C--O 1.219 -0.538 0 N-CA-C 101.784 -3.413 . . . . 10.0 101.784 179.983 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.2 mt -113.11 54.74 0.72 Allowed 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 119.902 3.297 . . . . 10.0 119.902 -179.886 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 64.8 m -93.38 131.01 38.95 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 104.04 -2.578 . . . . 10.0 104.04 -179.757 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -69.51 -13.34 62.29 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 123.236 1.493 . . . . 10.0 107.727 -179.848 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -95.22 84.17 4.02 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 106.799 -1.556 . . . . 10.0 106.799 179.954 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.419 ' CZ ' ' HB3' ' A' ' 58' ' ' ARG . 0.0 OUTLIER 50.95 80.11 0.08 Allowed 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 114.471 1.286 . . . . 10.0 114.471 -179.822 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . 0.401 ' OD1' ' N ' ' A' ' 59' ' ' ASN . 4.8 p-10 -71.94 90.62 1.15 Allowed 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 113.747 -1.57 . . . . 10.0 112.206 179.787 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 25.6 p90 -75.32 130.1 38.5 Favored 'General case' 0 C--N 1.321 -0.648 0 O-C-N 126.638 2.461 . . . . 10.0 105.483 -179.854 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 6.2 mm -104.34 164.28 3.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 O-C-N 121.409 -0.807 . . . . 10.0 111.277 -179.716 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 27.7 mmm -144.78 150.98 38.13 Favored 'General case' 0 N--CA 1.442 -0.827 0 N-CA-C 107.291 -1.374 . . . . 10.0 107.291 179.992 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -133.52 88.5 2.49 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 103.684 -2.71 . . . . 10.0 103.684 179.953 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -76.34 178.47 6.49 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 119.619 -1.926 . . . . 10.0 114.474 179.961 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 10.5 mt-30 -147.35 113.98 6.03 Favored 'General case' 0 C--N 1.315 -0.893 0 O-C-N 128.764 3.79 . . . . 10.0 103.187 -179.86 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -62.05 137.52 23.88 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 O-C-N 124.38 1.05 . . . . 10.0 113.721 -179.846 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.99 -25.16 0.67 Allowed Glycine 0 C--O 1.218 -0.869 0 CA-C-O 117.025 -1.986 . . . . 10.0 116.281 179.804 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 15.2 mttp -91.78 160.33 15.38 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 120.492 2.146 . . . . 10.0 116.7 -179.777 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -69.05 158.74 34.2 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 107.947 -1.131 . . . . 10.0 107.947 -179.955 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 45.9 t80 -165.95 113.11 0.91 Allowed 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 113.994 -1.457 . . . . 10.0 113.24 -179.583 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -79.73 145.84 32.7 Favored 'General case' 0 C--N 1.314 -0.955 0 O-C-N 125.181 1.551 . . . . 10.0 107.525 -179.79 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 13.8 tt0 -107.1 -42.24 4.93 Favored 'General case' 0 C--O 1.24 0.591 0 N-CA-C 117.193 2.294 . . . . 10.0 117.193 -179.922 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 6.3 t70 53.08 35.95 20.97 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.467 0.651 . . . . 10.0 110.695 179.777 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -46.28 117.54 1.61 Allowed 'General case' 0 C--N 1.32 -0.708 0 O-C-N 120.555 -1.341 . . . . 10.0 114.167 179.894 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -129.32 8.24 5.48 Favored 'General case' 0 CA--C 1.514 -0.418 0 O-C-N 121.61 -0.681 . . . . 10.0 109.909 179.956 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -78.94 -43.54 10.95 Favored Glycine 0 CA--C 1.5 -0.902 0 CA-C-O 117.505 -1.719 . . . . 10.0 110.453 -179.749 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.7 pp -142.44 142.2 27.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 CA-C-N 118.775 1.287 . . . . 10.0 107.917 179.848 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 75.34 -59.02 0.55 Allowed 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.639 0.733 . . . . 10.0 111.632 179.709 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 87.06 82.77 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 115.44 1.645 . . . . 10.0 115.44 179.926 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 3.4 ptt85 -155.32 143.29 19.99 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 113.985 -1.462 . . . . 10.0 111.026 179.767 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 4.3 ptpp? -95.21 175.81 6.46 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 103.731 -2.692 . . . . 10.0 103.731 179.894 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 6.0 p -177.84 158.72 1.32 Allowed 'General case' 0 C--O 1.213 -0.82 0 N-CA-C 106.344 -1.725 . . . . 10.0 106.344 179.824 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.6 ttm -105.57 117.83 35.01 Favored 'General case' 0 C--N 1.329 -0.323 1 N-CA-C 98.683 -4.562 . . . . 10.0 98.683 179.998 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 43.0 m -121.24 124.09 43.81 Favored 'General case' 0 C--O 1.215 -0.745 0 CA-C-N 112.068 -2.333 . . . . 10.0 117.113 -179.743 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.53 121.52 36.73 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 114.397 -1.274 . . . . 10.0 108.065 179.919 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 13.8 t -98.01 104.89 16.49 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.875 0 N-CA-C 105.488 -2.041 . . . . 10.0 105.488 -179.819 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -110.59 -178.65 3.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 122.238 1.018 . . . . 10.0 113.358 179.956 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 19.0 m0 -111.91 134.24 53.6 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 112.883 -1.962 . . . . 10.0 107.446 179.75 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -102.95 -58.94 1.79 Allowed 'General case' 0 C--O 1.246 0.892 0 N-CA-C 102.879 -3.008 . . . . 10.0 102.879 179.954 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 157.73 90.01 0.07 OUTLIER Glycine 0 CA--C 1.504 -0.614 0 N-CA-C 105.96 -2.856 . . . . 10.0 105.96 179.819 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 65.9 47.0 2.12 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 108.084 -1.08 . . . . 10.0 108.084 -179.904 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 25.6 mtmt -169.37 124.63 0.85 Allowed 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 125.51 1.524 . . . . 10.0 108.724 -179.991 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.412 ' CD1' ' CE2' ' A' ' 4' ' ' PHE . 0.3 OUTLIER -82.71 77.56 9.45 Favored 'General case' 0 CA--C 1.515 -0.394 0 O-C-N 126.451 2.344 . . . . 10.0 107.576 179.934 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.59 105.88 7.91 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 114.561 -1.199 . . . . 10.0 112.487 -179.982 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -108.45 138.48 44.68 Favored 'General case' 0 C--N 1.341 0.23 0 O-C-N 125.129 1.518 . . . . 10.0 112.598 -179.912 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 40.9 t -125.57 131.93 71.52 Favored 'Isoleucine or valine' 0 C--O 1.242 0.67 0 CA-C-O 124.457 2.075 . . . . 10.0 109.367 179.711 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.452 ' CG ' ' HA2' ' A' ' 105' ' ' GLY . 0.0 OUTLIER -134.95 141.2 46.21 Favored 'General case' 0 C--O 1.242 0.678 0 O-C-N 120.231 -1.543 . . . . 10.0 107.159 179.876 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 9.9 pttp -149.33 110.89 4.49 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 122.586 1.184 . . . . 10.0 111.08 179.988 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -163.37 74.49 0.18 Allowed Glycine 0 C--O 1.221 -0.691 0 O-C-N 119.653 -1.904 . . . . 10.0 112.135 -179.958 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 94.6 23.33 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.579 0 O-C-N 127.458 2.505 . . . . 10.0 115.024 179.791 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.468 ' CE ' ' HA ' ' A' ' 101' ' ' LYS . 0.0 OUTLIER -139.33 -155.49 0.6 Allowed 'General case' 0 N--CA 1.471 0.585 0 O-C-N 126.379 2.3 . . . . 10.0 110.982 -179.948 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -136.77 -57.24 0.73 Allowed 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 125.309 1.443 . . . . 10.0 113.564 -179.979 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -109.31 42.5 1.94 Allowed Glycine 0 N--CA 1.449 -0.436 0 N-CA-C 119.333 2.493 . . . . 10.0 119.333 -179.808 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 3.1 mtm180 -88.18 168.02 13.11 Favored 'General case' 0 C--O 1.244 0.805 0 O-C-N 120.71 -1.465 . . . . 10.0 110.805 -179.961 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . 0.452 ' HA2' ' CG ' ' A' ' 97' ' ' GLN . . . 120.96 139.02 5.63 Favored Glycine 0 N--CA 1.45 -0.426 0 N-CA-C 108.638 -1.785 . . . . 10.0 108.638 -179.819 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 106' ' ' TRP . . . . . 0.48 ' CD1' ' CG ' ' A' ' 119' ' ' MET . 3.1 m0 -104.93 176.5 5.14 Favored 'General case' 0 C--N 1.316 -0.87 0 O-C-N 119.959 -1.906 . . . . 10.0 109.096 -179.754 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 4.5 m -140.62 120.31 13.38 Favored 'General case' 0 C--O 1.222 -0.347 0 O-C-N 126.69 2.493 . . . . 10.0 107.074 179.915 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -108.65 133.31 52.93 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 114.342 -1.299 . . . . 10.0 109.676 -179.979 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 2.0 t90 -138.8 113.27 8.9 Favored 'General case' 0 CA--C 1.502 -0.882 0 O-C-N 125.783 1.927 . . . . 10.0 109.19 179.645 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -82.97 128.51 38.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 121.994 0.902 . . . . 10.0 111.651 -179.981 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -127.05 88.16 2.77 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 122.883 1.325 . . . . 10.0 108.044 179.991 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 53.27 -103.6 0.15 Allowed Glycine 0 C--N 1.346 1.134 0 O-C-N 119.21 -2.181 . . . . 10.0 111.16 -179.79 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . 0.407 ' N ' ' OD1' ' A' ' 113' ' ' ASP . 0.5 OUTLIER -102.17 28.88 5.47 Favored 'General case' 0 N--CA 1.463 0.199 0 C-N-CA 124.378 1.071 . . . . 10.0 113.692 -179.967 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -146.12 145.21 30.43 Favored 'General case' 0 C--N 1.321 -0.669 0 O-C-N 119.73 -1.856 . . . . 10.0 109.68 179.989 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.495 ' HG ' ' CG1' ' A' ' 133' ' ' VAL . 0.1 OUTLIER -107.75 133.96 51.39 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 104.593 -2.373 . . . . 10.0 104.593 -179.559 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -120.72 95.78 4.85 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 106.022 -1.844 . . . . 10.0 106.022 -179.969 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 5.0 tp -101.29 134.0 45.01 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 113.811 -1.54 . . . . 10.0 108.907 179.929 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -133.61 100.83 4.91 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 105.059 -2.2 . . . . 10.0 105.059 179.685 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.48 ' CG ' ' CD1' ' A' ' 106' ' ' TRP . 2.2 ttm -96.39 139.4 32.57 Favored 'General case' 0 CA--C 1.504 -0.821 0 O-C-N 126.449 2.343 . . . . 10.0 113.435 -179.907 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 3.2 ptt180 -131.27 177.92 7.1 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 114.004 1.113 . . . . 10.0 114.004 -179.998 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 174.19 132.07 0.03 OUTLIER 'General case' 0 C--N 1.319 -0.755 0 O-C-N 124.526 1.142 . . . . 10.0 108.908 179.647 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 44.97 51.82 8.52 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 116.272 1.953 . . . . 10.0 116.272 -179.918 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 66.19 24.12 71.79 Favored Glycine 0 CA--C 1.534 1.243 0 CA-C-N 114.316 -1.311 . . . . 10.0 114.854 -179.77 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 1.6 t -136.86 118.85 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 CA-C-O 123.796 1.76 . . . . 10.0 107.326 179.962 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 18.7 m -94.55 159.05 15.26 Favored 'General case' 0 C--N 1.314 -0.937 0 C-N-CA 125.507 1.523 . . . . 10.0 110.575 -179.977 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -149.52 153.64 37.52 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 127.829 3.206 . . . . 10.0 105.218 -179.816 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 25.3 mttp -151.5 123.44 8.1 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 113.719 1.007 . . . . 10.0 113.719 179.728 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . 0.408 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 3.0 tt0 -109.89 118.72 37.23 Favored 'General case' 0 C--N 1.319 -0.747 0 O-C-N 126.658 2.474 . . . . 10.0 109.432 -179.866 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 90.7 t -83.3 118.75 31.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 119.218 -0.993 . . . . 10.0 110.635 -179.741 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . 0.436 ' HB3' ' HB2' ' A' ' 115' ' ' LEU . 0.4 OUTLIER -103.3 133.3 48.59 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 114.147 -1.388 . . . . 10.0 109.095 -179.915 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.15 130.68 55.5 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 105.076 -2.194 . . . . 10.0 105.076 179.577 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . 0.455 ' HB2' ' HE3' ' A' ' 9' ' ' LYS . 25.7 tptt 74.84 161.18 0.24 Allowed 'General case' 0 C--O 1.211 -0.923 0 CA-C-O 116.743 -1.599 . . . . 10.0 107.03 -178.766 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . 0.495 ' CG1' ' HG ' ' A' ' 115' ' ' LEU . 7.6 p 146.25 57.77 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.31 -1.113 1 O-C-N 130.125 4.641 . . . . 10.0 109.298 -179.529 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . 0.435 ' HA ' ' HA2' ' A' ' 6' ' ' GLY . 8.2 t60 . . . . . 0 C--N 1.314 -0.966 1 O-C-N 129.245 4.091 . . . . 10.0 108.989 179.825 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo . . . . . 0 N--CA 1.485 1.021 0 CA-C-O 122.229 0.845 . . . . 10.0 114.268 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER 153.57 131.0 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 C-N-CA 126.996 2.119 . . . . 10.0 107.78 179.681 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -155.3 121.27 5.13 Favored 'General case' 0 C--N 1.318 -0.779 0 O-C-N 126.578 2.424 . . . . 10.0 111.765 -179.749 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 55.7 m-85 -78.22 -43.57 28.04 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 116.428 2.01 . . . . 10.0 116.428 -179.952 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 10.1 m-20 -43.23 125.18 3.63 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-O 116.954 -1.498 . . . . 10.0 114.796 179.798 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 160.58 -99.25 0.18 Allowed Glycine 0 CA--C 1.531 1.083 0 O-C-N 125.5 1.75 . . . . 10.0 116.899 179.96 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -175.04 128.69 0.29 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 101.579 -3.489 . . . . 10.0 101.579 -179.823 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.537 ' CZ3' ' HB2' ' A' ' 132' ' ' LYS . 82.0 m95 -127.16 114.1 17.25 Favored 'General case' 0 C--N 1.322 -0.608 0 O-C-N 126.78 2.55 . . . . 10.0 111.824 179.727 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.1 175.33 7.78 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 107.306 -1.368 . . . . 10.0 107.306 179.81 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -114.9 149.34 37.35 Favored 'General case' 0 C--O 1.241 0.606 0 N-CA-C 116.306 1.965 . . . . 10.0 116.306 -179.893 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.1 tt -114.84 -0.74 13.39 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 114.212 -1.358 . . . . 10.0 109.582 -179.88 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.1 t 173.83 156.32 0.12 Allowed 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 117.287 2.329 . . . . 10.0 117.287 -179.389 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -146.78 122.31 10.41 Favored 'General case' 0 C--N 1.322 -0.624 0 O-C-N 126.158 2.161 . . . . 10.0 105.289 -179.883 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.2 tt0 -135.81 144.01 45.48 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 115.991 1.849 . . . . 10.0 115.991 179.489 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 62.0 29.36 17.69 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 125.036 1.46 . . . . 10.0 111.799 179.832 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.467 ' CZ ' ' HA ' ' A' ' 34' ' ' ASN . 1.7 p90 -76.18 -26.26 56.01 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-O 118.527 -0.749 . . . . 10.0 112.281 179.892 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.42 ' HG3' ' CE1' ' A' ' 16' ' ' PHE . 5.0 mt-10 -71.25 -32.14 68.39 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 122.848 1.308 . . . . 10.0 111.968 179.932 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -78.91 -29.18 44.09 Favored 'General case' 0 C--O 1.215 -0.74 0 CA-C-N 113.37 -1.741 . . . . 10.0 108.103 -179.832 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.92 -35.81 81.65 Favored 'General case' 0 C--O 1.247 0.956 0 O-C-N 124.213 0.946 . . . . 10.0 110.12 -179.934 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.402 HD23 HG13 ' A' ' 25' ' ' VAL . 4.2 mt -77.02 -33.47 57.44 Favored 'General case' 0 C--O 1.22 -0.48 0 CA-C-O 121.692 0.758 . . . . 10.0 109.598 -179.858 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.31 -23.93 60.33 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 107.672 -1.233 . . . . 10.0 107.672 -179.877 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.14 -34.69 66.23 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 126.016 2.073 . . . . 10.0 111.968 -179.699 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -119.28 7.81 11.33 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 119.23 0.923 . . . . 10.0 113.439 179.883 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 t0 55.53 78.16 0.2 Allowed 'General case' 0 N--CA 1.475 0.808 0 O-C-N 124.92 1.387 . . . . 10.0 112.34 -179.831 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.449 HG21 ' CD2' ' A' ' 29' ' ' LEU . 2.9 p -118.74 54.29 0.25 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.506 0 CA-C-O 124.057 1.884 . . . . 10.0 107.464 179.737 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.432 ' ND2' ' N ' ' A' ' 26' ' ' ASN . 0.0 OUTLIER 60.14 146.08 0.01 OUTLIER 'General case' 0 C--O 1.225 -0.185 0 N-CA-C 118.655 2.835 . . . . 10.0 118.655 179.328 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 33.7 m -76.04 -30.77 20.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 113.417 -1.719 . . . . 10.0 113.237 179.892 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.27 -28.64 67.38 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 119.885 -1.759 . . . . 10.0 111.576 179.861 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.449 ' CD2' HG21 ' A' ' 25' ' ' VAL . 7.8 tp -77.87 -32.74 52.13 Favored 'General case' 0 N--CA 1.447 -0.595 0 O-C-N 123.847 0.717 . . . . 10.0 112.486 179.83 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 15.8 ttp85 -64.54 -32.87 74.7 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 124.446 2.07 . . . . 10.0 113.065 179.825 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -74.16 -41.16 61.96 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 113.794 -1.548 . . . . 10.0 111.058 -179.829 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 4.8 mm -74.89 -49.27 29.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 C-N-CA 125.136 1.375 . . . . 10.0 111.488 179.709 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -58.18 -40.51 81.68 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 117.643 -1.17 . . . . 10.0 112.746 -179.906 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.467 ' HA ' ' CZ ' ' A' ' 16' ' ' PHE . 0.1 OUTLIER -52.37 -29.88 26.1 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 120.41 1.459 . . . . 10.0 111.993 -179.486 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -109.0 23.99 13.76 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 119.481 1.037 . . . . 10.0 109.703 -179.777 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 2.3 tt -123.76 132.66 53.85 Favored 'General case' 0 CA--C 1.522 -0.122 0 O-C-N 125.21 1.568 . . . . 10.0 108.925 179.93 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 4.4 mmtp -119.66 106.02 42.62 Favored Pre-proline 0 N--CA 1.477 0.895 0 N-CA-C 104.644 -2.354 . . . . 10.0 104.644 179.66 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -66.6 -145.84 0.02 OUTLIER 'Trans proline' 0 C--N 1.356 0.95 0 C-N-CA 123.962 3.108 . . . . 10.0 117.522 -179.84 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 179.68 113.27 0.04 OUTLIER 'General case' 0 C--O 1.238 0.455 0 N-CA-C 106.236 -1.765 . . . . 10.0 106.236 -179.797 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.6 mmtp -80.08 168.56 18.99 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 117.401 -1.285 . . . . 10.0 111.825 -179.879 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -164.63 149.94 9.98 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 104.796 -2.298 . . . . 10.0 104.796 179.912 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 3.6 mm -133.69 154.58 38.79 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.632 0 N-CA-C 113.343 0.868 . . . . 10.0 113.343 -179.684 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.42 ' CG2' ' HD3' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -148.02 129.66 6.15 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 N-CA-C 105.7 -1.963 . . . . 10.0 105.7 179.576 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.459 ' HG2' ' HA ' ' A' ' 48' ' ' HIS . 0.8 OUTLIER -109.71 122.85 48.42 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-O 122.863 1.316 . . . . 10.0 111.029 -179.93 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -166.04 146.68 6.56 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 116.055 -1.926 . . . . 10.0 108.493 -179.941 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 74.19 -109.54 2.82 Favored Glycine 0 CA--C 1.537 1.417 0 O-C-N 126.119 2.137 . . . . 10.0 109.7 179.946 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.53 ' CB ' ' HB3' ' A' ' 65' ' ' GLN 0.256 2.8 m-20 -96.79 26.03 4.84 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 113.853 -1.174 . . . . 10.0 108.843 179.228 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . 0.459 ' HA ' ' HG2' ' A' ' 44' ' ' GLN . 8.3 m-70 77.01 -163.46 0.04 OUTLIER 'General case' 0 N--CA 1.434 -1.24 0 C-N-CA 126.695 1.998 . . . . 10.0 111.409 176.465 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.481 ' HG2' ' CD1' ' A' ' 51' ' ' ILE . 4.9 ttm 10.01 123.06 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.057 0 O-C-N 129.046 3.966 . . . . 10.0 119.261 -177.879 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 11.8 mt -144.53 106.46 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.865 0 N-CA-C 102.408 -3.182 . . . . 10.0 102.408 179.104 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.481 ' CD1' ' HG2' ' A' ' 49' ' ' MET . 1.2 mp -96.08 131.85 41.82 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.054 0 CA-C-O 124.846 2.26 . . . . 10.0 112.123 -178.795 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.42 ' HD3' ' CG2' ' A' ' 43' ' ' VAL . 0.0 OUTLIER -120.14 139.86 51.98 Favored 'General case' 0 N--CA 1.43 -1.466 0 CA-C-N 112.392 -2.186 . . . . 10.0 110.139 179.264 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 92.2 m -120.35 145.7 46.88 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 102.501 -3.148 . . . . 10.0 102.501 -179.86 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 97.0 mt -139.22 150.45 45.55 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 121.256 3.799 . . . . 10.0 121.256 179.909 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 78.4 p -179.27 174.84 0.99 Allowed 'General case' 0 C--O 1.24 0.577 0 CA-C-N 112.714 -2.039 . . . . 10.0 106.128 179.996 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 16.5 p -71.8 -22.02 61.63 Favored 'General case' 0 C--O 1.241 0.615 0 O-C-N 124.414 1.071 . . . . 10.0 109.892 179.308 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -86.11 173.96 9.49 Favored 'General case' 0 C--O 1.245 0.865 0 C-N-CA 125.795 1.638 . . . . 10.0 109.908 -179.919 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -47.35 127.14 10.54 Favored 'General case' 0 C--O 1.241 0.653 0 O-C-N 125.9 2.0 . . . . 10.0 114.159 -179.948 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 10.9 p-10 -100.04 177.31 5.13 Favored 'General case' 0 C--O 1.237 0.421 0 O-C-N 125.683 1.864 . . . . 10.0 108.857 179.794 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.473 ' CD1' ' HE1' ' A' ' 62' ' ' MET . 9.8 p90 -159.24 143.08 14.99 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 103.269 -2.863 . . . . 10.0 103.269 179.732 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -115.83 153.43 17.42 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.797 0 CA-C-O 123.679 1.704 . . . . 10.0 110.307 -179.87 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.473 ' HE1' ' CD1' ' A' ' 60' ' ' TYR . 0.3 OUTLIER -136.09 -178.63 5.23 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 104.195 -2.521 . . . . 10.0 104.195 179.964 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 34.1 t0 -150.33 122.24 8.17 Favored 'General case' 0 N--CA 1.437 -1.125 0 CA-C-N 113.003 -1.908 . . . . 10.0 106.508 179.888 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.482 ' HA ' ' CZ ' ' A' ' 70' ' ' PHE . 4.8 m-85 -93.67 -96.09 0.15 Allowed 'General case' 0 N--CA 1.44 -0.947 0 C-N-CA 125.629 1.572 . . . . 10.0 114.607 179.429 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.53 ' HB3' ' CB ' ' A' ' 47' ' ' ASP . 86.6 mt-30 84.33 114.01 0.05 Allowed 'General case' 0 C--N 1.298 -1.634 1 O-C-N 131.622 5.576 . . . . 10.0 108.393 -179.679 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 3.2 t -53.56 135.13 15.86 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.726 0 CA-C-N 113.023 -1.899 . . . . 10.0 107.369 179.573 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 63.04 70.5 1.03 Allowed Glycine 0 CA--C 1.53 1.014 0 CA-C-O 117.724 -1.598 . . . . 10.0 116.677 -179.756 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 5.6 tttp -179.43 148.45 0.35 Allowed 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 123.724 1.726 . . . . 10.0 113.715 179.617 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -97.18 133.37 41.91 Favored 'General case' 0 C--O 1.24 0.555 0 CA-C-N 113.129 -1.85 . . . . 10.0 109.662 -179.882 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.482 ' CZ ' ' HA ' ' A' ' 64' ' ' PHE . 1.0 OUTLIER -146.27 103.29 3.69 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 119.205 0.911 . . . . 10.0 111.345 -179.5 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.12 126.09 26.17 Favored 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 106.325 -1.731 . . . . 10.0 106.325 -179.77 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -109.72 96.07 6.02 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 112.407 0.521 . . . . 10.0 112.407 179.93 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -76.65 81.07 3.3 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 105.48 -2.044 . . . . 10.0 105.48 179.992 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.5 mp -67.43 120.94 14.74 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-N 112.479 -2.146 . . . . 10.0 113.248 179.946 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 1.2 t -159.83 100.18 1.42 Allowed 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 105.619 -1.993 . . . . 10.0 105.619 -179.924 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -167.69 -46.26 0.03 OUTLIER Glycine 0 N--CA 1.443 -0.884 0 O-C-N 127.277 2.86 . . . . 10.0 111.384 179.932 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 16.0 mt -137.97 -71.53 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 N-CA-C 107.517 -1.29 . . . . 10.0 107.517 -179.994 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -76.41 -22.14 55.09 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 125.585 1.803 . . . . 10.0 113.063 -179.981 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 60.16 -162.63 0.26 Allowed 'General case' 0 N--CA 1.478 0.937 0 CA-C-O 116.903 -1.522 . . . . 10.0 112.136 179.984 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 12.4 ttm105 74.89 137.07 0.06 Allowed 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 121.023 1.738 . . . . 10.0 109.394 -179.678 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.51 164.22 12.35 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 107.874 -1.158 . . . . 10.0 107.874 -179.874 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -162.33 159.47 25.48 Favored 'General case' 0 C--O 1.218 -0.581 0 N-CA-C 105.561 -2.014 . . . . 10.0 105.561 -179.984 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 2.6 ttp -122.24 124.92 44.92 Favored 'General case' 0 N--CA 1.448 -0.554 1 N-CA-C 99.066 -4.42 . . . . 10.0 99.066 -179.838 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 84' ' ' THR . . . . . 0.48 HG21 ' CZ ' ' A' ' 70' ' ' PHE . 1.1 m -124.77 137.66 54.31 Favored 'General case' 0 C--O 1.214 -0.77 0 N-CA-C 118.828 2.899 . . . . 10.0 118.828 -179.411 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -124.47 143.63 50.54 Favored 'General case' 0 CA--C 1.502 -0.9 0 N-CA-C 104.793 -2.299 . . . . 10.0 104.793 -179.754 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 3.0 m -123.55 146.62 28.66 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 N-CA-C 102.279 -3.23 . . . . 10.0 102.279 179.932 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 6.0 p -143.91 104.24 4.13 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 113.942 -1.481 . . . . 10.0 111.01 179.965 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 13.8 p-90 -61.74 137.75 58.27 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 104.987 -2.227 . . . . 10.0 104.987 -179.876 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -102.63 -54.91 2.55 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 102.624 -3.102 . . . . 10.0 102.624 179.794 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -168.94 -86.2 0.06 OUTLIER Glycine 0 CA--C 1.501 -0.836 0 N-CA-C 107.023 -2.431 . . . . 10.0 107.023 -179.912 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -102.49 14.0 33.08 Favored 'General case' 0 N--CA 1.446 -0.634 0 O-C-N 124.748 0.911 . . . . 10.0 112.566 -179.884 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -136.65 174.29 10.78 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 123.627 1.679 . . . . 10.0 108.633 -179.86 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -144.85 136.75 25.77 Favored 'General case' 0 C--O 1.216 -0.658 0 CA-C-N 114.549 -1.205 . . . . 10.0 107.949 179.847 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -126.18 149.23 49.15 Favored 'General case' 0 C--O 1.212 -0.906 0 CA-C-N 115.446 -0.797 . . . . 10.0 113.101 179.993 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -139.2 122.83 17.43 Favored 'General case' 0 C--N 1.321 -0.658 0 O-C-N 125.594 1.809 . . . . 10.0 113.219 179.85 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 14.1 t -111.68 113.93 45.6 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 N-CA-C 106.212 -1.773 . . . . 10.0 106.212 179.727 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -90.81 79.96 5.91 Favored 'General case' 0 C--O 1.245 0.826 0 O-C-N 125.118 1.511 . . . . 10.0 108.002 -179.949 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 24.5 ttpp -75.94 89.12 2.93 Favored 'General case' 0 CA--C 1.521 -0.159 0 C-N-CA 124.98 1.312 . . . . 10.0 113.352 -179.919 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -119.91 -65.28 0.27 Allowed Glycine 0 N--CA 1.436 -1.304 0 C-N-CA 125.498 1.523 . . . . 10.0 110.881 179.968 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -148.41 -32.18 0.25 Allowed 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 115.693 1.738 . . . . 10.0 115.693 -179.892 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 61.3 mmtt -80.1 -175.82 5.22 Favored 'General case' 0 C--O 1.215 -0.722 0 N-CA-C 115.115 1.524 . . . . 10.0 115.115 -179.856 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -105.88 -29.48 9.97 Favored 'General case' 0 N--CA 1.452 -0.358 0 O-C-N 125.833 1.958 . . . . 10.0 114.628 179.961 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -113.2 -18.62 7.12 Favored Glycine 0 N--CA 1.465 0.63 0 CA-C-O 118.411 -1.216 . . . . 10.0 115.825 -179.911 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -48.16 109.14 0.2 Allowed 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 120.329 2.065 . . . . 10.0 113.216 -179.918 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 177.55 149.13 7.69 Favored Glycine 0 N--CA 1.448 -0.554 0 N-CA-C 109.539 -1.424 . . . . 10.0 109.539 -179.688 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 9.3 m0 -111.21 121.18 44.62 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 118.708 1.254 . . . . 10.0 109.949 -179.987 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 60.2 m -104.59 108.9 20.58 Favored 'General case' 0 CA--C 1.499 -1.005 0 O-C-N 123.924 0.765 . . . . 10.0 109.259 179.586 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 -88.37 156.52 19.1 Favored 'General case' 0 C--O 1.245 0.835 0 C-N-CA 124.909 1.284 . . . . 10.0 108.237 179.719 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 109' ' ' TRP . . . . . 0.428 ' CD1' ' C ' ' A' ' 109' ' ' TRP . 2.4 t90 -175.46 104.65 0.08 Allowed 'General case' 0 C--O 1.215 -0.741 0 O-C-N 121.306 -0.872 . . . . 10.0 109.141 179.771 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 5.1 mt -78.49 146.47 8.08 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 125.799 2.714 . . . . 10.0 114.519 179.79 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -133.68 78.77 1.79 Allowed 'General case' 0 C--O 1.222 -0.366 0 CA-C-N 113.579 -1.646 . . . . 10.0 108.226 -179.779 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 73.62 -101.89 1.23 Allowed Glycine 0 N--CA 1.449 -0.443 0 N-CA-C 108.22 -1.952 . . . . 10.0 108.22 179.889 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -112.88 21.98 14.92 Favored 'General case' 0 C--O 1.214 -0.797 0 O-C-N 124.928 1.016 . . . . 10.0 109.596 179.889 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -127.71 139.92 52.39 Favored 'General case' 0 C--O 1.216 -0.683 0 CA-C-O 122.64 1.209 . . . . 10.0 110.131 -179.829 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.494 HD13 ' CE2' ' A' ' 8' ' ' TRP . 0.2 OUTLIER -105.58 125.18 50.69 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 114.402 -1.272 . . . . 10.0 109.135 -179.988 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 40.1 t-80 -111.44 101.69 10.12 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 106.491 -1.67 . . . . 10.0 106.491 179.684 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 2.0 tt -112.7 126.3 55.24 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 122.415 1.102 . . . . 10.0 113.075 179.989 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -112.59 103.75 11.82 Favored 'General case' 0 CA--C 1.505 -0.781 0 O-C-N 119.891 -1.755 . . . . 10.0 108.272 179.951 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 1.4 ttm -94.23 161.29 14.32 Favored 'General case' 0 CA--C 1.509 -0.601 0 N-CA-C 108.184 -1.043 . . . . 10.0 108.184 -179.923 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 49.9 mtm180 -150.13 -177.37 5.89 Favored 'General case' 0 C--N 1.316 -0.874 0 C-N-CA 125.135 1.374 . . . . 10.0 114.348 179.915 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 165.67 129.92 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.493 0 O-C-N 128.141 3.401 . . . . 10.0 107.985 -179.989 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 53.51 36.21 22.7 Favored 'General case' 0 C--O 1.244 0.787 0 N-CA-C 114.813 1.412 . . . . 10.0 114.813 179.853 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 81.3 -6.69 63.01 Favored Glycine 0 CA--C 1.529 0.914 0 CA-C-O 116.052 -2.527 . . . . 10.0 114.671 -179.818 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -82.02 157.08 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 CA-C-N 119.041 1.421 . . . . 10.0 109.573 -179.854 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 3.5 m -127.5 114.17 17.1 Favored 'General case' 0 C--O 1.239 0.522 0 O-C-N 126.367 2.292 . . . . 10.0 113.074 179.781 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -120.57 151.86 38.86 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 105.908 -1.886 . . . . 10.0 105.908 -179.779 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.61 154.87 51.29 Favored 'General case' 0 C--O 1.224 -0.26 0 O-C-N 125.271 1.607 . . . . 10.0 113.114 -179.905 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -145.63 109.63 4.86 Favored 'General case' 0 C--N 1.323 -0.546 0 O-C-N 126.267 2.229 . . . . 10.0 108.378 179.662 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 16.9 t -91.22 140.37 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 N-CA-C 107.935 -1.135 . . . . 10.0 107.935 -179.613 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . 0.41 ' HB2' ' HB2' ' A' ' 115' ' ' LEU . 74.7 m-85 -123.84 169.44 11.57 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 119.221 -0.418 . . . . 10.0 111.008 179.721 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -141.48 124.74 16.48 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 105.789 -1.93 . . . . 10.0 105.789 -179.988 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . 0.537 ' HB2' ' CZ3' ' A' ' 8' ' ' TRP . 13.7 tttt -78.4 132.0 37.18 Favored 'General case' 0 C--N 1.324 -0.533 0 O-C-N 121.365 -0.834 . . . . 10.0 110.495 -179.893 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 2.2 t -107.31 -54.7 5.78 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 N-CA-C 115.009 1.485 . . . . 10.0 115.009 179.94 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 6.1 t-160 . . . . . 0 C--O 1.252 1.216 0 CA-C-O 117.143 -1.408 . . . . 10.0 113.37 -179.907 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 . . . . . 0 CA--C 1.534 0.341 0 N-CA-C 113.569 0.952 . . . . 10.0 113.569 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 26.5 m-85 -40.14 -22.56 0.01 OUTLIER 'General case' 0 C--O 1.245 0.819 0 N-CA-C 117.844 2.535 . . . . 10.0 117.844 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -49.05 104.77 0.07 Allowed 'General case' 0 N--CA 1.475 0.775 0 O-C-N 125.738 1.899 . . . . 10.0 111.248 179.925 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -152.21 -163.44 11.57 Favored Glycine 0 N--CA 1.449 -0.458 0 N-CA-C 118.194 2.038 . . . . 10.0 118.194 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -135.31 110.85 9.17 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 100.843 -3.762 . . . . 10.0 100.843 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.604 ' CE2' HD21 ' A' ' 115' ' ' LEU . 46.5 m0 -112.63 116.43 30.17 Favored 'General case' 0 CA--C 1.506 -0.747 0 O-C-N 124.095 0.872 . . . . 10.0 112.373 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.78 148.63 22.42 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 117.658 -1.163 . . . . 10.0 107.946 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 2.6 mtt -86.03 128.66 34.9 Favored 'General case' 0 C--N 1.314 -0.942 0 O-C-N 126.671 2.482 . . . . 10.0 111.411 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.436 HD23 ' HA ' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -104.5 -53.12 2.77 Favored 'General case' 0 C--N 1.317 -0.813 0 O-C-N 124.914 1.384 . . . . 10.0 108.053 179.809 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -118.09 -172.36 2.24 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 113.53 0.937 . . . . 10.0 113.53 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 177.43 104.97 0.02 OUTLIER 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 106.655 -1.609 . . . . 10.0 106.655 179.658 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -107.2 151.13 25.83 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 116.551 2.056 . . . . 10.0 116.551 -179.793 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 34.03 34.33 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 116.647 2.091 . . . . 10.0 116.647 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -71.04 -29.99 66.05 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 115.554 1.687 . . . . 10.0 115.554 -179.751 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -75.38 -36.38 60.91 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 121.197 -0.939 . . . . 10.0 111.641 179.721 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -74.49 -23.45 58.86 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 107.785 -1.191 . . . . 10.0 107.785 -179.693 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.443 ' CZ ' HD11 ' A' ' 23' ' ' LEU . 2.4 t80 -69.36 -34.81 75.13 Favored 'General case' 0 CA--C 1.552 1.054 0 N-CA-C 108.492 -0.929 . . . . 10.0 108.492 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 34.6 mt -79.0 -28.84 43.44 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 108.821 -0.807 . . . . 10.0 108.821 179.313 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.6 ttt180 -73.83 -35.96 64.87 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 114.312 -1.313 . . . . 10.0 108.65 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.29 -33.65 71.81 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 126.695 2.497 . . . . 10.0 110.879 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.443 HD11 ' CZ ' ' A' ' 19' ' ' TYR . 6.7 mt -91.32 5.38 49.46 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 115.179 -0.919 . . . . 10.0 109.124 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 52.72 38.09 25.4 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 116.707 2.114 . . . . 10.0 116.707 -179.751 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 1.4 m -79.79 179.11 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 N-CA-C 106.036 -1.839 . . . . 10.0 106.036 179.561 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -72.35 159.49 33.94 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 117.462 2.393 . . . . 10.0 117.462 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.0 m -72.64 -35.46 50.61 Favored 'Isoleucine or valine' 0 C--O 1.242 0.668 0 C-N-CA 125.735 1.614 . . . . 10.0 112.836 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.72 -28.19 64.55 Favored 'General case' 0 N--CA 1.445 -0.724 0 O-C-N 120.286 -1.509 . . . . 10.0 111.558 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 22.9 tp -69.32 -45.23 70.02 Favored 'General case' 0 C--O 1.216 -0.705 0 CA-C-N 114.477 -1.238 . . . . 10.0 110.392 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.17 -20.44 61.59 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-N 113.107 -1.86 . . . . 10.0 112.333 179.854 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.75 -47.4 47.14 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 118.894 -2.379 . . . . 10.0 109.534 -179.93 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.1 mm -78.95 -44.7 24.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 O-C-N 126.803 2.564 . . . . 10.0 111.21 -179.54 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -55.88 -35.16 66.21 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 116.486 2.032 . . . . 10.0 116.486 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -67.51 -55.4 13.68 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 121.845 2.111 . . . . 10.0 115.668 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -54.57 -21.11 9.35 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-O 117.329 -1.319 . . . . 10.0 112.872 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 25.2 mt -90.55 161.32 15.52 Favored 'General case' 0 CA--C 1.503 -0.861 0 CA-C-O 123.204 1.478 . . . . 10.0 114.841 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.1 mttp -154.29 109.79 2.43 Favored Pre-proline 0 N--CA 1.472 0.646 0 N-CA-C 104.408 -2.441 . . . . 10.0 104.408 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.482 ' HB2' HG22 ' A' ' 53' ' ' THR . 72.5 Cg_endo -81.29 136.92 10.29 Favored 'Trans proline' 0 CA--C 1.535 0.568 0 C-N-CA 123.044 2.496 . . . . 10.0 116.802 179.791 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -91.01 121.79 33.12 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 118.019 -1.472 . . . . 10.0 107.701 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.1 ttpt -84.44 158.78 20.95 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-O 118.654 -0.689 . . . . 10.0 110.399 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -153.87 125.2 7.47 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 105.586 -2.005 . . . . 10.0 105.586 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.496 HD11 ' CZ3' ' A' ' 8' ' ' TRP . 7.9 mt -103.88 143.52 15.6 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.013 0 CA-C-N 120.076 1.307 . . . . 10.0 114.099 -179.761 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 35.7 t -136.97 138.16 46.17 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 N-CA-C 104.672 -2.344 . . . . 10.0 104.672 179.775 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -152.85 117.3 4.97 Favored 'General case' 0 C--N 1.312 -1.052 0 C-N-CA 124.784 1.234 . . . . 10.0 110.13 -179.782 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.58 -41.56 26.89 Favored 'General case' 0 C--N 1.321 -0.661 0 O-C-N 119.691 -1.881 . . . . 10.0 108.199 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -174.66 -92.11 0.08 OUTLIER Glycine 0 C--O 1.24 0.522 0 N-CA-C 106.76 -2.536 . . . . 10.0 106.76 -179.764 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -98.33 17.95 17.56 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 119.299 1.549 . . . . 10.0 109.935 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' HIS . . . . . 0.445 ' CE1' ' CG1' ' A' ' 50' ' ' ILE . 3.5 t60 -129.15 121.73 28.34 Favored 'General case' 0 C--O 1.214 -0.766 0 N-CA-C 105.439 -2.06 . . . . 10.0 105.439 179.721 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 7.2 ttp -121.03 133.44 55.25 Favored 'General case' 0 N--CA 1.443 -0.8 0 O-C-N 126.033 2.083 . . . . 10.0 112.759 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.445 ' CG1' ' CE1' ' A' ' 48' ' ' HIS . 19.3 mt -116.3 120.41 64.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 107.661 -1.237 . . . . 10.0 107.661 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -98.28 109.49 23.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 104.75 -2.315 . . . . 10.0 104.75 179.726 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 4.2 mtt180 -106.54 128.95 54.52 Favored 'General case' 0 N--CA 1.434 -1.265 0 C-N-CA 123.397 0.679 . . . . 10.0 112.112 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.482 HG22 ' HB2' ' A' ' 38' ' ' PRO . 0.2 OUTLIER -125.39 137.91 54.02 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 100.563 -3.865 . . . . 10.0 100.563 179.859 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.3 mp -125.92 92.64 3.63 Favored 'General case' 0 N--CA 1.449 -0.482 1 N-CA-C 123.409 4.596 . . . . 10.0 123.409 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 3.4 p -123.19 144.02 49.64 Favored 'General case' 0 C--N 1.315 -0.931 0 O-C-N 125.958 2.036 . . . . 10.0 105.531 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -69.35 -16.48 63.54 Favored 'General case' 0 C--O 1.22 -0.48 0 CA-C-O 123.209 1.48 . . . . 10.0 107.571 179.742 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -93.36 108.79 20.38 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 107.255 -1.387 . . . . 10.0 107.255 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 15.4 tpp180 36.64 91.87 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 O-C-N 126.074 2.109 . . . . 10.0 114.742 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ASN . . . . . 0.432 ' HB2' HD11 ' A' ' 61' ' ' ILE . 0.6 OUTLIER -48.79 122.12 5.35 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-O 123.64 1.686 . . . . 10.0 110.631 179.986 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -102.01 78.13 1.76 Allowed 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 112.87 -1.968 . . . . 10.0 107.959 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.432 HD11 ' HB2' ' A' ' 59' ' ' ASN . 1.4 mm -106.77 133.5 51.15 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 C-N-CA 120.424 -0.51 . . . . 10.0 109.993 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -129.99 151.46 50.52 Favored 'General case' 0 C--N 1.317 -0.834 0 C-N-CA 125.742 1.617 . . . . 10.0 108.378 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -127.33 152.81 46.97 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 101.363 -3.569 . . . . 10.0 101.363 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 4.9 m-30 -146.39 167.89 22.49 Favored 'General case' 0 C--O 1.246 0.911 0 N-CA-C 116.062 1.875 . . . . 10.0 116.062 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 40.2 mm-40 -137.01 117.14 13.39 Favored 'General case' 0 N--CA 1.437 -1.118 0 N-CA-C 104.412 -2.44 . . . . 10.0 104.412 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 47.1 t -73.73 132.25 33.68 Favored 'Isoleucine or valine' 0 C--O 1.241 0.639 0 CA-C-N 115.133 -0.939 . . . . 10.0 112.021 -179.616 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 77.86 -10.42 25.74 Favored Glycine 0 N--CA 1.437 -1.263 0 C-N-CA 125.299 1.428 . . . . 10.0 116.032 -179.761 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.6 tmtt? -113.25 126.48 55.45 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 114.514 -0.843 . . . . 10.0 112.218 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -41.82 141.15 0.87 Allowed 'General case' 0 C--N 1.32 -0.681 0 O-C-N 127.604 3.065 . . . . 10.0 112.789 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -124.15 151.34 44.1 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 113.912 -1.494 . . . . 10.0 113.248 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -126.49 151.81 47.31 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 105.994 -1.854 . . . . 10.0 105.994 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -143.32 145.5 32.75 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 117.201 2.297 . . . . 10.0 117.201 -179.88 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -129.81 124.05 32.4 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 121.487 0.661 . . . . 10.0 109.372 -179.82 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.492 HD13 HG12 ' A' ' 77' ' ' ILE . 80.5 mt -121.52 139.86 52.95 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 123.906 0.882 . . . . 10.0 111.751 -179.707 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.91 4.46 4.16 Favored 'General case' 0 N--CA 1.443 -0.8 0 O-C-N 120.649 -1.282 . . . . 10.0 109.631 -179.762 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -121.48 -21.23 3.07 Favored Glycine 0 CA--C 1.53 0.986 0 CA-C-O 117.892 -1.504 . . . . 10.0 110.858 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.656 HD13 ' N ' ' A' ' 77' ' ' ILE . 0.0 OUTLIER -124.43 120.17 58.37 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.687 0 CA-C-O 116.4 -1.762 . . . . 10.0 108.011 -179.868 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 3.4 p30 28.5 34.34 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.86 0 O-C-N 126.646 2.466 . . . . 10.0 114.027 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -4.56 81.13 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 127.68 2.392 . . . . 10.0 116.367 -179.592 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.9 158.23 44.91 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 113.095 -1.866 . . . . 10.0 110.265 -179.688 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -120.18 137.59 54.09 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 103.815 -2.661 . . . . 10.0 103.815 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 7.2 p -140.57 166.71 24.0 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.408 -1.269 . . . . 10.0 109.656 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -110.38 116.42 31.4 Favored 'General case' 0 N--CA 1.439 -0.995 1 N-CA-C 99.047 -4.427 . . . . 10.0 99.047 179.878 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 31.9 m -117.49 138.28 51.98 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 123.266 1.508 . . . . 10.0 114.329 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 20.7 m -127.51 123.49 36.01 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 106.238 -1.764 . . . . 10.0 106.238 -179.734 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 2.6 m -104.63 123.36 58.55 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.661 0 N-CA-C 102.647 -3.094 . . . . 10.0 102.647 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -137.97 178.37 7.17 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 122.724 1.25 . . . . 10.0 110.603 -179.834 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 4.0 p-90 -123.45 109.33 13.71 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 104.288 -2.486 . . . . 10.0 104.288 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -72.55 -55.09 7.47 Favored 'General case' 0 C--N 1.314 -0.974 1 N-CA-C 99.014 -4.439 . . . . 10.0 99.014 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -149.13 -117.57 0.89 Allowed Glycine 0 C--O 1.246 0.849 0 N-CA-C 105.505 -3.038 . . . . 10.0 105.505 -179.552 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -97.99 49.77 1.02 Allowed 'General case' 0 N--CA 1.461 0.115 0 C-N-CA 118.447 -1.301 . . . . 10.0 111.374 179.555 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.3 mtmm -147.14 -168.95 3.18 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 124.436 1.094 . . . . 10.0 109.181 -179.712 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -142.58 151.3 41.4 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 105.819 -1.919 . . . . 10.0 105.819 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 17.5 mt-30 -147.23 150.2 34.39 Favored 'General case' 0 C--O 1.215 -0.743 0 C-N-CA 124.595 1.158 . . . . 10.0 112.256 179.462 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -138.85 127.95 23.97 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-N 114.517 -1.22 . . . . 10.0 112.882 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 9.1 p -110.11 97.66 6.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 C-N-CA 123.992 0.917 . . . . 10.0 108.955 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -73.89 81.99 1.67 Allowed 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 105.675 -1.972 . . . . 10.0 105.675 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -71.64 97.45 1.73 Allowed 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 114.3 1.222 . . . . 10.0 114.3 -179.601 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -162.16 -155.26 7.89 Favored Glycine 0 C--N 1.315 -0.604 0 O-C-N 126.104 2.128 . . . . 10.0 110.621 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -64.96 -171.68 0.07 Allowed 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 120.639 0.256 . . . . 10.0 111.657 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 15.2 mmtm 74.97 162.49 0.25 Allowed 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 114.774 1.398 . . . . 10.0 114.774 -179.721 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -93.41 -32.84 14.08 Favored 'General case' 0 C--O 1.213 -0.824 0 CA-C-O 122.95 1.357 . . . . 10.0 112.446 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -130.78 80.86 0.34 Allowed Glycine 0 C--O 1.221 -0.719 0 C-N-CA 125.391 1.472 . . . . 10.0 115.392 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.49 126.11 46.13 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-O 123.571 1.653 . . . . 10.0 108.681 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 145.0 154.97 6.29 Favored Glycine 0 C--N 1.336 0.528 0 CA-C-O 117.834 -1.537 . . . . 10.0 109.709 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' TRP . . . . . 0.492 ' CD1' ' HG2' ' A' ' 119' ' ' MET . 2.9 m0 -115.81 161.19 19.11 Favored 'General case' 0 C--N 1.314 -0.968 0 O-C-N 127.118 2.305 . . . . 10.0 108.952 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 51.1 m -133.54 130.5 38.54 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 104.974 -2.232 . . . . 10.0 104.974 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -118.09 162.48 18.13 Favored 'General case' 0 C--N 1.318 -0.784 0 O-C-N 127.257 2.848 . . . . 10.0 111.6 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' TRP . . . . . 0.46 ' CD1' ' C ' ' A' ' 109' ' ' TRP . 0.0 OUTLIER 176.99 157.53 0.31 Allowed 'General case' 0 CA--C 1.5 -0.947 0 CA-C-N 114.354 -1.294 . . . . 10.0 107.613 -179.995 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 66.8 mt -121.62 130.88 74.21 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 CA-C-N 115.857 -0.61 . . . . 10.0 111.429 -179.782 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -111.12 58.99 0.61 Allowed 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 124.136 1.922 . . . . 10.0 107.93 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 77.22 -94.45 1.13 Allowed Glycine 0 CA--C 1.504 -0.634 0 O-C-N 120.478 -1.389 . . . . 10.0 110.739 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -102.93 4.75 37.89 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 114.271 1.211 . . . . 10.0 114.271 -179.659 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -142.45 139.83 31.73 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 124.013 1.863 . . . . 10.0 115.041 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.604 HD21 ' CE2' ' A' ' 8' ' ' TRP . 4.3 mm? -83.32 144.51 29.64 Favored 'General case' 0 N--CA 1.441 -0.905 0 CA-C-N 112.718 -2.037 . . . . 10.0 109.684 -179.751 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 8.4 m-70 -131.67 67.66 1.51 Allowed 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 113.319 -1.764 . . . . 10.0 107.375 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.93 154.07 20.8 Favored 'General case' 0 C--N 1.317 -0.82 0 O-C-N 125.06 1.475 . . . . 10.0 113.441 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -135.99 135.63 39.67 Favored 'General case' 0 CA--C 1.502 -0.896 0 N-CA-C 107.352 -1.351 . . . . 10.0 107.352 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.492 ' HG2' ' CD1' ' A' ' 106' ' ' TRP . 3.6 mtt -125.61 123.11 38.3 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-O 123.391 1.567 . . . . 10.0 111.784 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.09 158.29 23.4 Favored 'General case' 0 N--CA 1.443 -0.791 0 O-C-N 119.958 -1.714 . . . . 10.0 112.834 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 121' ' ' ALA . . . . . 0.567 ' O ' HG22 ' A' ' 124' ' ' VAL . . . -169.34 103.69 0.36 Allowed 'General case' 0 CA--C 1.515 -0.368 0 O-C-N 120.935 -1.103 . . . . 10.0 108.382 -179.845 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 73.47 13.21 4.57 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.397 1.879 . . . . 10.0 116.029 -179.855 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 107.81 13.75 19.27 Favored Glycine 0 CA--C 1.535 1.301 0 CA-C-O 116.144 -2.476 . . . . 10.0 116.326 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.567 HG22 ' O ' ' A' ' 121' ' ' ALA . 2.7 m -112.91 93.97 2.85 Favored 'Isoleucine or valine' 0 C--O 1.242 0.679 0 CA-C-N 119.869 1.834 . . . . 10.0 113.554 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -78.91 109.94 13.66 Favored 'General case' 0 C--N 1.317 -0.811 0 O-C-N 125.852 1.97 . . . . 10.0 113.809 -179.851 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -106.57 151.52 24.91 Favored 'General case' 0 N--CA 1.463 0.202 0 N-CA-C 105.02 -2.215 . . . . 10.0 105.02 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 9.0 mtpp -132.84 150.44 52.16 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 119.111 -1.035 . . . . 10.0 111.949 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 20.8 mt-30 -138.61 106.66 5.71 Favored 'General case' 0 C--N 1.316 -0.876 0 O-C-N 121.759 -0.588 . . . . 10.0 110.9 -179.735 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.543 HG22 ' O ' ' A' ' 115' ' ' LEU . 1.1 t -89.64 127.54 42.21 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 C-N-CA 118.611 -1.236 . . . . 10.0 109.126 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -108.38 167.06 10.3 Favored 'General case' 0 N--CA 1.445 -0.716 0 C-N-CA 125.309 1.443 . . . . 10.0 110.199 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -127.23 107.56 10.11 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 106.785 -1.561 . . . . 10.0 106.785 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 132' ' ' LYS . . . . . 0.46 ' HG3' ' CD1' ' A' ' 8' ' ' TRP . 21.3 tttt -56.26 109.88 0.67 Allowed 'General case' 0 C--O 1.221 -0.396 0 CA-C-N 119.726 1.148 . . . . 10.0 108.155 179.811 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 16.1 m -103.42 50.58 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.506 -0.724 0 C-N-CA 124.964 1.306 . . . . 10.0 110.94 179.703 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 2.1 t60 . . . . . 0 C--N 1.315 -0.922 0 O-C-N 121.569 -0.707 . . . . 10.0 109.767 179.96 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 . . . . . 0 CA--C 1.536 0.441 0 CA-C-O 116.54 -1.695 . . . . 10.0 112.972 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.595 ' CE1' HD12 ' A' ' 93' ' ' LEU . 0.7 OUTLIER -20.52 -52.49 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.779 0 O-C-N 126.313 2.258 . . . . 10.0 116.606 179.681 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.419 ' HA ' HG22 ' A' ' 42' ' ' ILE . 3.9 p-10 -53.12 110.56 0.55 Allowed 'General case' 0 N--CA 1.484 1.25 0 O-C-N 125.2 1.562 . . . . 10.0 112.404 179.76 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -152.75 171.08 31.87 Favored Glycine 0 N--CA 1.464 0.503 0 C-N-CA 118.507 -1.806 . . . . 10.0 115.748 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -92.65 87.45 5.91 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 101.355 -3.572 . . . . 10.0 101.355 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.53 ' CH2' HD11 ' A' ' 115' ' ' LEU . 38.7 m0 -89.55 112.63 23.88 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 123.282 1.515 . . . . 10.0 114.24 179.816 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 18.8 pttp -98.05 138.62 35.08 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 103.908 -2.627 . . . . 10.0 103.908 179.855 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.27 150.23 22.71 Favored 'General case' 0 C--N 1.313 -0.981 0 N-CA-C 114.115 1.154 . . . . 10.0 114.115 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.2 tt -113.34 -55.15 2.55 Favored 'General case' 0 C--O 1.242 0.696 0 CA-C-O 118.293 -0.86 . . . . 10.0 109.666 -179.645 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.4 p -167.99 133.09 1.83 Allowed 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 116.33 1.974 . . . . 10.0 116.33 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -90.4 165.89 13.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 111.173 -2.74 . . . . 10.0 105.715 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -124.13 -57.26 1.61 Allowed 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 120.549 1.522 . . . . 10.0 111.293 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -112.4 51.07 0.83 Allowed 'General case' 0 C--N 1.328 -0.342 0 O-C-N 126.592 2.432 . . . . 10.0 113.148 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 6.4 t80 -76.3 -28.57 57.04 Favored 'General case' 0 CA--C 1.546 0.799 0 O-C-N 118.889 -2.382 . . . . 10.0 110.133 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -79.26 -42.4 25.96 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 125.799 1.937 . . . . 10.0 112.0 179.694 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -74.79 -20.56 59.74 Favored 'General case' 0 C--O 1.22 -0.478 0 O-C-N 121.418 -0.801 . . . . 10.0 108.85 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 14.2 t80 -67.1 -39.86 86.81 Favored 'General case' 0 CA--C 1.548 0.88 0 CA-C-O 122.583 1.183 . . . . 10.0 110.074 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 34.9 mt -75.33 -40.33 58.49 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 122.385 1.088 . . . . 10.0 109.643 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.4 ttm180 -68.41 -27.2 65.99 Favored 'General case' 0 C--O 1.241 0.657 0 C-N-CA 125.415 1.486 . . . . 10.0 109.231 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.56 -26.36 59.9 Favored 'General case' 0 C--O 1.221 -0.432 0 O-C-N 124.664 1.228 . . . . 10.0 109.239 -179.57 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 79.0 mt -99.12 -15.26 19.05 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 124.756 1.223 . . . . 10.0 109.514 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 61.67 61.74 1.4 Allowed 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 116.424 2.009 . . . . 10.0 116.424 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.606 HG13 ' HA ' ' A' ' 78' ' ' ASP . 0.2 OUTLIER -88.33 -150.11 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.245 0.838 0 N-CA-C 104.892 -2.262 . . . . 10.0 104.892 -179.7 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.413 ' N ' ' OD1' ' A' ' 26' ' ' ASN . 0.0 OUTLIER -96.27 162.37 13.54 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 120.639 1.563 . . . . 10.0 113.786 -179.908 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.9 t -70.36 -39.33 76.41 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 O-C-N 125.735 1.897 . . . . 10.0 114.261 -179.694 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -71.56 -29.99 65.36 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 113.473 0.916 . . . . 10.0 113.473 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.74 -29.25 58.8 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 124.903 1.281 . . . . 10.0 111.455 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.05 -33.42 67.95 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 113.252 0.834 . . . . 10.0 113.252 179.726 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -72.21 -41.42 66.95 Favored 'General case' 0 N--CA 1.451 -0.423 0 O-C-N 125.813 1.946 . . . . 10.0 109.387 -179.402 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.555 HG21 ' CZ ' ' A' ' 57' ' ' PHE . 46.5 mm -73.58 -60.03 2.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 O-C-N 120.879 -1.138 . . . . 10.0 108.175 -179.556 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -46.32 -26.77 0.88 Allowed 'General case' 0 C--N 1.318 -0.771 0 O-C-N 125.026 1.454 . . . . 10.0 114.79 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -81.96 -16.98 48.6 Favored 'General case' 0 C--N 1.327 -0.37 0 O-C-N 124.448 1.092 . . . . 10.0 111.061 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -87.6 -15.83 36.24 Favored 'General case' 0 N--CA 1.441 -0.877 0 O-C-N 121.064 -1.023 . . . . 10.0 110.744 -179.779 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.67 172.97 8.41 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.518 -0.919 . . . . 10.0 108.518 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.5 ptpt -152.37 135.52 9.43 Favored Pre-proline 0 N--CA 1.474 0.77 0 N-CA-C 106.292 -1.744 . . . . 10.0 106.292 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -74.29 107.28 2.41 Favored 'Trans proline' 0 N--CA 1.448 -1.151 1 C-N-CA 126.532 4.822 . . . . 10.0 119.064 -179.758 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -82.38 149.02 27.92 Favored 'General case' 0 C--O 1.239 0.526 0 N-CA-C 105.778 -1.934 . . . . 10.0 105.778 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 28.6 mttp -121.36 155.91 33.76 Favored 'General case' 0 C--O 1.214 -0.811 0 O-C-N 120.48 -1.388 . . . . 10.0 109.671 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -143.37 105.01 4.32 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 102.907 -2.997 . . . . 10.0 102.907 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.419 HG22 ' HA ' ' A' ' 5' ' ' ASN . 1.3 mt -100.41 149.29 6.13 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.921 0 C-N-CA 117.679 -1.608 . . . . 10.0 111.525 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 45.4 t -138.34 145.42 28.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 113.594 -1.639 . . . . 10.0 107.694 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -139.01 128.08 23.83 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 113.538 -1.664 . . . . 10.0 112.005 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -103.55 -49.8 3.6 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 104.202 -2.518 . . . . 10.0 104.202 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -164.18 -113.15 0.28 Allowed Glycine 0 C--O 1.246 0.893 0 N-CA-C 106.466 -2.653 . . . . 10.0 106.466 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -75.17 -20.22 59.45 Favored 'General case' 0 C--O 1.215 -0.722 0 O-C-N 120.317 -1.696 . . . . 10.0 110.816 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.4 m170 -91.7 130.78 37.43 Favored 'General case' 0 N--CA 1.439 -0.982 0 CA-C-N 114.99 -1.005 . . . . 10.0 110.017 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.477 ' HG2' ' CD1' ' A' ' 51' ' ' ILE . 2.5 ttp -121.42 149.54 42.86 Favored 'General case' 0 N--CA 1.435 -1.181 0 O-C-N 125.761 1.913 . . . . 10.0 111.568 -179.659 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 19.9 mt -130.16 123.64 56.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 105.835 -1.913 . . . . 10.0 105.835 -179.808 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.477 ' CD1' ' HG2' ' A' ' 49' ' ' MET . 1.6 mp -110.05 128.18 66.4 Favored 'Isoleucine or valine' 0 C--O 1.24 0.578 0 N-CA-C 106.07 -1.826 . . . . 10.0 106.07 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.6 mmm180 -116.32 106.56 13.79 Favored 'General case' 0 N--CA 1.435 -1.221 0 CA-C-O 118.533 -0.746 . . . . 10.0 110.59 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.476 ' C ' HD12 ' A' ' 54' ' ' LEU . 65.3 m -91.52 129.87 37.43 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 102.126 -3.287 . . . . 10.0 102.126 -179.707 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.476 HD12 ' C ' ' A' ' 53' ' ' THR . 6.0 mp -127.37 86.5 2.5 Favored 'General case' 0 N--CA 1.441 -0.881 0 N-CA-C 119.353 3.094 . . . . 10.0 119.353 -179.811 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 7.1 m -108.42 132.67 53.53 Favored 'General case' 0 N--CA 1.443 -0.782 0 C-N-CA 125.491 1.517 . . . . 10.0 107.504 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.7 p -56.83 -24.73 53.2 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-O 123.021 1.391 . . . . 10.0 107.753 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.555 ' CZ ' HG21 ' A' ' 32' ' ' ILE . 1.2 t80 -87.0 -135.07 0.08 Allowed 'General case' 0 C--O 1.239 0.545 0 N-CA-C 106.782 -1.562 . . . . 10.0 106.782 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.69 140.21 44.02 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 118.868 -1.133 . . . . 10.0 113.723 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -138.14 144.06 40.62 Favored 'General case' 0 N--CA 1.466 0.367 0 O-C-N 125.851 1.97 . . . . 10.0 111.714 179.719 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 1.5 p90 -129.34 134.57 47.97 Favored 'General case' 0 C--O 1.217 -0.643 0 N-CA-C 105.449 -2.056 . . . . 10.0 105.449 -179.817 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 1.4 mp -97.28 119.5 45.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 124.327 2.013 . . . . 10.0 109.286 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -118.39 144.4 45.95 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-N 112.497 -2.138 . . . . 10.0 106.654 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -132.11 114.3 14.35 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 100.467 -3.901 . . . . 10.0 100.467 -179.834 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -102.55 177.38 4.88 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 117.429 2.381 . . . . 10.0 117.429 -179.738 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 15.9 mm-40 -144.1 105.58 4.27 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 103.095 -2.928 . . . . 10.0 103.095 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 47.8 t -62.81 119.43 6.78 Favored 'Isoleucine or valine' 0 C--O 1.243 0.744 0 CA-C-O 122.738 1.256 . . . . 10.0 113.106 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.12 37.28 63.89 Favored Glycine 0 CA--C 1.533 1.188 0 N-CA-C 117.117 1.607 . . . . 10.0 117.117 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.21 13.84 3.54 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 119.426 -0.91 . . . . 10.0 112.473 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 65.85 150.61 0.05 OUTLIER 'General case' 0 C--N 1.32 -0.706 0 O-C-N 125.656 1.847 . . . . 10.0 112.338 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -149.63 114.92 5.48 Favored 'General case' 0 C--O 1.243 0.714 0 CA-C-O 121.18 0.514 . . . . 10.0 111.665 179.76 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -87.07 89.93 8.18 Favored 'General case' 0 C--O 1.217 -0.612 0 N-CA-C 107.688 -1.227 . . . . 10.0 107.688 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -68.52 170.65 8.71 Favored 'General case' 0 C--N 1.319 -0.723 0 O-C-N 126.328 2.267 . . . . 10.0 115.625 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -150.02 62.66 0.98 Allowed 'General case' 0 N--CA 1.441 -0.91 0 N-CA-C 106.475 -1.676 . . . . 10.0 106.475 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.827 HD12 HG22 ' A' ' 77' ' ' ILE . 3.5 mm? -50.0 145.91 5.24 Favored 'General case' 0 N--CA 1.438 -1.034 0 N-CA-C 113.267 0.84 . . . . 10.0 113.267 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 62.2 m -156.1 92.67 1.36 Allowed 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.368 -0.833 . . . . 10.0 109.08 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 144.54 -43.85 0.94 Allowed Glycine 0 N--CA 1.434 -1.47 0 CA-C-O 117.072 -1.96 . . . . 10.0 112.097 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.827 HG22 HD12 ' A' ' 74' ' ' LEU . 0.3 OUTLIER -99.59 66.74 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.467 0 CA-C-N 118.961 1.38 . . . . 10.0 108.66 179.976 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.606 ' HA ' HG13 ' A' ' 25' ' ' VAL . 9.0 t70 83.24 -11.0 0.96 Allowed 'General case' 0 N--CA 1.443 -0.798 0 O-C-N 125.523 1.764 . . . . 10.0 109.744 -179.731 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 50.45 100.26 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 116.593 2.072 . . . . 10.0 116.593 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.42 124.11 4.01 Favored 'General case' 0 C--N 1.317 -0.818 0 O-C-N 120.688 -1.258 . . . . 10.0 112.178 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 10.3 mttt -63.05 149.21 45.62 Favored 'General case' 0 C--O 1.221 -0.447 0 N-CA-C 105.87 -1.9 . . . . 10.0 105.87 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 1.6 p -158.28 171.06 20.88 Favored 'General case' 0 C--O 1.215 -0.741 0 N-CA-C 105.652 -1.981 . . . . 10.0 105.652 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 30.1 mtp -120.56 96.38 5.11 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 102.664 -3.087 . . . . 10.0 102.664 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 27.7 m -107.24 117.52 34.28 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 116.977 2.214 . . . . 10.0 116.977 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 51.6 m -109.09 118.44 36.78 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 106.004 -1.85 . . . . 10.0 106.004 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.414 HG22 ' HB3' ' A' ' 95' ' ' CYS . 53.4 t -99.77 139.09 22.16 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 N-CA-C 105.714 -1.958 . . . . 10.0 105.714 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -154.41 -174.0 4.8 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 113.867 -1.515 . . . . 10.0 113.188 179.905 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 64.4 p-90 -133.93 130.48 37.79 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 121.787 0.804 . . . . 10.0 108.835 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 14.8 t0 -149.31 119.35 7.18 Favored 'General case' 0 C--O 1.242 0.666 0 N-CA-C 103.444 -2.798 . . . . 10.0 103.444 179.698 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 88.08 13.27 64.44 Favored Glycine 0 CA--C 1.503 -0.702 0 N-CA-C 106.979 -2.449 . . . . 10.0 106.979 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 20.9 t0 72.11 5.39 5.3 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 119.269 1.535 . . . . 10.0 111.859 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.44 168.85 9.48 Favored 'General case' 0 CA--C 1.504 -0.79 0 N-CA-C 106.499 -1.667 . . . . 10.0 106.499 179.782 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.595 HD12 ' CE1' ' A' ' 4' ' ' PHE . 0.5 OUTLIER -112.96 92.22 3.93 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 123.808 1.766 . . . . 10.0 106.425 179.586 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -104.45 155.87 18.42 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 114.72 -1.127 . . . . 10.0 110.446 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' CYS . . . . . 0.414 ' HB3' HG22 ' A' ' 86' ' ' VAL . 0.1 OUTLIER -145.3 170.59 16.01 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 117.601 -1.64 . . . . 10.0 108.461 -179.835 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 81.3 t -145.94 128.07 8.63 Favored 'Isoleucine or valine' 0 C--O 1.241 0.639 0 O-C-N 125.291 1.619 . . . . 10.0 107.574 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -110.89 118.94 37.47 Favored 'General case' 0 C--N 1.32 -0.695 0 O-C-N 125.041 1.463 . . . . 10.0 109.136 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 2.7 mmmt -96.17 80.58 3.26 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 122.655 1.217 . . . . 10.0 110.373 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -143.27 74.96 0.32 Allowed Glycine 0 C--N 1.338 0.652 0 CA-C-N 114.101 -1.409 . . . . 10.0 110.481 179.75 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 58.72 -176.12 0.08 Allowed 'General case' 0 C--O 1.234 0.241 0 N-CA-C 116.125 1.898 . . . . 10.0 116.125 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 24.9 mmtt 60.81 175.58 0.1 Allowed 'General case' 0 CA--C 1.544 0.747 0 O-C-N 125.244 1.59 . . . . 10.0 114.822 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 75.2 mt-10 -123.68 88.3 2.89 Favored 'General case' 0 C--O 1.232 0.134 0 O-C-N 125.568 1.792 . . . . 10.0 113.512 179.786 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 142.46 -23.39 2.36 Favored Glycine 0 C--O 1.217 -0.953 0 CA-C-O 118.258 -1.301 . . . . 10.0 116.263 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 7.0 mtp180 -47.94 130.89 15.45 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.869 0.982 . . . . 10.0 112.347 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 142.99 148.96 5.03 Favored Glycine 0 N--CA 1.439 -1.111 0 O-C-N 125.874 1.984 . . . . 10.0 109.952 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' TRP . . . . . 0.511 ' CE3' HD11 ' A' ' 117' ' ' LEU . 2.6 m0 -112.26 171.54 7.45 Favored 'General case' 0 N--CA 1.455 -0.22 0 O-C-N 121.789 -0.83 . . . . 10.0 109.727 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 4.0 m -153.54 88.98 1.3 Allowed 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 104.106 -2.553 . . . . 10.0 104.106 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 -79.76 98.23 6.94 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 125.156 1.535 . . . . 10.0 112.9 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -105.15 130.71 53.26 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 107.218 -1.401 . . . . 10.0 107.218 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 15.6 mt -93.18 119.64 41.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 116.679 2.103 . . . . 10.0 116.679 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -101.5 71.85 1.37 Allowed 'General case' 0 C--O 1.223 -0.303 0 CA-C-O 123.337 1.541 . . . . 10.0 108.243 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 59.52 -103.6 0.44 Allowed Glycine 0 C--N 1.341 0.826 0 N-CA-C 109.419 -1.473 . . . . 10.0 109.419 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 17.9 p-10 -87.12 16.79 4.74 Favored 'General case' 0 N--CA 1.476 0.842 0 O-C-N 121.392 -1.063 . . . . 10.0 112.54 179.849 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 13.4 mt-10 -138.92 158.33 44.4 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 125.166 2.412 . . . . 10.0 110.304 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.53 HD11 ' CH2' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -118.75 121.1 39.3 Favored 'General case' 0 C--O 1.24 0.582 0 N-CA-C 105.629 -1.989 . . . . 10.0 105.629 -179.931 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 48.0 t-80 -115.18 68.03 0.7 Allowed 'General case' 0 N--CA 1.444 -0.739 0 CA-C-O 123.327 1.537 . . . . 10.0 110.828 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.511 HD11 ' CE3' ' A' ' 106' ' ' TRP . 9.0 tt -69.48 126.28 29.27 Favored 'General case' 0 N--CA 1.441 -0.889 0 CA-C-N 113.206 -1.815 . . . . 10.0 108.796 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -128.38 98.19 4.98 Favored 'General case' 0 CA--C 1.498 -1.047 0 CA-C-O 124.31 2.005 . . . . 10.0 107.494 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 3.1 ptp -95.09 133.64 38.68 Favored 'General case' 0 CA--C 1.515 -0.396 0 O-C-N 120.663 -1.273 . . . . 10.0 112.346 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.97 169.1 9.25 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 117.613 -1.184 . . . . 10.0 112.388 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -177.58 116.6 0.09 Allowed 'General case' 0 C--O 1.237 0.433 0 O-C-N 125.43 1.706 . . . . 10.0 106.604 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 67.91 31.56 5.61 Favored 'General case' 0 C--O 1.245 0.865 0 CA-C-O 123.354 1.55 . . . . 10.0 114.344 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 78.83 -3.81 63.3 Favored Glycine 0 CA--C 1.526 0.747 0 O-C-N 120.049 -1.657 . . . . 10.0 113.178 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 49.1 t -95.85 121.68 46.63 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 N-CA-C 105.924 -1.88 . . . . 10.0 105.924 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 4.9 m -104.4 117.47 34.26 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-O 122.407 1.099 . . . . 10.0 112.164 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 4.2 t -103.4 128.03 50.62 Favored 'General case' 0 C--O 1.214 -0.777 0 C-N-CA 126.039 1.736 . . . . 10.0 107.538 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.42 155.08 47.94 Favored 'General case' 0 C--O 1.218 -0.572 0 C-N-CA 119.098 -1.041 . . . . 10.0 111.457 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -136.22 135.54 39.16 Favored 'General case' 0 N--CA 1.439 -1.02 0 N-CA-C 113.146 0.795 . . . . 10.0 113.146 179.869 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -86.23 103.19 12.58 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 CA-C-N 114.2 -1.364 . . . . 10.0 107.676 179.601 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 130' ' ' PHE . . . . . 0.494 ' CD1' ' HB3' ' A' ' 8' ' ' TRP . 0.7 OUTLIER -93.52 165.58 12.68 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 118.109 -0.948 . . . . 10.0 109.096 -179.86 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 13.5 tptp -133.02 134.87 45.0 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 125.94 2.025 . . . . 10.0 108.543 179.778 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 15.4 tptm -88.49 131.46 34.89 Favored 'General case' 0 CA--C 1.512 -0.493 0 CA-C-N 114.603 -1.181 . . . . 10.0 109.487 -179.677 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 28.3 t -109.8 -48.42 6.94 Favored 'Isoleucine or valine' 0 C--O 1.243 0.75 0 O-C-N 125.876 1.985 . . . . 10.0 109.075 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 6.2 t-80 . . . . . 0 N--CA 1.438 -1.05 0 CA-C-N 112.84 -1.982 . . . . 10.0 114.17 -179.806 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.467 0.383 0 CA-C-O 123.512 1.625 . . . . 10.0 109.983 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.414 ' CE1' HD11 ' A' ' 110' ' ' ILE . 10.0 m-85 63.21 -43.32 0.21 Allowed 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 117.11 2.263 . . . . 10.0 117.11 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 42.7 t-20 -40.25 106.39 0.05 Allowed 'General case' 0 C--N 1.319 -0.744 0 C-N-CA 125.455 1.502 . . . . 10.0 114.916 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -165.45 -127.17 0.87 Allowed Glycine 0 N--CA 1.468 0.796 0 N-CA-C 116.61 1.404 . . . . 10.0 116.61 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -167.15 122.98 1.11 Allowed 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 102.664 -3.087 . . . . 10.0 102.664 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 40.9 m0 -106.77 107.69 18.83 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 117.75 -1.119 . . . . 10.0 109.345 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.413 ' HE3' ' HB3' ' A' ' 131' ' ' LYS . 20.0 pttt -97.4 108.34 21.05 Favored 'General case' 0 C--O 1.216 -0.683 0 N-CA-C 105.589 -2.004 . . . . 10.0 105.589 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.17 166.84 0.09 Allowed 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 115.602 1.704 . . . . 10.0 115.602 -179.868 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.3 tt -126.12 -63.88 1.08 Allowed 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 105.18 -2.156 . . . . 10.0 105.18 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 77.4 p -144.64 155.89 43.84 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 124.654 1.182 . . . . 10.0 113.891 179.727 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -129.35 155.7 45.21 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 125.392 1.682 . . . . 10.0 106.647 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.8 pm0 -144.81 146.88 32.31 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 116.821 2.156 . . . . 10.0 116.821 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.1 m120 54.85 16.47 1.45 Allowed 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 114.571 1.323 . . . . 10.0 114.571 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -59.17 -36.79 75.92 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 116.015 1.858 . . . . 10.0 116.015 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.38 -34.77 61.14 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-N 119.419 1.009 . . . . 10.0 111.62 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -73.55 -27.39 61.31 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 107.846 -1.168 . . . . 10.0 107.846 179.789 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.412 ' CD2' HD23 ' A' ' 20' ' ' LEU . 10.1 t80 -65.15 -42.52 93.72 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 124.994 1.317 . . . . 10.0 111.024 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.633 HD12 ' HA ' ' A' ' 30' ' ' ARG . 24.4 mt -75.11 -25.52 58.56 Favored 'General case' 0 N--CA 1.478 0.946 0 O-C-N 121.797 -0.564 . . . . 10.0 109.576 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 57.1 ttt180 -67.79 -27.66 66.93 Favored 'General case' 0 C--O 1.242 0.708 0 C-N-CA 124.582 1.153 . . . . 10.0 110.735 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.51 -42.33 71.43 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.08 1.352 . . . . 10.0 110.096 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 32.6 mt -76.99 -13.47 59.96 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 122.312 1.053 . . . . 10.0 109.741 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 29.7 m-20 45.46 39.67 4.86 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.575 1.15 . . . . 10.0 111.483 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.569 HG12 ' N ' ' A' ' 26' ' ' ASN . 1.2 t -57.15 -63.54 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 O-C-N 127.428 2.955 . . . . 10.0 104.692 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.569 ' N ' HG12 ' A' ' 25' ' ' VAL . 5.4 t-20 -167.75 161.35 13.25 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.303 0.853 . . . . 10.0 113.303 -179.761 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.4 HG13 ' NH2' ' A' ' 30' ' ' ARG . 2.9 t -78.51 -33.14 16.85 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 N-CA-C 114.633 1.345 . . . . 10.0 114.633 -179.822 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -74.67 -32.34 62.19 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.003 -0.999 . . . . 10.0 112.634 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.5 tp -78.84 -21.47 47.57 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 122.021 0.915 . . . . 10.0 113.306 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.633 ' HA ' HD12 ' A' ' 20' ' ' LEU . 15.7 ttm180 -74.46 -31.31 62.19 Favored 'General case' 0 C--O 1.22 -0.491 0 O-C-N 119.605 -1.935 . . . . 10.0 111.311 -179.751 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.2 tttp -77.95 -39.03 43.95 Favored 'General case' 0 C--O 1.225 -0.19 0 CA-C-N 114.137 -1.392 . . . . 10.0 110.209 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 10.7 mm -75.29 -46.41 38.54 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 CA-C-N 114.278 -1.328 . . . . 10.0 109.913 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.54 ' CB ' HD11 ' A' ' 20' ' ' LEU . . . -67.21 -21.07 65.78 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 115.623 1.712 . . . . 10.0 115.623 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -71.1 -45.69 63.19 Favored 'General case' 0 N--CA 1.443 -0.819 0 N-CA-C 114.886 1.439 . . . . 10.0 114.886 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.3 pp -59.04 -21.84 59.74 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 113.627 0.973 . . . . 10.0 113.627 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -69.23 159.03 33.8 Favored 'General case' 0 C--O 1.217 -0.63 0 O-C-N 124.116 0.885 . . . . 10.0 112.348 -179.776 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 7.6 mttp -146.28 107.29 4.16 Favored Pre-proline 0 C--N 1.322 -0.593 0 N-CA-C 103.662 -2.718 . . . . 10.0 103.662 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -89.13 104.35 0.39 Allowed 'Trans proline' 0 C--N 1.354 0.868 0 N-CA-C 118.8 2.577 . . . . 10.0 118.8 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -81.28 136.01 35.76 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 103.536 -2.764 . . . . 10.0 103.536 178.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 12.0 mtpp -118.66 142.51 47.59 Favored 'General case' 0 C--N 1.31 -1.141 0 C-N-CA 118.846 -1.142 . . . . 10.0 112.153 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.424 ' OE1' HG23 ' A' ' 43' ' ' VAL . 0.2 OUTLIER -120.98 116.77 25.72 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 102.706 -3.072 . . . . 10.0 102.706 179.76 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 29.9 mt -110.66 136.26 47.22 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.058 0 CA-C-O 124.653 2.168 . . . . 10.0 111.062 -179.536 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.424 HG23 ' OE1' ' A' ' 41' ' ' GLU . 83.7 t -131.53 124.35 54.29 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.875 0 N-CA-C 105.095 -2.187 . . . . 10.0 105.095 -179.8 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 -108.86 165.13 11.79 Favored 'General case' 0 C--O 1.215 -0.733 0 CA-C-N 114.733 -1.121 . . . . 10.0 109.596 179.75 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -145.4 -146.81 0.2 Allowed 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 104.525 -2.398 . . . . 10.0 104.525 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -84.81 91.85 1.71 Allowed Glycine 0 CA--C 1.527 0.8 0 N-CA-C 105.993 -2.843 . . . . 10.0 105.993 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 62.02 20.34 11.51 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 124.481 0.754 . . . . 10.0 112.311 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 4.9 t-160 -125.75 103.52 7.85 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 105.413 -2.069 . . . . 10.0 105.413 -179.78 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.53 ' HG2' HD11 ' A' ' 51' ' ' ILE . 2.8 ttp -109.87 107.21 17.07 Favored 'General case' 0 C--O 1.216 -0.686 0 CA-C-N 112.723 -2.035 . . . . 10.0 116.028 -179.795 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.531 ' H ' HD12 ' A' ' 50' ' ' ILE . 3.3 mp -88.97 146.8 5.73 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 C-N-CA 125.824 1.65 . . . . 10.0 107.858 -179.583 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.53 HD11 ' HG2' ' A' ' 49' ' ' MET . 1.8 mp -133.87 133.12 56.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 O-C-N 124.582 1.176 . . . . 10.0 108.065 179.657 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 21.1 mtt-85 -124.14 127.58 48.0 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-O 117.798 -1.096 . . . . 10.0 113.199 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 12.7 m -114.63 94.85 4.96 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 102.814 -3.032 . . . . 10.0 102.814 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 58.0 mt -82.87 100.06 10.12 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 120.554 3.539 . . . . 10.0 120.554 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 48.9 p -122.82 -139.88 0.31 Allowed 'General case' 0 C--N 1.319 -0.759 0 O-C-N 126.168 2.167 . . . . 10.0 108.028 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -139.1 -38.36 0.5 Allowed 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 119.212 0.915 . . . . 10.0 111.86 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -54.76 -81.16 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 123.048 1.404 . . . . 10.0 110.507 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 3.2 mmp_? -110.47 -25.67 9.92 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 116.767 -1.587 . . . . 10.0 113.847 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ASN . . . . . 0.639 ' O ' HD12 ' A' ' 61' ' ' ILE . 5.2 m120 56.83 85.31 0.08 Allowed 'General case' 0 CA--C 1.537 0.477 0 O-C-N 126.41 2.319 . . . . 10.0 108.352 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -56.16 117.83 4.12 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 107.007 -1.479 . . . . 10.0 107.007 -179.548 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.639 HD12 ' O ' ' A' ' 59' ' ' ASN . 3.6 mt -128.1 114.29 34.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 CA-C-N 113.798 -1.546 . . . . 10.0 111.454 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 3.2 mtm -121.27 172.39 8.04 Favored 'General case' 0 C--O 1.214 -0.795 0 N-CA-C 104.716 -2.327 . . . . 10.0 104.716 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.407 ' HA ' ' HA ' ' A' ' 50' ' ' ILE . 0.8 OUTLIER -163.23 128.6 3.11 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 104.904 -2.258 . . . . 10.0 104.904 179.553 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 -135.02 178.63 6.88 Favored 'General case' 0 CA--C 1.515 -0.366 0 N-CA-C 114.142 1.164 . . . . 10.0 114.142 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -129.44 100.51 5.58 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 126.868 2.605 . . . . 10.0 105.457 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.1 t -43.95 146.59 0.32 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.594 0 O-C-N 125.879 1.987 . . . . 10.0 110.419 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 56.42 63.74 5.04 Favored Glycine 0 CA--C 1.526 0.78 0 CA-C-N 114.077 -1.42 . . . . 10.0 113.03 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.12 166.57 2.4 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 125.011 2.338 . . . . 10.0 116.22 -179.758 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -87.5 133.96 33.68 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 113.444 -1.707 . . . . 10.0 110.783 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -145.69 112.51 5.99 Favored 'General case' 0 C--N 1.318 -0.777 0 O-C-N 125.301 1.625 . . . . 10.0 114.1 -179.723 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 17.9 pt-20 -76.6 135.66 39.21 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 105.13 -2.174 . . . . 10.0 105.13 -179.884 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -99.9 -34.92 9.92 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 122.44 1.114 . . . . 10.0 112.511 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 75.83 -60.48 0.49 Allowed 'General case' 0 C--O 1.221 -0.418 0 CA-C-N 114.235 -1.348 . . . . 10.0 108.614 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 61.77 33.57 17.77 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 116.689 2.107 . . . . 10.0 116.689 179.807 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -59.44 125.2 22.67 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-O 123.144 1.45 . . . . 10.0 109.158 -179.863 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 75.33 133.41 0.36 Allowed Glycine 0 C--O 1.223 -0.554 0 CA-C-O 118.336 -1.258 . . . . 10.0 110.413 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.485 HG22 ' O ' ' A' ' 77' ' ' ILE . 2.8 mt 92.02 20.49 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 O-C-N 126.448 1.911 . . . . 10.0 108.711 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.554 ' HA ' HG22 ' A' ' 25' ' ' VAL . 18.4 t70 143.32 -33.84 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.74 0 O-C-N 128.659 3.724 . . . . 10.0 114.098 179.826 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 50.48 52.85 14.0 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 124.121 0.968 . . . . 10.0 112.967 -179.648 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.5 -67.65 0.57 Allowed 'General case' 0 N--CA 1.467 0.407 0 O-C-N 119.49 -2.006 . . . . 10.0 114.094 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 88.56 118.74 0.03 OUTLIER 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 102.876 -3.009 . . . . 10.0 102.876 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 4.6 p -147.4 171.25 15.77 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 123.433 1.587 . . . . 10.0 110.246 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.09 71.75 0.87 Allowed 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 100.287 -3.968 . . . . 10.0 100.287 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 6.3 m -76.77 139.53 40.43 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 118.315 2.709 . . . . 10.0 118.315 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 1.9 m -124.97 129.27 50.01 Favored 'General case' 0 C--O 1.244 0.77 0 O-C-N 125.475 1.734 . . . . 10.0 107.421 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -101.86 159.19 4.24 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.989 0 N-CA-C 104.773 -2.306 . . . . 10.0 104.773 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.4 t -145.99 167.76 22.54 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 122.75 1.262 . . . . 10.0 110.837 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' TRP . . . . . 0.468 ' HA ' HD12 ' A' ' 93' ' ' LEU . 11.1 p90 -124.32 122.61 38.18 Favored 'General case' 0 C--O 1.239 0.534 0 CA-C-N 112.815 -1.993 . . . . 10.0 107.177 179.853 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -88.97 172.52 9.07 Favored 'General case' 0 C--N 1.312 -1.053 1 N-CA-C 98.593 -4.595 . . . . 10.0 98.593 179.985 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -65.87 -27.78 73.07 Favored Glycine 0 CA--C 1.496 -1.156 0 N-CA-C 108.448 -1.861 . . . . 10.0 108.448 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 44.0 p-10 -145.66 25.88 1.3 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 118.89 1.345 . . . . 10.0 111.897 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 2.1 mtmt -153.03 -157.11 0.76 Allowed 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 108.3 -1.0 . . . . 10.0 108.3 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.468 HD12 ' HA ' ' A' ' 88' ' ' TRP . 4.4 tp -165.27 136.48 3.99 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 106.257 -1.757 . . . . 10.0 106.257 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -132.38 156.72 46.15 Favored 'General case' 0 CA--C 1.508 -0.655 0 N-CA-C 114.623 1.342 . . . . 10.0 114.623 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -133.72 145.25 49.7 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 123.129 1.442 . . . . 10.0 111.439 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 3.8 t -138.52 153.57 26.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 114.132 -1.395 . . . . 10.0 108.908 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -148.5 152.76 37.44 Favored 'General case' 0 C--O 1.246 0.878 0 CA-C-O 122.355 1.074 . . . . 10.0 108.365 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 2.8 mttp -117.62 83.54 2.01 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 114.61 -1.177 . . . . 10.0 110.122 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -152.96 87.07 0.13 Allowed Glycine 0 C--N 1.315 -0.604 0 C-N-CA 119.174 -1.489 . . . . 10.0 110.133 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 42.61 -154.81 0.02 OUTLIER 'General case' 0 C--O 1.246 0.888 0 N-CA-C 116.968 2.21 . . . . 10.0 116.968 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.401 ' N ' ' CD ' ' A' ' 101' ' ' LYS . 0.0 OUTLIER 62.66 166.65 0.12 Allowed 'General case' 0 C--O 1.217 -0.642 0 CA-C-O 124.089 1.899 . . . . 10.0 112.552 179.759 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -100.13 4.9 44.8 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-N 112.646 -2.07 . . . . 10.0 114.451 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 170.48 58.13 0.04 OUTLIER Glycine 0 C--N 1.319 -0.373 0 N-CA-C 120.02 2.768 . . . . 10.0 120.02 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.504 ' H ' ' NE ' ' A' ' 104' ' ' ARG . 0.0 OUTLIER -86.59 161.88 18.28 Favored 'General case' 0 N--CA 1.441 -0.88 0 O-C-N 125.034 1.079 . . . . 10.0 109.44 -179.943 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 127.55 154.94 8.62 Favored Glycine 0 N--CA 1.435 -1.402 0 C-N-CA 120.624 -0.798 . . . . 10.0 111.457 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -118.77 154.64 32.48 Favored 'General case' 0 CA--C 1.506 -0.734 0 C-N-CA 124.442 1.097 . . . . 10.0 110.502 -179.776 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.1 m -131.88 139.79 48.89 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-O 123.697 1.713 . . . . 10.0 107.864 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -120.94 125.31 47.1 Favored 'General case' 0 C--O 1.246 0.917 0 CA-C-N 113.249 -1.796 . . . . 10.0 108.608 -179.821 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 5.5 t-105 -132.27 137.03 47.34 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 106.839 -1.541 . . . . 10.0 106.839 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.414 HD11 ' CE1' ' A' ' 4' ' ' PHE . 2.1 mt -111.26 140.85 28.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 O-C-N 126.352 2.283 . . . . 10.0 117.022 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -123.82 170.56 10.42 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 104.103 -2.554 . . . . 10.0 104.103 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -33.95 -80.0 0.02 OUTLIER Glycine 0 C--O 1.241 0.59 0 O-C-N 128.152 3.407 . . . . 10.0 111.159 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -115.42 15.53 16.77 Favored 'General case' 0 CA--C 1.555 1.143 0 CA-C-N 120.157 1.978 . . . . 10.0 108.776 179.737 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -126.9 154.51 44.35 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 124.547 2.117 . . . . 10.0 112.516 -179.793 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.485 ' HB3' ' HB2' ' A' ' 130' ' ' PHE . 0.2 OUTLIER -113.42 127.55 56.15 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 111.715 -2.493 . . . . 10.0 106.525 179.863 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -110.87 79.64 1.22 Allowed 'General case' 0 C--O 1.217 -0.656 0 CA-C-O 122.305 1.05 . . . . 10.0 111.785 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 1.7 tp -80.27 148.24 30.85 Favored 'General case' 0 C--O 1.218 -0.582 0 CA-C-O 124.417 2.056 . . . . 10.0 113.493 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.412 ' HA ' ' HB3' ' A' ' 127' ' ' LYS . 0.0 OUTLIER -142.89 136.33 28.53 Favored 'General case' 0 C--O 1.219 -0.54 0 O-C-N 119.594 -1.941 . . . . 10.0 107.264 -179.835 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 7.5 mtp -138.48 151.08 47.07 Favored 'General case' 0 CA--C 1.51 -0.589 0 CA-C-O 122.941 1.353 . . . . 10.0 108.111 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.421 ' O ' ' HB2' ' A' ' 121' ' ' ALA . 2.8 mtt-85 -143.58 166.48 24.71 Favored 'General case' 0 CA--C 1.512 -0.512 0 O-C-N 119.852 -1.78 . . . . 10.0 112.338 -179.777 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 121' ' ' ALA . . . . . 0.421 ' HB2' ' O ' ' A' ' 120' ' ' ARG . . . 178.57 122.66 0.05 OUTLIER 'General case' 0 CA--C 1.503 -0.848 0 CA-C-N 114.418 -1.264 . . . . 10.0 109.212 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 50.92 41.19 26.68 Favored 'General case' 0 C--O 1.244 0.791 0 O-C-N 125.96 2.037 . . . . 10.0 115.947 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 84.12 -7.37 71.55 Favored Glycine 0 C--N 1.341 0.811 0 O-C-N 124.646 1.216 . . . . 10.0 115.165 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 12.7 t -91.31 126.85 43.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 CA-C-O 117.642 -1.17 . . . . 10.0 111.409 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 85.6 m -111.86 111.35 22.24 Favored 'General case' 0 N--CA 1.441 -0.904 0 O-C-N 126.725 2.516 . . . . 10.0 115.83 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 1.4 t -110.07 156.39 20.61 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 104.996 -2.224 . . . . 10.0 104.996 -179.909 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' LYS . . . . . 0.412 ' HB3' ' HA ' ' A' ' 118' ' ' GLU . 0.0 OUTLIER -168.07 177.92 5.32 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 123.306 1.527 . . . . 10.0 110.163 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 12.2 mt-30 -149.83 150.42 31.95 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 112.789 -2.005 . . . . 10.0 114.092 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 28.1 t -111.32 115.66 50.45 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.788 0 N-CA-C 105.199 -2.149 . . . . 10.0 105.199 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 130' ' ' PHE . . . . . 0.485 ' HB2' ' HB3' ' A' ' 115' ' ' LEU . 55.1 m-85 -110.39 162.55 14.55 Favored 'General case' 0 CA--C 1.51 -0.573 0 O-C-N 125.584 1.802 . . . . 10.0 111.809 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.413 ' HB3' ' HE3' ' A' ' 9' ' ' LYS . 0.0 OUTLIER -129.45 115.22 17.18 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 105.879 -1.897 . . . . 10.0 105.879 179.866 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 9.9 tttp -76.45 116.78 17.46 Favored 'General case' 0 C--O 1.216 -0.675 0 O-C-N 125.524 1.765 . . . . 10.0 108.506 -179.81 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.63 -37.39 77.55 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.678 0 CA-C-N 114.127 -1.397 . . . . 10.0 112.117 -179.741 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 . . . . . 0 N--CA 1.446 -0.641 0 CA-C-O 117.195 -1.384 . . . . 10.0 107.86 179.849 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.9 t0 . . . . . 0 C--O 1.238 0.497 0 CA-C-O 123.167 1.46 . . . . 10.0 111.419 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.447 ' CD1' HD11 ' A' ' 110' ' ' ILE . 57.0 m-85 -96.5 -28.23 14.5 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 116.899 2.185 . . . . 10.0 116.899 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 47.0 p-10 -64.48 139.79 58.8 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 117.985 2.587 . . . . 10.0 117.985 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -174.23 -130.57 1.3 Allowed Glycine 0 N--CA 1.452 -0.267 0 N-CA-C 117.179 1.632 . . . . 10.0 117.179 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -160.84 98.15 1.19 Allowed 'General case' 0 C--O 1.239 0.533 0 N-CA-C 105.709 -1.96 . . . . 10.0 105.709 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.562 ' CZ3' ' HG2' ' A' ' 132' ' ' LYS . 0.8 OUTLIER -90.15 139.64 30.43 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 116.253 -1.832 . . . . 10.0 107.697 179.9 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -123.04 8.88 9.28 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 125.09 1.494 . . . . 10.0 111.481 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 61.77 135.09 0.01 OUTLIER 'General case' 0 C--N 1.309 -1.163 0 O-C-N 126.718 2.511 . . . . 10.0 117.527 179.101 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.5 tp -113.05 -56.08 2.45 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 107.854 -1.165 . . . . 10.0 107.854 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.1 p -154.01 -178.25 6.96 Favored 'General case' 0 C--O 1.242 0.679 0 N-CA-C 115.522 1.675 . . . . 10.0 115.522 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -154.17 164.02 39.18 Favored 'General case' 0 C--O 1.238 0.457 0 N-CA-C 105.002 -2.222 . . . . 10.0 105.002 -179.484 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -156.02 18.6 0.37 Allowed 'General case' 0 C--O 1.234 0.237 0 O-C-N 118.545 -2.597 . . . . 10.0 114.658 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.415 ' CB ' ' HA ' ' A' ' 126' ' ' CYS . 0.3 OUTLIER -163.01 26.52 0.09 Allowed 'General case' 0 C--O 1.241 0.651 0 O-C-N 125.34 1.65 . . . . 10.0 114.332 -179.873 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.634 ' CE2' ' HB1' ' A' ' 33' ' ' ALA . 2.6 t80 -62.75 -52.59 62.61 Favored 'General case' 0 C--O 1.243 0.718 0 C-N-CA 124.627 1.171 . . . . 10.0 113.71 -179.591 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.0 tm-20 -69.01 -34.13 74.77 Favored 'General case' 0 CA--C 1.511 -0.557 0 N-CA-C 115.151 1.537 . . . . 10.0 115.151 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -77.0 -23.3 52.25 Favored 'General case' 0 C--N 1.32 -0.715 0 O-C-N 124.91 1.381 . . . . 10.0 108.034 -179.746 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -78.1 -32.59 50.63 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 107.994 -1.113 . . . . 10.0 107.994 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 81.8 mt -75.9 -30.4 58.77 Favored 'General case' 0 C--O 1.217 -0.656 0 O-C-N 119.926 -1.733 . . . . 10.0 111.876 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.2 ttm180 -68.96 -27.09 65.42 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 124.11 0.964 . . . . 10.0 110.245 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.26 -49.01 54.24 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.189 1.795 . . . . 10.0 109.308 -179.687 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.566 HD13 ' HB3' ' A' ' 78' ' ' ASP . 2.6 mt -74.9 -15.47 60.7 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 125.915 2.009 . . . . 10.0 111.793 179.857 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 69.15 28.94 4.84 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 115.396 1.628 . . . . 10.0 115.396 -179.7 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 6.1 m -62.0 178.12 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 N-CA-C 107.675 -1.231 . . . . 10.0 107.675 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -62.32 152.07 34.83 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 116.327 1.973 . . . . 10.0 116.327 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 14.8 p -70.74 -32.29 48.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 N-CA-C 115.072 1.508 . . . . 10.0 115.072 179.624 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -73.72 -25.04 60.01 Favored 'General case' 0 C--O 1.243 0.725 0 O-C-N 124.989 1.431 . . . . 10.0 109.171 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -73.99 -50.48 19.69 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-N 114.024 -1.444 . . . . 10.0 108.826 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.49 -25.37 68.23 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 125.145 1.378 . . . . 10.0 113.491 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -73.92 -44.84 53.78 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 113.166 -1.833 . . . . 10.0 112.12 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.418 HG22 ' CD2' ' A' ' 36' ' ' LEU . 1.7 mm -69.31 -54.85 17.67 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 O-C-N 120.093 -1.629 . . . . 10.0 110.755 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.634 ' HB1' ' CE2' ' A' ' 16' ' ' PHE . . . -45.57 -28.13 0.89 Allowed 'General case' 0 C--O 1.216 -0.696 0 N-CA-C 115.874 1.805 . . . . 10.0 115.874 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 13.9 t-20 -86.15 -2.47 58.38 Favored 'General case' 0 N--CA 1.44 -0.968 0 O-C-N 119.995 -1.691 . . . . 10.0 113.908 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 15.7 mt -104.43 -20.15 13.81 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 108.942 -0.762 . . . . 10.0 108.942 179.726 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.418 ' CD2' HG22 ' A' ' 32' ' ' ILE . 0.4 OUTLIER -128.29 173.66 9.96 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 113.422 0.897 . . . . 10.0 113.422 -179.953 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 6.5 ptpt -151.32 155.19 34.46 Favored Pre-proline 0 N--CA 1.478 0.949 0 N-CA-C 104.236 -2.505 . . . . 10.0 104.236 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo -101.74 162.56 0.35 Allowed 'Trans proline' 0 N--CA 1.459 -0.547 1 C-N-CA 126.799 4.999 . . . . 10.0 116.672 -179.803 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -110.42 -175.86 2.83 Favored 'General case' 0 C--O 1.239 0.55 0 N-CA-C 104.927 -2.249 . . . . 10.0 104.927 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.76 140.78 11.1 Favored 'General case' 0 C--N 1.309 -1.153 0 O-C-N 120.517 -1.364 . . . . 10.0 111.73 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -132.16 135.84 46.66 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 105.225 -2.139 . . . . 10.0 105.225 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.406 HG13 ' NE1' ' A' ' 8' ' ' TRP . 0.9 OUTLIER -121.52 141.21 42.92 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.026 0 N-CA-C 109.265 -0.642 . . . . 10.0 109.265 -179.926 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.5 t -137.86 135.35 45.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 105.791 -1.929 . . . . 10.0 105.791 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -126.47 113.3 16.65 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 121.482 0.658 . . . . 10.0 109.85 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -82.08 -17.57 46.09 Favored 'General case' 0 C--O 1.219 -0.543 0 N-CA-C 106.757 -1.572 . . . . 10.0 106.757 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 140.44 -110.67 0.69 Allowed Glycine 0 CA--C 1.521 0.451 0 N-CA-C 107.619 -2.192 . . . . 10.0 107.619 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 60.0 m-20 -71.24 -13.54 61.94 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 119.299 -2.294 . . . . 10.0 108.541 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 31.7 m170 -109.78 144.83 37.66 Favored 'General case' 0 N--CA 1.439 -0.997 0 N-CA-C 105.372 -2.084 . . . . 10.0 105.372 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.528 ' C ' HD12 ' A' ' 50' ' ' ILE . 16.5 ttt -133.14 154.95 50.13 Favored 'General case' 0 C--N 1.317 -0.812 0 O-C-N 125.807 1.942 . . . . 10.0 111.592 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.528 HD12 ' C ' ' A' ' 49' ' ' MET . 4.6 mp -142.26 132.11 23.49 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.058 0 N-CA-C 107.161 -1.422 . . . . 10.0 107.161 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -120.24 125.56 74.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 CA-C-O 117.355 -1.307 . . . . 10.0 108.785 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.401 ' HB2' HD21 ' A' ' 54' ' ' LEU . 3.5 ptp180 -115.83 128.59 55.94 Favored 'General case' 0 C--O 1.221 -0.413 0 O-C-N 126.058 2.099 . . . . 10.0 108.27 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.611 ' C ' HD22 ' A' ' 54' ' ' LEU . 76.9 m -123.99 113.07 17.95 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 104.861 -2.274 . . . . 10.0 104.861 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.611 HD22 ' C ' ' A' ' 53' ' ' THR . 2.5 mm? -119.51 140.3 50.71 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 119.52 3.156 . . . . 10.0 119.52 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -165.29 28.16 0.06 Allowed 'General case' 0 N--CA 1.445 -0.704 0 N-CA-C 109.273 -0.64 . . . . 10.0 109.273 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' THR . . . . . 0.49 ' O ' HG22 ' A' ' 56' ' ' THR . 9.0 m 44.14 48.21 7.58 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 112.647 0.61 . . . . 10.0 112.647 179.814 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -159.98 -70.89 0.07 Allowed 'General case' 0 C--O 1.247 0.946 0 N-CA-C 105.849 -1.908 . . . . 10.0 105.849 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.408 ' NE ' ' HA ' ' A' ' 58' ' ' ARG . 0.0 OUTLIER -113.11 118.26 34.25 Favored 'General case' 0 C--O 1.245 0.836 0 CA-C-N 113.628 -1.624 . . . . 10.0 109.74 -179.916 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -102.53 102.34 12.6 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.745 0.784 . . . . 10.0 109.914 179.832 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.699 ' OH ' HD11 ' A' ' 74' ' ' LEU . 0.1 OUTLIER -87.34 107.76 18.67 Favored 'General case' 0 C--O 1.212 -0.88 0 N-CA-C 105.33 -2.1 . . . . 10.0 105.33 -179.698 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 5.2 mt -135.84 141.48 41.82 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 CA-C-O 122.463 1.125 . . . . 10.0 111.312 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 28.3 mmt -149.57 178.16 9.09 Favored 'General case' 0 CA--C 1.505 -0.76 0 N-CA-C 104.549 -2.389 . . . . 10.0 104.549 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 58.6 m-20 -142.16 69.46 1.32 Allowed 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 102.638 -3.097 . . . . 10.0 102.638 -179.826 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 6.0 m-30 -70.58 146.12 50.31 Favored 'General case' 0 C--O 1.243 0.732 0 N-CA-C 115.398 1.629 . . . . 10.0 115.398 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -116.93 120.79 39.53 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 107.046 -1.465 . . . . 10.0 107.046 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 43.9 t -65.04 100.95 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.723 0 C-N-CA 123.942 0.897 . . . . 10.0 110.871 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 94.61 68.3 1.04 Allowed Glycine 0 C--O 1.221 -0.695 0 O-C-N 127.868 3.23 . . . . 10.0 112.027 -179.877 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -167.3 136.46 2.73 Favored 'General case' 0 C--O 1.231 0.091 0 O-C-N 119.472 -2.193 . . . . 10.0 114.851 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -84.57 136.06 33.94 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 118.485 -1.286 . . . . 10.0 111.311 179.828 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 44.2 p90 -158.62 128.37 5.79 Favored 'General case' 0 C--N 1.322 -0.617 0 O-C-N 120.612 -1.305 . . . . 10.0 109.268 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -61.9 155.14 24.21 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 123.719 1.723 . . . . 10.0 110.902 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 14.8 tp10 -120.95 67.49 0.86 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 113.139 -1.846 . . . . 10.0 113.564 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -68.97 71.82 0.24 Allowed 'General case' 0 C--N 1.316 -0.85 0 C-N-CA 125.395 1.478 . . . . 10.0 107.107 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.699 HD11 ' OH ' ' A' ' 60' ' ' TYR . 0.4 OUTLIER -76.58 137.16 39.35 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 114.082 -1.417 . . . . 10.0 113.721 -179.807 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 51.0 p -152.78 50.91 0.75 Allowed 'General case' 0 C--O 1.242 0.707 0 N-CA-C 106.165 -1.791 . . . . 10.0 106.165 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -128.91 -59.18 0.11 Allowed Glycine 0 N--CA 1.435 -1.425 0 O-C-N 125.266 1.604 . . . . 10.0 112.417 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.492 HG22 ' N ' ' A' ' 78' ' ' ASP . 46.3 mt -112.46 -87.15 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.539 0 O-C-N 124.667 0.863 . . . . 10.0 109.692 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.566 ' HB3' HD13 ' A' ' 23' ' ' LEU . 1.3 p30 -81.26 3.82 22.61 Favored 'General case' 0 CA--C 1.51 -0.566 0 N-CA-C 115.298 1.592 . . . . 10.0 115.298 -179.725 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.8 p30 44.68 -155.76 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 114.545 1.313 . . . . 10.0 114.545 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 72.84 130.77 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 119.477 1.035 . . . . 10.0 111.841 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 6.3 ttpm? -87.73 122.45 31.41 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 104.783 -2.303 . . . . 10.0 104.783 -179.847 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -121.59 172.4 8.13 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 107.601 -1.259 . . . . 10.0 107.601 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' MET . . . . . 0.404 ' CB ' ' HB2' ' A' ' 98' ' ' LYS . 0.0 OUTLIER -116.48 126.6 53.6 Favored 'General case' 0 CA--C 1.512 -0.498 1 N-CA-C 98.902 -4.481 . . . . 10.0 98.902 -179.954 . . . . . . . . 4 4 . 1 . 004 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 33.9 m -127.1 140.11 52.5 Favored 'General case' 0 C--N 1.311 -1.097 0 O-C-N 121.189 -0.945 . . . . 10.0 113.513 -179.681 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 2.1 m -126.82 101.54 6.64 Favored 'General case' 0 C--N 1.316 -0.872 0 O-C-N 125.052 1.47 . . . . 10.0 109.345 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 1.3 m -81.97 138.13 20.01 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.954 0 N-CA-C 101.332 -3.581 . . . . 10.0 101.332 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 13.7 t -145.89 167.13 24.0 Favored 'General case' 0 C--N 1.317 -0.84 0 C-N-CA 119.364 -0.935 . . . . 10.0 111.037 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 5.7 t90 -97.28 129.23 44.61 Favored 'General case' 0 C--N 1.314 -0.956 0 O-C-N 125.707 1.879 . . . . 10.0 106.554 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -139.85 98.0 3.37 Favored 'General case' 0 CA--C 1.505 -0.771 0 N-CA-C 101.519 -3.512 . . . . 10.0 101.519 -179.773 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 52.19 -130.77 37.43 Favored Glycine 0 N--CA 1.437 -1.29 0 N-CA-C 104.762 -3.335 . . . . 10.0 104.762 179.707 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -89.37 24.23 2.29 Favored 'General case' 0 N--CA 1.446 -0.628 0 O-C-N 124.288 0.64 . . . . 10.0 112.205 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.7 167.42 12.07 Favored 'General case' 0 CA--C 1.508 -0.641 0 CA-C-O 121.601 0.715 . . . . 10.0 110.651 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -125.05 99.64 6.21 Favored 'General case' 0 C--O 1.241 0.635 0 N-CA-C 102.85 -3.018 . . . . 10.0 102.85 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 18.4 mm-40 -85.76 137.0 33.1 Favored 'General case' 0 CA--C 1.503 -0.851 0 O-C-N 124.756 1.285 . . . . 10.0 113.188 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 7.1 t -137.94 123.86 20.11 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 108.33 -0.989 . . . . 10.0 108.33 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 16.1 t -133.93 117.12 25.03 Favored 'Isoleucine or valine' 0 C--O 1.245 0.84 0 CA-C-N 112.939 -1.937 . . . . 10.0 109.256 -179.783 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 17.3 mt-30 -90.54 143.23 26.95 Favored 'General case' 0 C--O 1.243 0.758 0 N-CA-C 107.235 -1.394 . . . . 10.0 107.235 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.404 ' HB2' ' CB ' ' A' ' 83' ' ' MET . 0.6 OUTLIER -85.18 17.07 3.17 Favored 'General case' 0 CA--C 1.508 -0.643 0 O-C-N 124.249 0.968 . . . . 10.0 113.255 179.973 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -77.79 -178.08 48.05 Favored Glycine 0 N--CA 1.435 -1.37 0 C-N-CA 118.231 -1.937 . . . . 10.0 109.816 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -70.76 164.06 25.95 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 113.681 0.993 . . . . 10.0 113.681 -179.779 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 15.0 mttm 82.95 -179.91 0.05 Allowed 'General case' 0 CA--C 1.54 0.575 0 O-C-N 125.773 1.921 . . . . 10.0 112.401 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -108.17 130.76 55.11 Favored 'General case' 0 C--O 1.223 -0.301 0 O-C-N 124.76 1.288 . . . . 10.0 112.306 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 106.09 -20.55 35.47 Favored Glycine 0 C--O 1.215 -1.057 0 N-CA-C 118.338 2.095 . . . . 10.0 118.338 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 10.2 mtt180 -40.98 116.35 0.71 Allowed 'General case' 0 C--N 1.327 -0.407 0 O-C-N 125.956 1.621 . . . . 10.0 110.999 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 125.74 170.95 13.11 Favored Glycine 0 C--O 1.218 -0.898 0 N-CA-C 107.933 -2.067 . . . . 10.0 107.933 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -130.92 174.72 9.71 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 123.036 1.398 . . . . 10.0 110.038 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 48.6 m -130.97 133.69 46.03 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 104.672 -2.344 . . . . 10.0 104.672 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -122.08 125.73 46.86 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 118.254 -0.879 . . . . 10.0 110.699 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 109' ' ' TRP . . . . . 0.496 ' CD1' ' C ' ' A' ' 109' ' ' TRP . 0.0 OUTLIER -138.45 145.14 40.53 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 126.097 2.123 . . . . 10.0 106.74 -179.98 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.447 HD11 ' CD1' ' A' ' 4' ' ' PHE . 4.7 mt -105.36 137.9 32.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 124.184 1.945 . . . . 10.0 115.646 179.718 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -104.45 165.95 10.72 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 104.611 -2.366 . . . . 10.0 104.611 179.463 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -39.55 -73.07 0.19 Allowed Glycine 0 N--CA 1.448 -0.521 0 O-C-N 126.015 2.072 . . . . 10.0 111.414 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -122.46 35.98 4.75 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 121.576 0.703 . . . . 10.0 110.248 -179.823 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -150.45 164.12 36.69 Favored 'General case' 0 C--O 1.241 0.62 0 O-C-N 119.402 -2.061 . . . . 10.0 109.722 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -119.2 120.99 38.68 Favored 'General case' 0 C--N 1.314 -0.965 0 N-CA-C 104.351 -2.463 . . . . 10.0 104.351 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -119.0 91.1 3.47 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 119.348 0.976 . . . . 10.0 108.517 179.85 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.513 HD12 ' H ' ' A' ' 118' ' ' GLU . 30.5 tp -86.98 151.2 23.49 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 124.55 1.156 . . . . 10.0 109.745 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.513 ' H ' HD12 ' A' ' 117' ' ' LEU . 34.6 tt0 -139.46 102.94 4.59 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 114.924 -1.034 . . . . 10.0 109.966 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 4.7 mtp -97.54 154.33 17.58 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 108.437 -0.949 . . . . 10.0 108.437 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -146.89 154.78 41.7 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 114.093 1.146 . . . . 10.0 114.093 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -170.02 118.53 0.59 Allowed 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 105.027 -2.212 . . . . 10.0 105.027 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 63.64 43.31 5.78 Favored 'General case' 0 C--O 1.242 0.7 0 O-C-N 126.664 2.477 . . . . 10.0 113.093 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 64.47 15.92 59.98 Favored Glycine 0 C--O 1.22 -0.763 0 O-C-N 121.236 -0.915 . . . . 10.0 115.37 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 2.6 t -105.16 123.25 59.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 N-CA-C 108.064 -1.087 . . . . 10.0 108.064 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 85.1 m -93.78 117.47 30.14 Favored 'General case' 0 N--CA 1.441 -0.903 0 O-C-N 123.82 0.7 . . . . 10.0 112.484 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 126' ' ' CYS . . . . . 0.415 ' HA ' ' CB ' ' A' ' 15' ' ' ASN . 51.6 t -116.88 104.93 11.8 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 106.487 -1.672 . . . . 10.0 106.487 179.808 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 28.9 mtpt -106.56 152.38 23.78 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 122.396 1.093 . . . . 10.0 111.822 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -135.3 107.91 7.43 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 108.206 -1.035 . . . . 10.0 108.206 -179.579 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 76.8 t -83.14 122.37 37.38 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.73 0 O-C-N 125.555 1.784 . . . . 10.0 107.694 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 59.6 m-85 -112.07 -172.38 2.03 Favored 'General case' 0 N--CA 1.45 -0.457 0 O-C-N 125.173 1.545 . . . . 10.0 108.506 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 24.1 tptp -151.87 122.48 7.4 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 123.542 1.639 . . . . 10.0 107.745 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 132' ' ' LYS . . . . . 0.562 ' HG2' ' CZ3' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -78.27 110.78 13.59 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-N 115.01 -0.995 . . . . 10.0 108.866 -179.832 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 4.2 t -100.87 -1.85 9.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 118.209 -0.901 . . . . 10.0 109.313 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.44 -0.936 0 O-C-N 126.044 2.09 . . . . 10.0 110.866 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.47 0.561 0 N-CA-C 112.511 0.56 . . . . 10.0 112.511 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.434 ' CE1' HD12 ' A' ' 110' ' ' ILE . 84.9 m-85 68.86 -49.22 0.58 Allowed 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 126.168 1.787 . . . . 10.0 114.027 -179.706 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 -47.55 113.17 0.65 Allowed 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 115.105 1.52 . . . . 10.0 115.105 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 169.96 -116.0 0.63 Allowed Glycine 0 CA--C 1.529 0.968 0 O-C-N 125.467 1.729 . . . . 10.0 113.954 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -165.66 144.4 6.15 Favored 'General case' 0 C--O 1.224 -0.243 0 N-CA-C 100.894 -3.743 . . . . 10.0 100.894 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.577 ' CE2' HD12 ' A' ' 115' ' ' LEU . 87.2 m95 -129.92 114.9 16.43 Favored 'General case' 0 C--N 1.315 -0.919 0 O-C-N 124.53 1.144 . . . . 10.0 109.331 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 9.1 tptt -99.01 116.91 32.32 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.231 -1.35 . . . . 10.0 110.698 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.467 ' HA ' ' HA ' ' A' ' 130' ' ' PHE . 0.0 OUTLIER -61.46 135.51 57.7 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-O 122.234 1.016 . . . . 10.0 111.483 179.265 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 15.0 tp -117.02 -45.02 2.77 Favored 'General case' 0 CA--C 1.514 -0.441 0 O-C-N 120.611 -1.306 . . . . 10.0 111.436 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -122.29 156.93 32.82 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 123.977 1.846 . . . . 10.0 113.992 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -148.43 120.04 8.01 Favored 'General case' 0 CA--C 1.508 -0.666 0 CA-C-N 112.098 -2.319 . . . . 10.0 107.51 179.683 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.5 mt-10 -101.49 -71.57 0.71 Allowed 'General case' 0 C--N 1.319 -0.76 0 C-N-CA 122.861 0.465 . . . . 10.0 112.169 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 10.3 m-20 -107.18 56.38 0.64 Allowed 'General case' 0 C--O 1.24 0.586 0 CA-C-O 123.123 1.439 . . . . 10.0 112.893 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -71.26 -49.75 39.87 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 118.16 -2.838 . . . . 10.0 111.088 179.749 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -64.62 -36.63 84.88 Favored 'General case' 0 C--N 1.323 -0.565 0 O-C-N 119.396 -2.065 . . . . 10.0 115.633 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.68 -28.92 64.06 Favored 'General case' 0 C--O 1.216 -0.701 0 CA-C-O 122.95 1.357 . . . . 10.0 111.752 179.508 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.429 ' CE1' HD11 ' A' ' 23' ' ' LEU . 4.5 t80 -67.58 -42.96 81.7 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 113.142 -1.844 . . . . 10.0 111.447 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.518 ' HA ' HD12 ' A' ' 23' ' ' LEU . 46.9 mt -75.73 -22.35 56.65 Favored 'General case' 0 C--O 1.212 -0.902 0 O-C-N 120.989 -1.07 . . . . 10.0 110.817 179.739 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.34 -21.53 56.03 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 112.883 -1.962 . . . . 10.0 106.44 179.682 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.8 -35.71 59.98 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-O 125.194 2.426 . . . . 10.0 111.151 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.518 HD12 ' HA ' ' A' ' 20' ' ' LEU . 0.5 OUTLIER -89.41 -7.74 54.51 Favored 'General case' 0 CA--C 1.546 0.808 0 O-C-N 120.265 -1.522 . . . . 10.0 114.618 179.753 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 64.78 38.34 6.84 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 124.232 1.968 . . . . 10.0 113.606 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.555 ' CG2' HD23 ' A' ' 29' ' ' LEU . 0.3 OUTLIER -68.22 160.47 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.709 0 N-CA-C 105.161 -2.162 . . . . 10.0 105.161 -179.909 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 13.0 p30 -63.0 160.14 15.62 Favored 'General case' 0 C--O 1.242 0.663 0 O-C-N 125.412 1.695 . . . . 10.0 114.557 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -67.95 -35.24 71.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 N-CA-C 115.925 1.824 . . . . 10.0 115.925 -179.365 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.449 ' O ' HD12 ' A' ' 32' ' ' ILE . . . -72.66 -34.72 67.44 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 121.259 -0.9 . . . . 10.0 112.086 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.641 HD21 HG22 ' A' ' 77' ' ' ILE . 32.8 tp -66.18 -31.02 71.61 Favored 'General case' 0 C--N 1.32 -0.679 0 O-C-N 120.153 -1.592 . . . . 10.0 112.093 -179.719 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 7.7 ttp180 -78.04 -29.83 49.55 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 113.757 -1.565 . . . . 10.0 109.563 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -78.86 -41.08 30.82 Favored 'General case' 0 N--CA 1.466 0.328 0 O-C-N 124.431 1.082 . . . . 10.0 111.608 -179.783 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.449 HD12 ' O ' ' A' ' 28' ' ' ALA . 1.2 mp -74.72 -30.47 24.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 CA-C-N 113.698 -1.592 . . . . 10.0 109.449 -179.788 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -76.8 -52.23 9.91 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 115.691 1.737 . . . . 10.0 115.691 179.792 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 16.8 p30 -45.65 -23.96 0.3 Allowed 'General case' 0 C--O 1.217 -0.628 0 N-CA-C 115.409 1.633 . . . . 10.0 115.409 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.0 mt -73.56 -46.95 44.37 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-O 124.198 1.951 . . . . 10.0 111.1 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.6 pp -97.51 -178.91 4.29 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 113.783 -1.553 . . . . 10.0 109.815 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 18.8 mttt -142.43 138.53 16.52 Favored Pre-proline 0 N--CA 1.468 0.438 0 N-CA-C 104.293 -2.484 . . . . 10.0 104.293 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -68.83 108.83 1.98 Allowed 'Trans proline' 0 N--CA 1.45 -1.055 0 C-N-CA 124.782 3.655 . . . . 10.0 119.018 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -88.26 136.32 33.03 Favored 'General case' 0 C--O 1.219 -0.521 0 N-CA-C 105.38 -2.082 . . . . 10.0 105.38 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.9 mttm -119.06 138.81 52.61 Favored 'General case' 0 C--O 1.211 -0.922 0 CA-C-O 123.417 1.579 . . . . 10.0 112.29 179.682 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -134.61 128.36 33.03 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 103.544 -2.761 . . . . 10.0 103.544 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 17.5 mt -118.01 136.84 53.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 O-C-N 125.843 1.964 . . . . 10.0 110.992 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 48.7 t -128.79 103.84 10.28 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.38 0 N-CA-C 105.162 -2.162 . . . . 10.0 105.162 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.26 142.84 27.92 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-O 123.374 1.559 . . . . 10.0 111.804 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -132.45 167.45 19.93 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 102.725 -3.065 . . . . 10.0 102.725 -179.699 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -67.9 118.43 9.65 Favored Glycine 0 C--O 1.246 0.862 0 CA-C-O 117.685 -1.619 . . . . 10.0 109.443 179.813 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 62.74 18.75 10.91 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 119.198 1.499 . . . . 10.0 112.695 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' HIS . . . . . 0.597 ' CD2' HE21 ' A' ' 65' ' ' GLN . 0.0 OUTLIER -156.76 119.98 4.15 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 105.837 -1.912 . . . . 10.0 105.837 179.954 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.62 ' CE ' HD11 ' A' ' 93' ' ' LEU . 5.6 ttp -118.88 159.61 23.45 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 114.794 -1.094 . . . . 10.0 112.226 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.63 ' C ' HD13 ' A' ' 51' ' ' ILE . 35.0 mt -145.41 135.45 18.59 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 N-CA-C 108.095 -1.076 . . . . 10.0 108.095 179.746 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.63 HD13 ' C ' ' A' ' 50' ' ' ILE . 2.3 mm -117.42 129.17 74.33 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 N-CA-C 105.262 -2.125 . . . . 10.0 105.262 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.9 mtp-105 -121.85 106.26 11.11 Favored 'General case' 0 N--CA 1.437 -1.091 0 O-C-N 124.338 1.024 . . . . 10.0 113.588 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.3 m -80.81 128.78 34.05 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 101.17 -3.641 . . . . 10.0 101.17 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 64.2 mt -132.94 76.46 1.68 Allowed 'General case' 0 N--CA 1.448 -0.549 1 N-CA-C 122.559 4.281 . . . . 10.0 122.559 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -110.18 129.33 55.73 Favored 'General case' 0 C--O 1.242 0.66 0 C-N-CA 124.992 1.317 . . . . 10.0 107.942 -179.737 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 22.9 p -61.41 89.11 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.728 0 O-C-N 125.145 1.528 . . . . 10.0 109.465 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 3.0 t80 174.11 -69.52 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 126.796 2.56 . . . . 10.0 109.71 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 40.2 ttm180 -148.21 105.72 3.67 Favored 'General case' 0 C--N 1.344 0.368 0 O-C-N 125.246 1.591 . . . . 10.0 114.758 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -91.04 123.86 34.83 Favored 'General case' 0 C--N 1.319 -0.722 0 O-C-N 125.182 1.551 . . . . 10.0 112.668 -179.746 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.407 ' CD1' ' O ' ' A' ' 60' ' ' TYR . 0.1 OUTLIER -118.09 120.68 38.49 Favored 'General case' 0 C--O 1.211 -0.931 0 N-CA-C 104.041 -2.577 . . . . 10.0 104.041 179.697 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.0 mm -108.56 156.61 9.08 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.476 0 O-C-N 119.049 -2.282 . . . . 10.0 111.895 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' MET . . . . . 0.49 ' O ' HG23 ' A' ' 50' ' ' ILE . 0.7 OUTLIER -136.18 -169.07 2.35 Favored 'General case' 0 C--O 1.219 -0.551 0 CA-C-N 112.86 -1.973 . . . . 10.0 107.819 -179.938 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 12.3 t0 -170.62 77.42 0.08 Allowed 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 101.598 -3.482 . . . . 10.0 101.598 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.499 ' CD1' ' CD2' ' A' ' 70' ' ' PHE . 66.4 m-85 -62.96 175.13 0.91 Allowed 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 114.722 1.379 . . . . 10.0 114.722 -179.891 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.597 HE21 ' CD2' ' A' ' 48' ' ' HIS . 1.7 mm-40 -134.75 94.05 3.12 Favored 'General case' 0 C--O 1.217 -0.65 0 N-CA-C 104.451 -2.425 . . . . 10.0 104.451 179.517 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 5.3 t -59.99 120.12 5.29 Favored 'Isoleucine or valine' 0 C--O 1.245 0.862 0 O-C-N 124.268 0.98 . . . . 10.0 112.961 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 105.66 23.35 7.56 Favored Glycine 0 CA--C 1.532 1.149 0 CA-C-N 114.903 -1.044 . . . . 10.0 114.957 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -172.43 143.5 1.4 Allowed 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 116.795 -1.574 . . . . 10.0 114.701 179.78 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.3 118.31 3.72 Favored 'General case' 0 C--N 1.319 -0.747 0 O-C-N 125.333 1.646 . . . . 10.0 108.61 179.757 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.499 ' CD2' ' CD1' ' A' ' 64' ' ' PHE . 81.8 t80 -91.83 -34.29 14.61 Favored 'General case' 0 C--O 1.239 0.525 0 CA-C-N 113.122 -1.854 . . . . 10.0 112.824 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 72.6 161.76 0.25 Allowed 'General case' 0 C--O 1.217 -0.649 0 N-CA-C 105.513 -2.032 . . . . 10.0 105.513 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.492 ' OE1' HD23 ' A' ' 74' ' ' LEU . 32.8 mt-10 -136.85 -46.92 0.59 Allowed 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 114.779 1.4 . . . . 10.0 114.779 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 56.52 28.03 13.19 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 108.405 -0.961 . . . . 10.0 108.405 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.498 HD13 ' H ' ' A' ' 75' ' ' THR . 0.2 OUTLIER -39.57 143.25 0.23 Allowed 'General case' 0 C--N 1.313 -1.009 0 N-CA-C 116.917 2.191 . . . . 10.0 116.917 -179.95 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.498 ' H ' HD13 ' A' ' 74' ' ' LEU . 0.2 OUTLIER -165.84 107.62 0.75 Allowed 'General case' 0 C--O 1.241 0.626 0 N-CA-C 107.314 -1.365 . . . . 10.0 107.314 179.755 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 162.26 -54.88 0.3 Allowed Glycine 0 N--CA 1.438 -1.177 0 N-CA-C 108.988 -1.645 . . . . 10.0 108.988 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.641 HG22 HD21 ' A' ' 29' ' ' LEU . 1.2 pt -121.77 142.94 36.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 N-CA-C 103.441 -2.8 . . . . 10.0 103.441 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.431 ' HA ' HG23 ' A' ' 25' ' ' VAL . 23.5 t0 64.7 -68.5 0.1 Allowed 'General case' 0 N--CA 1.443 -0.804 0 O-C-N 125.712 1.883 . . . . 10.0 113.918 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 81.83 70.52 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.572 0 O-C-N 126.309 2.255 . . . . 10.0 111.46 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 6.3 mtm180 -121.68 -171.96 2.33 Favored 'General case' 0 C--O 1.236 0.358 0 O-C-N 120.506 -1.371 . . . . 10.0 112.733 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 5.4 mtpm? -139.27 135.77 34.2 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 103.439 -2.801 . . . . 10.0 103.439 -179.743 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 27.5 p -172.22 159.08 4.7 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-O 123.014 1.388 . . . . 10.0 108.993 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -107.05 108.45 19.94 Favored 'General case' 0 N--CA 1.441 -0.923 1 N-CA-C 98.381 -4.674 . . . . 10.0 98.381 -179.726 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 17.7 m -105.04 112.79 26.05 Favored 'General case' 0 N--CA 1.445 -0.693 0 O-C-N 126.805 2.566 . . . . 10.0 116.641 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 25.5 m -106.72 115.66 30.57 Favored 'General case' 0 N--CA 1.439 -0.979 0 O-C-N 125.892 1.995 . . . . 10.0 109.284 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 58.1 t -86.76 143.21 11.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 104.625 -2.361 . . . . 10.0 104.625 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 39.1 t -163.73 133.17 4.01 Favored 'General case' 0 C--O 1.243 0.759 0 CA-C-N 113.986 -1.461 . . . . 10.0 111.712 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -82.61 126.22 32.07 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 119.573 -0.851 . . . . 10.0 110.08 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -75.28 -37.95 60.65 Favored 'General case' 0 C--N 1.313 -1.002 1 N-CA-C 98.803 -4.518 . . . . 10.0 98.803 179.868 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 163.04 -73.75 0.19 Allowed Glycine 0 C--N 1.333 0.4 0 N-CA-C 106.015 -2.834 . . . . 10.0 106.015 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -106.57 8.45 31.29 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.092 -0.643 . . . . 10.0 109.669 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.5 121.04 21.59 Favored 'General case' 0 N--CA 1.442 -0.846 0 N-CA-C 109.195 -0.669 . . . . 10.0 109.195 -179.847 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.62 HD11 ' CE ' ' A' ' 49' ' ' MET . 0.3 OUTLIER -84.24 83.32 8.01 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 104.931 -2.248 . . . . 10.0 104.931 -179.998 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -86.05 139.45 31.14 Favored 'General case' 0 C--O 1.212 -0.881 0 CA-C-N 113.051 -1.886 . . . . 10.0 113.663 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -130.86 146.05 52.17 Favored 'General case' 0 C--O 1.241 0.631 0 CA-C-N 113.521 -1.672 . . . . 10.0 109.616 -179.753 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 9.1 p -121.16 142.41 37.43 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 N-CA-C 104.765 -2.309 . . . . 10.0 104.765 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -148.82 94.43 2.26 Favored 'General case' 0 C--N 1.321 -0.656 0 O-C-N 125.106 1.504 . . . . 10.0 109.557 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.87 119.88 8.54 Favored 'General case' 0 C--O 1.213 -0.833 0 O-C-N 121.055 -1.028 . . . . 10.0 112.448 -179.697 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -134.77 -160.37 9.08 Favored Glycine 0 C--N 1.312 -0.782 0 CA-C-O 117.808 -1.551 . . . . 10.0 110.62 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -90.33 4.48 50.67 Favored 'General case' 0 C--N 1.316 -0.873 0 O-C-N 126.7 2.059 . . . . 10.0 115.723 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 11.1 mmtt -107.86 -176.27 3.01 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 115.342 1.608 . . . . 10.0 115.342 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -67.31 -60.89 2.21 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 125.546 1.779 . . . . 10.0 108.659 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -141.91 127.28 3.22 Favored Glycine 0 C--N 1.338 0.681 0 N-CA-C 117.639 1.815 . . . . 10.0 117.639 179.775 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -144.45 127.92 16.96 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-O 117.734 -1.127 . . . . 10.0 109.343 -179.655 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 176.49 160.68 24.11 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 109.21 -1.556 . . . . 10.0 109.21 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 38.6 m0 -116.48 105.29 12.32 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 123.321 0.648 . . . . 10.0 109.726 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.4 m -98.69 77.03 2.24 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 107.518 -1.29 . . . . 10.0 107.518 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.435 ' HG3' HD13 ' A' ' 117' ' ' LEU . 14.5 mp0 -72.02 111.69 7.47 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 122.743 1.259 . . . . 10.0 108.468 -179.754 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 4.4 t90 -113.53 109.31 18.44 Favored 'General case' 0 C--O 1.214 -0.804 0 O-C-N 120.557 -1.34 . . . . 10.0 110.934 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.434 HD12 ' CE1' ' A' ' 4' ' ' PHE . 10.3 mt -76.58 148.09 7.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 116.568 2.062 . . . . 10.0 116.568 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -130.84 58.66 1.69 Allowed 'General case' 0 C--O 1.219 -0.523 0 N-CA-C 105.429 -2.063 . . . . 10.0 105.429 -179.833 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 65.66 -94.24 0.19 Allowed Glycine 0 C--O 1.22 -0.777 0 N-CA-C 109.785 -1.326 . . . . 10.0 109.785 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -89.6 29.1 1.18 Allowed 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 122.838 1.304 . . . . 10.0 111.787 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -152.63 163.9 38.72 Favored 'General case' 0 CA--C 1.503 -0.827 0 O-C-N 120.736 -1.228 . . . . 10.0 114.082 179.709 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.577 HD12 ' CE2' ' A' ' 8' ' ' TRP . 2.4 tt -134.37 108.74 8.35 Favored 'General case' 0 N--CA 1.437 -1.12 0 O-C-N 126.201 2.188 . . . . 10.0 106.375 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -103.83 99.64 9.42 Favored 'General case' 0 C--O 1.212 -0.909 0 N-CA-C 105.53 -2.026 . . . . 10.0 105.53 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.435 HD13 ' HG3' ' A' ' 108' ' ' GLN . 17.2 tp -99.7 123.75 44.28 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 115.413 1.634 . . . . 10.0 115.413 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -99.66 73.7 1.82 Allowed 'General case' 0 N--CA 1.446 -0.665 0 O-C-N 123.479 0.487 . . . . 10.0 110.424 179.846 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 13.9 ttp -57.03 140.7 48.27 Favored 'General case' 0 N--CA 1.449 -0.516 0 O-C-N 124.4 1.063 . . . . 10.0 108.143 -179.703 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -125.64 156.04 39.85 Favored 'General case' 0 C--N 1.322 -0.621 0 O-C-N 125.928 2.018 . . . . 10.0 109.884 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 178.9 117.85 0.04 OUTLIER 'General case' 0 C--O 1.216 -0.662 0 O-C-N 126.545 2.403 . . . . 10.0 109.241 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 50.85 34.64 10.64 Favored 'General case' 0 N--CA 1.445 -0.72 0 O-C-N 125.447 1.717 . . . . 10.0 113.007 -179.899 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 85.02 -3.41 87.27 Favored Glycine 0 C--N 1.339 0.707 0 CA-C-O 122.385 0.992 . . . . 10.0 113.348 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 24.7 t -95.12 111.16 25.2 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 N-CA-C 107.632 -1.247 . . . . 10.0 107.632 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 4.1 m -101.1 106.25 17.5 Favored 'General case' 0 N--CA 1.442 -0.859 0 C-N-CA 125.468 1.507 . . . . 10.0 112.004 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -105.5 147.33 28.45 Favored 'General case' 0 C--O 1.214 -0.769 0 N-CA-C 105.047 -2.205 . . . . 10.0 105.047 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 7.8 mtpt -114.55 149.5 36.39 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 123.317 0.647 . . . . 10.0 110.739 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' GLN . . . . . 0.416 ' NE2' ' CZ ' ' A' ' 130' ' ' PHE . 0.1 OUTLIER -138.52 115.8 11.11 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 118.047 -0.978 . . . . 10.0 109.553 179.942 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 21.3 t -97.26 106.24 18.25 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.28 0 O-C-N 126.659 2.475 . . . . 10.0 110.885 -179.661 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 130' ' ' PHE . . . . . 0.467 ' HA ' ' HA ' ' A' ' 10' ' ' MET . 96.3 m-85 -92.75 172.65 8.21 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 106.58 -1.637 . . . . 10.0 106.58 179.827 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 46.5 tptt -140.88 122.13 14.83 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 107.014 -1.476 . . . . 10.0 107.014 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 18.4 ttpt -68.04 138.84 56.14 Favored 'General case' 0 C--O 1.218 -0.572 0 CA-C-N 120.169 1.35 . . . . 10.0 107.951 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -154.03 54.41 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.241 0.646 0 O-C-N 126.069 2.106 . . . . 10.0 111.139 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.441 -0.884 0 CA-C-O 116.392 -1.766 . . . . 10.0 111.925 -179.831 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.521 -0.135 0 CA-C-O 122.661 1.219 . . . . 10.0 109.664 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.406 ' HB3' ' HB ' ' A' ' 42' ' ' ILE . 99.0 m-85 -91.73 -17.39 25.5 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 117.447 2.388 . . . . 10.0 117.447 179.863 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 8.8 m120 -54.19 113.82 1.39 Allowed 'General case' 0 N--CA 1.477 0.89 0 CA-C-O 122.985 1.374 . . . . 10.0 112.858 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -177.61 -110.84 0.28 Allowed Glycine 0 C--N 1.347 1.163 0 N-CA-C 117.704 1.841 . . . . 10.0 117.704 179.75 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.574 ' O ' HG23 ' A' ' 133' ' ' VAL . 0.2 OUTLIER 173.09 93.99 0.01 OUTLIER 'General case' 0 C--O 1.241 0.621 0 N-CA-C 102.767 -3.049 . . . . 10.0 102.767 -179.846 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 10.0 m95 -94.38 105.48 17.45 Favored 'General case' 0 C--O 1.215 -0.724 0 CA-C-N 114.282 -1.326 . . . . 10.0 112.382 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.99 -163.5 0.04 OUTLIER 'General case' 0 C--O 1.239 0.53 0 C-N-CA 118.923 -1.111 . . . . 10.0 109.401 179.789 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -128.7 134.7 48.56 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.406 0.622 . . . . 10.0 112.628 179.813 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -99.73 -63.09 1.16 Allowed 'General case' 0 C--O 1.236 0.352 0 N-CA-C 108.853 -0.795 . . . . 10.0 108.853 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -132.52 173.77 10.97 Favored 'General case' 0 CA--C 1.511 -0.532 0 O-C-N 126.771 2.544 . . . . 10.0 114.59 -179.533 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 23.8 p-10 -150.11 172.48 15.21 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 113.906 -1.497 . . . . 10.0 107.641 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -157.6 132.68 8.79 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 114.673 1.36 . . . . 10.0 114.673 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 52.32 42.95 31.19 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 122.691 1.234 . . . . 10.0 112.425 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -69.36 -44.41 71.62 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 115.004 1.483 . . . . 10.0 115.004 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -71.9 -34.18 68.92 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-O 122.69 1.233 . . . . 10.0 113.758 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 -77.44 -20.35 54.66 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 117.651 -1.166 . . . . 10.0 109.371 179.499 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.751 ' CE1' HD11 ' A' ' 23' ' ' LEU . 0.1 OUTLIER -76.19 -42.81 45.09 Favored 'General case' 0 CA--C 1.552 1.032 0 O-C-N 126.976 2.673 . . . . 10.0 108.537 179.968 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.634 HD12 ' HA ' ' A' ' 30' ' ' ARG . 3.0 mt -72.03 -21.41 61.54 Favored 'General case' 0 C--O 1.211 -0.947 0 O-C-N 120.764 -1.21 . . . . 10.0 113.211 -179.826 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.6 ttm180 -78.52 -25.37 45.54 Favored 'General case' 0 C--O 1.243 0.737 0 N-CA-C 106.252 -1.759 . . . . 10.0 106.252 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.437 ' HB3' ' O ' ' A' ' 19' ' ' TYR . . . -63.81 -47.23 81.7 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.86 1.059 . . . . 10.0 113.86 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.751 HD11 ' CE1' ' A' ' 19' ' ' TYR . 0.4 OUTLIER -87.36 -6.4 58.49 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 119.25 0.932 . . . . 10.0 110.355 -179.705 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 71.48 19.04 5.3 Favored 'General case' 0 C--O 1.224 -0.273 0 O-C-N 123.815 0.697 . . . . 10.0 111.734 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.448 HG23 ' H ' ' A' ' 78' ' ' ASP . 10.0 p -59.04 163.54 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.219 0 N-CA-C 105.621 -1.992 . . . . 10.0 105.621 -179.833 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -41.81 148.31 0.17 Allowed 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 115.38 1.622 . . . . 10.0 115.38 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 2.9 p -73.32 -23.24 19.66 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.66 0 O-C-N 119.441 -2.037 . . . . 10.0 114.021 -179.852 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -73.98 -23.75 59.51 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 109.554 -0.535 . . . . 10.0 109.554 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -71.04 -45.49 63.77 Favored 'General case' 0 C--O 1.218 -0.566 0 O-C-N 126.317 2.261 . . . . 10.0 112.694 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.634 ' HA ' HD12 ' A' ' 20' ' ' LEU . 0.0 OUTLIER -68.15 -30.99 70.25 Favored 'General case' 0 CA--C 1.512 -0.499 0 O-C-N 125.107 1.504 . . . . 10.0 111.47 179.986 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.19 -44.72 59.37 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 108.647 -0.871 . . . . 10.0 108.647 -179.623 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 5.4 mt -76.21 -30.54 20.24 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 N-CA-C 108.109 -1.071 . . . . 10.0 108.109 -179.64 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -49.94 -61.57 2.06 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 127.977 3.298 . . . . 10.0 110.403 179.505 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.661 ' O ' HD12 ' A' ' 35' ' ' LEU . 14.5 t-20 -52.86 154.93 2.57 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 116.134 -1.888 . . . . 10.0 108.632 179.497 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.661 HD12 ' O ' ' A' ' 34' ' ' ASN . 0.4 OUTLIER 77.3 -39.21 0.31 Allowed 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 120.16 1.345 . . . . 10.0 113.167 -179.248 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -100.48 139.68 35.82 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 120.068 1.304 . . . . 10.0 110.948 179.693 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 14.9 mttt -127.13 111.82 21.62 Favored Pre-proline 0 CA--C 1.535 0.404 0 CA-C-O 123.151 1.453 . . . . 10.0 107.677 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -60.04 105.88 0.31 Allowed 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 123.307 2.671 . . . . 10.0 115.954 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.58 -177.98 1.67 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 118.31 0.504 . . . . 10.0 109.687 179.847 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.0 tptt -140.44 153.0 46.12 Favored 'General case' 0 C--N 1.314 -0.966 0 O-C-N 121.043 -1.036 . . . . 10.0 109.526 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.415 ' HB2' HD12 ' A' ' 54' ' ' LEU . 17.0 tt0 -154.6 69.68 0.76 Allowed 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 104.143 -2.54 . . . . 10.0 104.143 -179.894 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.453 HG22 ' N ' ' A' ' 43' ' ' VAL . 25.4 mm -56.99 152.21 2.7 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.01 0 O-C-N 121.791 -0.568 . . . . 10.0 112.181 -179.727 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.453 ' N ' HG22 ' A' ' 42' ' ' ILE . 0.0 OUTLIER -146.49 95.29 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 N-CA-C 104.461 -2.422 . . . . 10.0 104.461 179.969 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 55.8 tt0 -122.78 118.76 28.76 Favored 'General case' 0 C--O 1.218 -0.597 0 O-C-N 119.846 -1.784 . . . . 10.0 108.634 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -69.02 -85.89 0.02 OUTLIER 'General case' 0 C--O 1.236 0.387 0 N-CA-C 105.638 -1.986 . . . . 10.0 105.638 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -160.45 -54.79 0.01 OUTLIER Glycine 0 N--CA 1.461 0.348 0 N-CA-C 106.192 -2.763 . . . . 10.0 106.192 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.9 m-20 -100.78 4.4 42.92 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 108.643 -0.873 . . . . 10.0 108.643 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 62.0 m-70 -142.07 174.2 10.82 Favored 'General case' 0 N--CA 1.438 -1.049 0 CA-C-O 117.82 -1.086 . . . . 10.0 110.246 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 14.0 ttp -149.22 165.07 32.98 Favored 'General case' 0 N--CA 1.441 -0.91 0 C-N-CA 118.699 -1.201 . . . . 10.0 111.806 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.437 ' C ' HD12 ' A' ' 51' ' ' ILE . 6.8 mm -149.25 123.5 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 103.563 -2.754 . . . . 10.0 103.563 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.437 HD12 ' C ' ' A' ' 50' ' ' ILE . 1.6 mp -110.51 133.23 56.6 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 N-CA-C 107.833 -1.173 . . . . 10.0 107.833 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.478 HH21 HD21 ' A' ' 54' ' ' LEU . 63.6 mtp180 -127.36 146.87 50.31 Favored 'General case' 0 C--O 1.214 -0.763 0 N-CA-C 109.021 -0.733 . . . . 10.0 109.021 179.828 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 18.4 m -128.22 108.21 10.42 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 102.402 -3.184 . . . . 10.0 102.402 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.478 HD21 HH21 ' A' ' 52' ' ' ARG . 11.0 mt -105.26 99.24 8.86 Favored 'General case' 0 C--N 1.32 -0.707 1 N-CA-C 122.095 4.109 . . . . 10.0 122.095 -179.775 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.5 m -129.94 173.29 10.83 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 104.879 -2.267 . . . . 10.0 104.879 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 32.5 p -101.49 31.5 3.73 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 107.211 -1.403 . . . . 10.0 107.211 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -124.5 -43.85 2.01 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-O 118.277 -0.868 . . . . 10.0 110.123 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -176.3 137.38 0.29 Allowed 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 118.006 -0.997 . . . . 10.0 112.389 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -101.55 171.07 7.79 Favored 'General case' 0 C--O 1.241 0.621 0 O-C-N 125.012 1.445 . . . . 10.0 113.81 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -130.32 117.25 19.49 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 104.533 -2.395 . . . . 10.0 104.533 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 26.0 mm -122.8 112.86 35.78 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 N-CA-C 115.024 1.49 . . . . 10.0 115.024 179.819 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 3.2 mmt -130.67 178.25 6.78 Favored 'General case' 0 C--O 1.212 -0.876 0 CA-C-O 123.507 1.622 . . . . 10.0 108.372 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -151.59 107.53 3.4 Favored 'General case' 0 N--CA 1.437 -1.102 0 N-CA-C 101.929 -3.36 . . . . 10.0 101.929 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -107.73 174.31 5.94 Favored 'General case' 0 C--O 1.247 0.964 0 N-CA-C 116.854 2.168 . . . . 10.0 116.854 -179.745 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 5.7 mm100 -126.06 115.27 19.58 Favored 'General case' 0 N--CA 1.444 -0.743 0 N-CA-C 104.934 -2.247 . . . . 10.0 104.934 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 3.4 t -71.12 95.25 0.49 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.728 0 N-CA-C 109.218 -0.66 . . . . 10.0 109.218 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 112.29 55.74 0.46 Allowed Glycine 0 CA--C 1.532 1.131 0 C-N-CA 124.705 1.145 . . . . 10.0 115.46 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -174.06 121.9 0.3 Allowed 'General case' 0 C--O 1.236 0.388 0 C-N-CA 123.386 0.674 . . . . 10.0 112.562 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -56.08 135.81 52.65 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 124.521 1.128 . . . . 10.0 112.708 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -120.5 -174.66 2.85 Favored 'General case' 0 N--CA 1.437 -1.085 0 C-N-CA 124.165 0.986 . . . . 10.0 110.74 -179.769 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -148.9 66.72 1.04 Allowed 'General case' 0 C--N 1.312 -1.039 0 N-CA-C 108.149 -1.056 . . . . 10.0 108.149 179.639 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -51.4 118.39 3.26 Favored 'General case' 0 CA--C 1.509 -0.624 0 O-C-N 124.682 1.239 . . . . 10.0 111.529 179.776 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -71.54 -36.91 71.14 Favored 'General case' 0 C--N 1.318 -0.768 0 O-C-N 125.539 1.774 . . . . 10.0 110.544 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 19.4 mt 41.76 71.71 0.2 Allowed 'General case' 0 N--CA 1.441 -0.88 0 C-N-CA 124.813 1.245 . . . . 10.0 114.268 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -113.79 116.75 29.85 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 106.722 -1.584 . . . . 10.0 106.722 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 140.35 -67.84 0.49 Allowed Glycine 0 N--CA 1.444 -0.825 0 CA-C-O 118.778 -1.012 . . . . 10.0 111.361 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -111.14 147.15 15.35 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 N-CA-C 105.539 -2.022 . . . . 10.0 105.539 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.448 ' H ' HG23 ' A' ' 25' ' ' VAL . 77.7 m-20 55.28 16.5 1.71 Allowed 'General case' 0 N--CA 1.443 -0.8 0 CA-C-O 116.019 -1.943 . . . . 10.0 113.414 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -2.35 68.41 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 118.062 2.615 . . . . 10.0 118.062 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.64 -163.43 1.37 Allowed 'General case' 0 N--CA 1.452 -0.337 0 O-C-N 119.936 -1.727 . . . . 10.0 111.868 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 2.1 tptp -153.18 147.64 25.98 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 102.998 -2.964 . . . . 10.0 102.998 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 5.7 p -158.84 140.6 13.55 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 122.395 1.093 . . . . 10.0 110.562 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.1 ttt -93.77 67.6 3.84 Favored 'General case' 0 N--CA 1.441 -0.895 0 N-CA-C 102.797 -3.038 . . . . 10.0 102.797 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.552 HG23 ' N ' ' A' ' 85' ' ' THR . 0.6 OUTLIER -50.89 166.21 0.09 Allowed 'General case' 0 N--CA 1.434 -1.263 0 CA-C-N 112.958 -1.928 . . . . 10.0 115.479 179.921 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.552 ' N ' HG23 ' A' ' 84' ' ' THR . 0.2 OUTLIER -164.27 106.05 0.89 Allowed 'General case' 0 N--CA 1.442 -0.842 0 N-CA-C 108.217 -1.031 . . . . 10.0 108.217 179.608 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.459 ' CG1' HD11 ' A' ' 93' ' ' LEU . 32.6 t -108.15 118.05 54.99 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.974 0 N-CA-C 103.237 -2.875 . . . . 10.0 103.237 -179.903 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -124.65 149.44 47.13 Favored 'General case' 0 C--N 1.315 -0.895 0 O-C-N 124.786 1.304 . . . . 10.0 114.483 -179.868 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 4.0 t90 -85.4 127.88 34.53 Favored 'General case' 0 C--N 1.329 -0.319 0 O-C-N 121.567 -0.708 . . . . 10.0 110.055 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -92.24 -55.33 3.47 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 101.434 -3.543 . . . . 10.0 101.434 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 146.59 -76.87 0.26 Allowed Glycine 0 C--O 1.245 0.787 0 N-CA-C 107.691 -2.164 . . . . 10.0 107.691 179.659 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.0 -24.12 67.59 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 114.837 -0.681 . . . . 10.0 111.078 -179.768 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.33 168.08 23.51 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-O 122.249 1.023 . . . . 10.0 110.129 179.831 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.68 HD13 ' N ' ' A' ' 94' ' ' GLN . 1.5 tm? -108.81 136.9 47.6 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 104.298 -2.482 . . . . 10.0 104.298 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' GLN . . . . . 0.68 ' N ' HD13 ' A' ' 93' ' ' LEU . 0.5 OUTLIER -138.33 145.25 40.95 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 118.772 0.715 . . . . 10.0 110.199 -179.911 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 6.7 m -123.03 159.98 27.27 Favored 'General case' 0 CA--C 1.505 -0.784 0 O-C-N 126.163 2.165 . . . . 10.0 114.129 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -159.02 128.75 0.75 Allowed 'Isoleucine or valine' 0 C--O 1.246 0.903 0 N-CA-C 105.134 -2.173 . . . . 10.0 105.134 -179.662 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -132.6 140.05 48.06 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 122.673 1.225 . . . . 10.0 110.998 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -86.92 179.69 6.67 Favored 'General case' 0 C--N 1.343 0.297 0 N-CA-C 115.013 1.486 . . . . 10.0 115.013 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 142.37 -157.01 26.44 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.972 -0.632 . . . . 10.0 112.281 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -89.03 -17.04 30.19 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 118.387 2.736 . . . . 10.0 118.387 179.725 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 17.3 mmtt -81.96 179.55 7.78 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 115.203 1.557 . . . . 10.0 115.203 -179.766 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -108.71 14.87 24.1 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 126.764 2.026 . . . . 10.0 113.004 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -148.24 -88.24 0.07 OUTLIER Glycine 0 C--N 1.342 0.914 0 CA-C-N 113.547 -1.661 . . . . 10.0 114.549 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 6.2 mtp180 31.71 92.17 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.808 0 O-C-N 126.912 2.183 . . . . 10.0 114.889 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 169.97 149.88 6.57 Favored Glycine 0 N--CA 1.441 -0.97 0 N-CA-C 110.085 -1.206 . . . . 10.0 110.085 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -112.26 168.08 9.91 Favored 'General case' 0 C--N 1.32 -0.679 0 O-C-N 120.64 -1.506 . . . . 10.0 109.257 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.7 m -151.01 120.06 6.7 Favored 'General case' 0 C--O 1.215 -0.72 0 N-CA-C 107.703 -1.221 . . . . 10.0 107.703 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -117.38 102.0 8.87 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 124.426 2.06 . . . . 10.0 114.738 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' TRP . . . . . 0.489 ' CD1' ' C ' ' A' ' 109' ' ' TRP . 0.0 OUTLIER -111.99 133.48 54.14 Favored 'General case' 0 C--O 1.217 -0.645 0 O-C-N 119.6 -1.938 . . . . 10.0 107.333 179.956 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 33.1 mt -98.93 142.13 15.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 O-C-N 126.603 2.439 . . . . 10.0 114.4 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -130.57 97.29 4.34 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 104.619 -2.363 . . . . 10.0 104.619 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 55.61 -118.13 10.04 Favored Glycine 0 C--O 1.221 -0.714 0 N-CA-C 109.721 -1.351 . . . . 10.0 109.721 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -92.4 12.72 21.76 Favored 'General case' 0 C--N 1.327 -0.392 0 O-C-N 126.06 1.682 . . . . 10.0 111.277 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -109.74 -179.18 3.74 Favored 'General case' 0 CA--C 1.513 -0.448 0 CA-C-O 117.701 -1.142 . . . . 10.0 111.234 179.807 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.707 HD23 ' CG ' ' A' ' 130' ' ' PHE . 2.3 tp -157.0 117.97 3.66 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 127.128 2.171 . . . . 10.0 106.725 179.749 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -104.47 121.21 42.96 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 106.367 -1.716 . . . . 10.0 106.367 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 10.8 tp -106.16 132.48 52.18 Favored 'General case' 0 C--N 1.315 -0.895 0 O-C-N 123.285 0.366 . . . . 10.0 111.101 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -119.25 100.53 7.38 Favored 'General case' 0 C--N 1.315 -0.893 0 O-C-N 125.149 1.531 . . . . 10.0 107.694 -179.664 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.537 ' HE1' ' CZ ' ' A' ' 19' ' ' TYR . 1.3 tmm? -109.55 136.67 48.55 Favored 'General case' 0 N--CA 1.444 -0.767 0 O-C-N 124.767 1.292 . . . . 10.0 109.372 -179.885 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -124.03 147.76 47.58 Favored 'General case' 0 C--N 1.315 -0.922 0 O-C-N 125.947 2.03 . . . . 10.0 113.172 179.756 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -156.17 131.49 9.41 Favored 'General case' 0 CA--C 1.501 -0.916 0 O-C-N 124.473 1.108 . . . . 10.0 109.314 179.803 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 47.42 29.5 1.35 Allowed 'General case' 0 C--N 1.319 -0.754 0 O-C-N 125.176 1.548 . . . . 10.0 114.409 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 93.6 -0.84 68.24 Favored Glycine 0 CA--C 1.528 0.881 0 N-CA-C 116.333 1.293 . . . . 10.0 116.333 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 21.2 t -107.21 158.9 7.0 Favored 'Isoleucine or valine' 0 C--O 1.242 0.676 0 N-CA-C 106.699 -1.593 . . . . 10.0 106.699 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -138.86 130.3 27.21 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 118.72 0.691 . . . . 10.0 111.94 -179.744 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 1.1 t -98.18 148.56 23.46 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 104.837 -2.282 . . . . 10.0 104.837 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 20.1 mtpt -126.83 111.48 14.24 Favored 'General case' 0 C--O 1.218 -0.605 0 O-C-N 125.491 1.744 . . . . 10.0 108.988 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -114.53 113.59 24.63 Favored 'General case' 0 N--CA 1.447 -0.622 0 O-C-N 127.287 2.867 . . . . 10.0 114.136 179.821 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 2.3 t -91.56 133.01 34.49 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.768 0 O-C-N 123.905 0.753 . . . . 10.0 109.043 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 130' ' ' PHE . . . . . 0.707 ' CG ' HD23 ' A' ' 115' ' ' LEU . 9.3 m-85 -121.58 177.62 5.16 Favored 'General case' 0 C--O 1.214 -0.802 0 C-N-CA 126.178 1.791 . . . . 10.0 107.259 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 4.9 ttpt -158.07 138.66 12.84 Favored 'General case' 0 N--CA 1.445 -0.715 0 O-C-N 126.281 2.238 . . . . 10.0 106.376 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 2.2 tttp -74.16 130.11 39.14 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 123.035 1.398 . . . . 10.0 108.692 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 133' ' ' VAL . . . . . 0.574 HG23 ' O ' ' A' ' 7' ' ' TYR . 2.1 t -96.83 -0.69 10.52 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 CA-C-N 114.846 -1.07 . . . . 10.0 109.219 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.24 0.604 0 O-C-N 126.773 2.545 . . . . 10.0 108.778 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.541 0.62 0 N-CA-C 113.857 1.058 . . . . 10.0 113.857 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -56.82 -28.7 61.92 Favored 'General case' 0 C--O 1.222 -0.358 0 N-CA-C 117.869 2.544 . . . . 10.0 117.869 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.4 p30 -52.46 153.15 3.14 Favored 'General case' 0 N--CA 1.478 0.962 0 O-C-N 125.75 1.906 . . . . 10.0 113.673 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 148.06 -140.91 8.71 Favored Glycine 0 C--N 1.336 0.533 0 N-CA-C 116.659 1.423 . . . . 10.0 116.659 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -144.17 156.9 44.51 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 103.392 -2.818 . . . . 10.0 103.392 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.751 ' CE2' HD22 ' A' ' 115' ' ' LEU . 3.8 m0 -160.11 72.73 0.5 Allowed 'General case' 0 C--N 1.315 -0.897 0 O-C-N 126.313 2.258 . . . . 10.0 113.202 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.31 113.83 1.73 Allowed 'General case' 0 C--O 1.238 0.458 0 N-CA-C 107.21 -1.404 . . . . 10.0 107.21 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -68.32 146.31 53.4 Favored 'General case' 0 CA--C 1.512 -0.51 0 O-C-N 119.338 -2.101 . . . . 10.0 113.424 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.0 mt -103.98 -46.56 4.44 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.994 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.5 t -155.31 153.82 31.13 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 116.182 1.919 . . . . 10.0 116.182 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -120.37 115.12 22.9 Favored 'General case' 0 C--N 1.318 -0.789 0 O-C-N 127.059 2.725 . . . . 10.0 104.508 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -92.68 139.22 30.78 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 120.243 1.383 . . . . 10.0 112.923 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 8.2 m120 56.09 31.66 18.59 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 113.683 0.994 . . . . 10.0 113.683 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 22.0 t80 -67.5 -32.13 72.74 Favored 'General case' 0 CA--C 1.55 0.967 0 O-C-N 120.778 -1.201 . . . . 10.0 113.733 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.65 -37.43 42.06 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-O 122.729 1.252 . . . . 10.0 110.565 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.33 -20.22 60.18 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-O 123.897 1.808 . . . . 10.0 107.064 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -74.81 -39.26 61.78 Favored 'General case' 0 CA--C 1.553 1.093 0 CA-C-N 114.141 -1.391 . . . . 10.0 111.105 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.591 HD12 ' HG3' ' A' ' 30' ' ' ARG . 4.0 mt -78.02 -21.13 51.22 Favored 'General case' 0 C--O 1.21 -0.987 0 O-C-N 125.152 1.532 . . . . 10.0 109.73 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 26.9 ttp180 -77.27 -24.13 51.11 Favored 'General case' 0 C--O 1.245 0.846 0 CA-C-N 114.015 -1.448 . . . . 10.0 109.101 179.737 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.22 -51.46 67.68 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 126.224 1.809 . . . . 10.0 113.731 -179.632 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -110.78 6.98 21.84 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 119.094 0.861 . . . . 10.0 112.001 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 50.57 80.77 0.07 Allowed 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.795 1.035 . . . . 10.0 113.795 179.568 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.449 ' CG1' HD13 ' A' ' 20' ' ' LEU . 8.7 p -99.09 39.69 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.808 0 CA-C-N 115.162 -0.926 . . . . 10.0 110.074 -179.624 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 75.11 143.7 0.08 Allowed 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 117.151 2.278 . . . . 10.0 117.151 -179.48 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 63.3 t -75.4 -33.42 27.57 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 O-C-N 124.893 1.371 . . . . 10.0 114.647 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -71.51 -27.87 63.5 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 122.933 1.349 . . . . 10.0 111.223 179.725 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.441 HD22 HG22 ' A' ' 25' ' ' VAL . 1.3 tp -79.17 -34.65 42.91 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 123.685 0.794 . . . . 10.0 110.206 179.751 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.591 ' HG3' HD12 ' A' ' 20' ' ' LEU . 42.8 ttp85 -77.37 -30.86 53.97 Favored 'General case' 0 C--O 1.242 0.702 0 O-C-N 120.742 -1.224 . . . . 10.0 111.746 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.66 -39.5 80.64 Favored 'General case' 0 C--N 1.314 -0.947 0 C-N-CA 126.45 1.9 . . . . 10.0 109.38 179.715 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 80.1 mt -79.41 -57.16 5.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 O-C-N 125.284 1.615 . . . . 10.0 112.595 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -50.01 -31.79 13.71 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 115.127 1.528 . . . . 10.0 115.127 -179.869 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -61.05 -26.76 67.86 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 123.38 1.562 . . . . 10.0 113.377 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.662 ' N ' HD22 ' A' ' 35' ' ' LEU . 0.9 OUTLIER -97.17 -6.3 35.15 Favored 'General case' 0 C--N 1.323 -0.576 0 O-C-N 119.074 -2.266 . . . . 10.0 113.666 179.848 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 47.2 mt -96.64 109.03 21.73 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 124.933 1.395 . . . . 10.0 108.023 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 20.1 mttp -120.01 93.86 48.17 Favored Pre-proline 0 C--O 1.236 0.392 0 O-C-N 119.657 -1.902 . . . . 10.0 106.935 -179.719 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -69.41 172.1 12.9 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 125.205 3.937 . . . . 10.0 118.211 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -122.0 113.63 19.83 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 104.429 -2.434 . . . . 10.0 104.429 -179.825 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.1 mttm -81.26 138.17 35.77 Favored 'General case' 0 C--N 1.316 -0.883 0 O-C-N 120.752 -1.218 . . . . 10.0 112.431 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -128.32 107.62 9.91 Favored 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 103.783 -2.673 . . . . 10.0 103.783 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.6 mt -95.82 149.34 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 CA-C-O 123.573 1.654 . . . . 10.0 108.968 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -147.41 131.03 9.07 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 CA-C-O 123.92 1.819 . . . . 10.0 106.105 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -116.61 143.95 44.99 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 105.638 -1.986 . . . . 10.0 105.638 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -126.29 -66.65 0.91 Allowed 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 108.31 -0.996 . . . . 10.0 108.31 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -171.54 92.78 0.1 OUTLIER Glycine 0 CA--C 1.522 0.479 0 N-CA-C 107.82 -2.112 . . . . 10.0 107.82 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 60.89 19.29 9.59 Favored 'General case' 0 C--N 1.32 -0.686 0 O-C-N 121.72 -0.871 . . . . 10.0 109.663 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 5.9 m80 -137.88 78.18 1.67 Allowed 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 104.884 -2.265 . . . . 10.0 104.884 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.479 ' HB2' ' CG2' ' A' ' 66' ' ' VAL . 1.0 OUTLIER -78.3 126.27 30.54 Favored 'General case' 0 N--CA 1.441 -0.889 0 CA-C-N 114.114 -1.403 . . . . 10.0 112.133 179.925 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.617 ' C ' HD12 ' A' ' 51' ' ' ILE . 76.3 mt -110.6 139.68 33.14 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.544 0 N-CA-C 107.872 -1.159 . . . . 10.0 107.872 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.617 HD12 ' C ' ' A' ' 50' ' ' ILE . 1.8 mp -132.43 109.56 15.0 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 N-CA-C 105.629 -1.989 . . . . 10.0 105.629 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 36.7 mtt180 -106.15 116.15 31.44 Favored 'General case' 0 C--N 1.315 -0.904 0 O-C-N 126.802 2.564 . . . . 10.0 111.487 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.1 m -105.28 127.59 53.02 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 100.441 -3.911 . . . . 10.0 100.441 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 11.6 mt -117.29 98.28 6.35 Favored 'General case' 0 C--N 1.321 -0.662 1 N-CA-C 121.929 4.048 . . . . 10.0 121.929 179.772 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 82.7 p -108.72 138.75 44.54 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 126.926 2.09 . . . . 10.0 106.342 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -82.36 9.22 9.43 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 116.873 -1.537 . . . . 10.0 111.564 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 29.1 t80 -110.1 -46.62 3.43 Favored 'General case' 0 C--O 1.24 0.599 0 N-CA-C 108.27 -1.011 . . . . 10.0 108.27 -179.869 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 2.4 tpm_? -163.86 102.62 0.9 Allowed 'General case' 0 C--O 1.241 0.618 0 O-C-N 124.65 1.219 . . . . 10.0 111.93 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -76.05 170.09 16.94 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 120.737 -1.227 . . . . 10.0 111.435 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.459 ' CG ' ' O ' ' A' ' 60' ' ' TYR . 0.1 OUTLIER -151.44 56.19 0.87 Allowed 'General case' 0 C--O 1.214 -0.802 0 CA-C-O 125.088 2.375 . . . . 10.0 107.194 179.902 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.436 HD13 ' N ' ' A' ' 61' ' ' ILE . 2.9 mm -39.79 134.15 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 O-C-N 120.429 -1.42 . . . . 10.0 114.593 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -106.92 -178.06 3.54 Favored 'General case' 0 CA--C 1.513 -0.457 0 O-C-N 125.426 1.704 . . . . 10.0 107.345 -179.668 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -166.76 87.76 0.32 Allowed 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 101.878 -3.378 . . . . 10.0 101.878 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -93.2 164.87 13.08 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 116.249 1.944 . . . . 10.0 116.249 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.64 125.22 33.49 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 102.79 -3.041 . . . . 10.0 102.79 -179.715 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.479 ' CG2' ' HB2' ' A' ' 49' ' ' MET . 5.1 t -80.18 95.51 2.37 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 O-C-N 124.143 0.902 . . . . 10.0 112.803 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 102.8 39.8 2.64 Favored Glycine 0 CA--C 1.52 0.383 0 N-CA-C 114.99 0.756 . . . . 10.0 114.99 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -160.96 144.84 13.41 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 115.256 1.576 . . . . 10.0 115.256 -179.789 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -91.91 129.2 37.93 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 108.639 -0.874 . . . . 10.0 108.639 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 29.6 p90 -150.05 31.17 0.69 Allowed 'General case' 0 N--CA 1.439 -0.989 0 CA-C-O 116.113 -1.898 . . . . 10.0 113.413 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 12.6 pm0 36.18 84.53 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.773 0 O-C-N 126.243 2.215 . . . . 10.0 110.762 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -23.65 -43.51 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.959 0 O-C-N 126.764 2.54 . . . . 10.0 117.124 -179.625 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 73.29 89.68 0.09 Allowed 'General case' 0 C--O 1.224 -0.277 0 CA-C-N 113.223 -1.808 . . . . 10.0 109.871 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.558 HD22 ' CD1' ' A' ' 77' ' ' ILE . 8.6 mt -104.41 65.46 0.78 Allowed 'General case' 0 C--N 1.313 -0.988 0 O-C-N 121.145 -0.972 . . . . 10.0 112.798 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 11.0 p -107.99 33.22 4.22 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.447 -0.946 . . . . 10.0 108.447 179.813 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -116.98 -26.68 2.93 Favored Glycine 0 CA--C 1.509 -0.334 0 CA-C-O 117.617 -1.657 . . . . 10.0 113.277 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.558 ' CD1' HD22 ' A' ' 74' ' ' LEU . 0.1 OUTLIER -132.11 -80.1 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.721 0 CA-C-N 119.202 1.501 . . . . 10.0 110.022 -179.826 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -87.52 36.85 0.76 Allowed 'General case' 0 N--CA 1.444 -0.768 0 CA-C-O 116.697 -1.621 . . . . 10.0 115.02 -179.802 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 25.0 t0 11.75 74.93 0.01 OUTLIER 'General case' 0 C--O 1.219 -0.501 0 O-C-N 126.283 2.24 . . . . 10.0 116.45 179.825 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.86 96.09 1.11 Allowed 'General case' 0 CA--C 1.508 -0.653 0 O-C-N 126.667 2.48 . . . . 10.0 114.299 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 11.1 ttpt -67.75 128.6 37.08 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 106.378 -1.712 . . . . 10.0 106.378 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 41.3 m -120.97 171.82 8.37 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 126.856 2.598 . . . . 10.0 108.159 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 18.5 mtt -95.54 107.35 19.52 Favored 'General case' 0 C--N 1.314 -0.977 1 N-CA-C 99.697 -4.186 . . . . 10.0 99.697 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 5.2 m -122.89 144.14 49.42 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 117.665 2.468 . . . . 10.0 117.665 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -136.52 125.61 24.49 Favored 'General case' 0 N--CA 1.441 -0.878 0 N-CA-C 107.661 -1.237 . . . . 10.0 107.661 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -100.1 149.62 5.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 N-CA-C 102.798 -3.038 . . . . 10.0 102.798 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -165.77 156.86 13.71 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 114.306 1.224 . . . . 10.0 114.306 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -97.55 112.32 24.22 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 114.574 -1.194 . . . . 10.0 109.49 -179.829 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -118.8 85.03 2.29 Favored 'General case' 0 CA--C 1.532 0.288 1 N-CA-C 99.998 -4.075 . . . . 10.0 99.998 -179.774 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 92.93 -133.91 11.93 Favored Glycine 0 CA--C 1.498 -0.977 0 N-CA-C 105.308 -3.117 . . . . 10.0 105.308 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -104.43 35.17 2.81 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 122.841 0.457 . . . . 10.0 110.0 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 7.5 mtpt -128.18 172.33 11.1 Favored 'General case' 0 N--CA 1.463 0.18 0 O-C-N 126.506 2.379 . . . . 10.0 106.817 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -133.65 89.48 2.59 Favored 'General case' 0 C--N 1.323 -0.572 0 O-C-N 126.715 2.509 . . . . 10.0 107.275 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -76.16 154.99 34.97 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 116.465 -0.334 . . . . 10.0 110.828 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 3.3 m -144.27 133.74 23.34 Favored 'General case' 0 C--O 1.218 -0.587 0 O-C-N 126.212 2.195 . . . . 10.0 110.506 179.771 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -136.83 132.84 48.05 Favored 'Isoleucine or valine' 0 C--O 1.243 0.747 0 CA-C-N 113.42 -1.718 . . . . 10.0 107.395 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -118.54 121.1 39.42 Favored 'General case' 0 C--O 1.24 0.597 0 C-N-CA 124.36 1.064 . . . . 10.0 110.776 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 6.9 mttm -90.7 87.31 6.64 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 119.123 0.874 . . . . 10.0 109.979 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -131.11 75.55 0.42 Allowed Glycine 0 N--CA 1.438 -1.174 0 CA-C-O 116.458 -2.301 . . . . 10.0 114.082 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 28.04 39.74 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 117.549 2.426 . . . . 10.0 117.549 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 5.8 mmtt -131.46 160.01 36.41 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 115.31 1.596 . . . . 10.0 115.31 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -73.75 -37.95 64.88 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 112.676 -2.056 . . . . 10.0 108.829 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -135.78 134.0 6.97 Favored Glycine 0 C--O 1.222 -0.617 0 CA-C-O 117.201 -1.888 . . . . 10.0 113.681 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 173.72 106.07 0.01 OUTLIER 'General case' 0 N--CA 1.439 -0.983 0 O-C-N 124.91 1.006 . . . . 10.0 110.034 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 166.45 160.31 13.49 Favored Glycine 0 C--O 1.215 -1.063 0 N-CA-C 109.313 -1.515 . . . . 10.0 109.313 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 6.2 m0 -123.04 -179.65 4.35 Favored 'General case' 0 N--CA 1.442 -0.841 0 O-C-N 126.496 1.939 . . . . 10.0 109.268 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -164.47 151.55 11.46 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 104.163 -2.532 . . . . 10.0 104.163 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.595 ' NE2' HD13 ' A' ' 117' ' ' LEU . 3.4 tp-100 -140.32 151.98 45.48 Favored 'General case' 0 N--CA 1.444 -0.744 0 O-C-N 125.731 1.894 . . . . 10.0 108.808 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 109' ' ' TRP . . . . . 0.458 ' CD1' ' C ' ' A' ' 109' ' ' TRP . 0.0 OUTLIER -167.34 137.39 2.88 Favored 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 125.156 1.382 . . . . 10.0 107.529 179.977 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 33.6 mt -96.92 114.98 35.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 118.624 2.824 . . . . 10.0 118.624 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -95.97 161.75 13.86 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 102.645 -3.094 . . . . 10.0 102.645 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -57.75 106.25 0.75 Allowed Glycine 0 N--CA 1.443 -0.843 0 CA-C-O 118.571 -1.127 . . . . 10.0 110.835 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 69.34 11.76 8.18 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 126.133 1.725 . . . . 10.0 112.701 -179.678 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -151.86 120.57 6.53 Favored 'General case' 0 CA--C 1.499 -0.989 0 CA-C-O 124.712 2.196 . . . . 10.0 114.559 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.751 HD22 ' CE2' ' A' ' 8' ' ' TRP . 2.9 tp -78.07 138.06 38.57 Favored 'General case' 0 C--N 1.319 -0.717 0 CA-C-N 113.903 -1.498 . . . . 10.0 107.52 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -117.81 112.01 19.83 Favored 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 106.601 -1.629 . . . . 10.0 106.601 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.595 HD13 ' NE2' ' A' ' 108' ' ' GLN . 6.9 tp -122.65 131.83 53.99 Favored 'General case' 0 C--N 1.315 -0.921 0 C-N-CA 124.952 1.301 . . . . 10.0 107.922 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -135.81 151.93 50.57 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 106.183 -1.784 . . . . 10.0 106.183 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -156.39 160.42 39.63 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.328 -0.851 . . . . 10.0 109.641 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 3.4 mtm180 -138.82 179.55 6.42 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 117.289 -1.338 . . . . 10.0 114.042 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -173.62 132.5 0.45 Allowed 'General case' 0 CA--C 1.499 -1.016 0 O-C-N 125.269 1.606 . . . . 10.0 106.734 179.612 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 35.56 60.46 0.75 Allowed 'General case' 0 N--CA 1.475 0.821 0 O-C-N 126.669 2.481 . . . . 10.0 116.661 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 64.52 10.33 42.63 Favored Glycine 0 N--CA 1.444 -0.813 0 C-N-CA 123.877 0.751 . . . . 10.0 113.091 179.601 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 14.9 t -107.81 151.42 9.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 CA-C-N 118.958 1.379 . . . . 10.0 108.203 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 3.1 m -121.85 140.01 52.92 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 122.648 1.213 . . . . 10.0 112.279 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -137.77 175.23 9.77 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 113.165 -1.834 . . . . 10.0 106.466 -179.749 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 177.74 163.33 0.6 Allowed 'General case' 0 C--O 1.24 0.553 0 O-C-N 123.973 0.795 . . . . 10.0 111.309 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -131.01 133.51 45.83 Favored 'General case' 0 CA--C 1.5 -0.961 0 CA-C-N 115.708 -0.678 . . . . 10.0 111.461 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 55.5 t -100.21 90.56 1.94 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.43 0 C-N-CA 124.675 1.19 . . . . 10.0 109.68 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 130' ' ' PHE . . . . . 0.46 ' HB2' ' HB3' ' A' ' 115' ' ' LEU . 13.4 m-30 -81.96 166.57 19.74 Favored 'General case' 0 N--CA 1.442 -0.85 0 CA-C-O 122.557 1.17 . . . . 10.0 111.31 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.23 127.14 16.36 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 106.318 -1.734 . . . . 10.0 106.318 179.789 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 8.6 tttp -77.55 142.98 38.72 Favored 'General case' 0 CA--C 1.504 -0.807 0 N-CA-C 106.376 -1.713 . . . . 10.0 106.376 179.831 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 10.4 p -97.03 -14.26 7.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 119.369 0.986 . . . . 10.0 111.978 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 12.0 t-80 . . . . . 0 C--N 1.314 -0.946 0 O-C-N 126.315 2.259 . . . . 10.0 110.87 -179.958 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 . . . . . 0 C--O 1.239 0.52 0 N-CA-C 113.89 1.07 . . . . 10.0 113.89 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -85.45 24.32 1.2 Allowed 'General case' 0 C--O 1.243 0.719 0 O-C-N 121.119 -0.988 . . . . 10.0 111.759 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 13.2 m-80 -55.92 125.51 21.74 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 120.909 -1.12 . . . . 10.0 111.762 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 159.26 -163.38 33.35 Favored Glycine 0 C--O 1.214 -1.132 0 C-N-CA 117.963 -2.065 . . . . 10.0 116.409 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -122.7 173.26 7.84 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 105.058 -2.201 . . . . 10.0 105.058 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.657 ' CE3' HD12 ' A' ' 115' ' ' LEU . 1.1 m0 -169.56 98.58 0.33 Allowed 'General case' 0 N--CA 1.445 -0.698 0 O-C-N 125.306 1.629 . . . . 10.0 114.782 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.53 146.95 28.06 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 104.362 -2.458 . . . . 10.0 104.362 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -93.39 132.4 37.67 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 117.554 -1.658 . . . . 10.0 114.447 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -80.92 -54.98 5.1 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 113.731 -1.577 . . . . 10.0 110.07 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 33.9 m -156.47 130.79 8.68 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 115.598 1.703 . . . . 10.0 115.598 -179.675 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 5.1 p30 -116.18 171.36 7.86 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 112.534 -2.121 . . . . 10.0 105.521 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -136.57 -56.51 0.74 Allowed 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 116.703 2.112 . . . . 10.0 116.703 -179.771 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -92.96 51.05 1.62 Allowed 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 114.029 1.122 . . . . 10.0 114.029 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 27.9 t80 -71.72 -49.58 38.05 Favored 'General case' 0 C--O 1.243 0.761 0 CA-C-O 117.219 -1.372 . . . . 10.0 112.861 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -72.66 -39.09 67.39 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 114.362 1.245 . . . . 10.0 114.362 -179.766 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.94 -24.7 63.39 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 121.831 0.824 . . . . 10.0 110.871 -179.816 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -74.63 -42.8 57.92 Favored 'General case' 0 C--N 1.319 -0.756 0 O-C-N 120.292 -1.505 . . . . 10.0 107.803 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 45.7 mt -75.92 -20.13 58.23 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-O 123.408 1.575 . . . . 10.0 109.64 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -79.7 -29.1 40.61 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 107.577 -1.268 . . . . 10.0 107.577 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.468 ' HB1' ' HB3' ' A' ' 122' ' ' GLU . . . -68.82 -23.23 64.24 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 120.427 -1.421 . . . . 10.0 111.977 -179.61 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 85.2 mt -102.42 -21.92 14.17 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 118.247 -0.882 . . . . 10.0 111.394 179.607 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 50.0 m-20 70.86 63.85 0.18 Allowed 'General case' 0 C--O 1.247 0.935 0 O-C-N 126.965 2.666 . . . . 10.0 114.561 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -93.1 167.22 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 106.203 -1.777 . . . . 10.0 106.203 179.811 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 43.9 t30 -43.67 159.02 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 117.154 2.279 . . . . 10.0 117.154 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.4 t -77.19 -40.92 30.33 Favored 'Isoleucine or valine' 0 C--O 1.232 0.158 0 CA-C-N 113.057 -1.883 . . . . 10.0 112.791 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.75 -33.9 71.29 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.212 -0.904 . . . . 10.0 111.798 -179.484 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.625 HD23 ' O ' ' A' ' 29' ' ' LEU . 10.5 tt -72.31 -26.94 62.15 Favored 'General case' 0 C--O 1.218 -0.585 0 CA-C-N 115.662 -0.699 . . . . 10.0 111.969 -179.938 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.1 -31.35 62.76 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 125.024 1.33 . . . . 10.0 110.535 179.703 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 30.4 tttp -78.24 -41.28 34.7 Favored 'General case' 0 N--CA 1.447 -0.606 0 O-C-N 123.735 0.647 . . . . 10.0 112.736 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 40.2 mt -75.46 -44.48 41.43 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.321 0 O-C-N 124.048 0.843 . . . . 10.0 111.623 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.421 ' HA ' HD11 ' A' ' 36' ' ' LEU . . . -63.12 -22.57 66.95 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.267 -0.879 . . . . 10.0 113.034 -179.733 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -81.25 -5.35 57.68 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 113.934 1.087 . . . . 10.0 113.934 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.5 13.05 36.16 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-O 116.711 -1.614 . . . . 10.0 112.859 -179.902 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.421 HD11 ' HA ' ' A' ' 33' ' ' ALA . 0.0 OUTLIER -137.14 172.98 12.2 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 119.557 1.071 . . . . 10.0 110.184 179.791 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -127.94 102.29 22.15 Favored Pre-proline 0 C--O 1.24 0.601 0 N-CA-C 104.853 -2.277 . . . . 10.0 104.853 -179.593 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -57.56 87.57 0.05 OUTLIER 'Trans proline' 0 C--O 1.221 -0.374 0 N-CA-C 116.947 1.864 . . . . 10.0 116.947 179.83 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -61.55 152.57 30.0 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 122.165 0.983 . . . . 10.0 108.819 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -108.75 156.39 19.67 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.038 -1.437 . . . . 10.0 110.335 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.428 ' OE1' HG23 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -149.62 103.05 3.22 Favored 'General case' 0 N--CA 1.439 -1.007 0 N-CA-C 103.477 -2.786 . . . . 10.0 103.477 -179.866 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 5.0 mt -101.66 133.99 43.43 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 CA-C-N 115.586 -0.734 . . . . 10.0 111.885 179.834 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.428 HG23 ' OE1' ' A' ' 41' ' ' GLU . 47.2 t -136.66 90.62 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.883 0 N-CA-C 105.265 -2.124 . . . . 10.0 105.265 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 21.8 tt0 -90.0 126.76 35.87 Favored 'General case' 0 C--N 1.313 -0.983 0 O-C-N 125.6 1.813 . . . . 10.0 109.288 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -95.71 -22.48 17.52 Favored 'General case' 0 C--N 1.319 -0.747 0 O-C-N 120.571 -1.331 . . . . 10.0 108.829 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 140.34 -126.49 3.2 Favored Glycine 0 CA--C 1.534 1.243 0 N-CA-C 105.943 -2.863 . . . . 10.0 105.943 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -47.25 -30.75 3.23 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 119.737 1.769 . . . . 10.0 111.672 -179.927 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 40.7 m170 -102.37 128.46 48.94 Favored 'General case' 0 N--CA 1.444 -0.766 0 O-C-N 120.037 -1.664 . . . . 10.0 106.571 179.746 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 31.7 ttm -122.2 142.11 50.77 Favored 'General case' 0 N--CA 1.437 -1.102 0 O-C-N 119.698 -1.876 . . . . 10.0 112.374 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 10.1 mt -131.33 121.85 49.62 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.068 0 N-CA-C 107.383 -1.339 . . . . 10.0 107.383 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mp -116.16 125.98 73.46 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 N-CA-C 104.985 -2.228 . . . . 10.0 104.985 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.592 ' HA ' HG22 ' A' ' 61' ' ' ILE . 3.9 mtt85 -120.16 94.96 4.56 Favored 'General case' 0 C--O 1.214 -0.766 0 O-C-N 126.069 2.106 . . . . 10.0 109.074 -179.781 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.8 m -83.16 113.5 20.68 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 101.323 -3.584 . . . . 10.0 101.323 -179.682 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 6.6 mp -102.74 93.97 5.37 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 118.267 2.691 . . . . 10.0 118.267 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -100.21 132.0 45.83 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 104.413 -2.439 . . . . 10.0 104.413 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 8.4 p -46.88 -28.57 1.63 Allowed 'General case' 0 CA--C 1.545 0.776 0 O-C-N 125.252 1.595 . . . . 10.0 109.041 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -106.01 99.79 9.36 Favored 'General case' 0 C--O 1.245 0.817 0 C-N-CA 125.048 1.339 . . . . 10.0 110.446 -179.609 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 67.79 149.74 0.06 Allowed 'General case' 0 C--N 1.321 -0.659 0 O-C-N 126.697 2.498 . . . . 10.0 110.743 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -108.73 150.37 27.68 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 113.594 -1.639 . . . . 10.0 110.785 179.798 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 6.5 t80 -137.59 84.67 2.06 Favored 'General case' 0 N--CA 1.434 -1.244 0 CA-C-N 114.035 -1.438 . . . . 10.0 107.468 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.592 HG22 ' HA ' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -102.99 157.33 4.94 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-N 120.492 1.496 . . . . 10.0 112.488 179.821 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 2.4 mtp -134.82 158.97 42.83 Favored 'General case' 0 C--N 1.32 -0.686 0 O-C-N 126.378 2.299 . . . . 10.0 107.826 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -145.55 95.84 2.72 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 100.79 -3.782 . . . . 10.0 100.79 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 8.6 m-30 -116.87 163.38 16.28 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 117.026 2.232 . . . . 10.0 117.026 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 82.2 mt-30 -117.23 116.33 27.05 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 103.611 -2.737 . . . . 10.0 103.611 179.793 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.9 t -66.95 138.99 21.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 124.025 1.869 . . . . 10.0 109.483 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 66.06 24.39 71.73 Favored Glycine 0 C--N 1.336 0.553 0 CA-C-N 114.081 -1.418 . . . . 10.0 113.818 179.709 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 11.7 mttt -141.41 158.22 44.15 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 118.417 -1.313 . . . . 10.0 113.389 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -72.74 167.88 19.94 Favored 'General case' 0 C--N 1.316 -0.885 0 O-C-N 124.87 1.357 . . . . 10.0 109.145 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -157.48 -175.28 5.31 Favored 'General case' 0 C--O 1.247 0.941 0 C-N-CA 124.482 1.113 . . . . 10.0 110.547 -179.759 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -163.14 127.51 2.96 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 105.304 -2.11 . . . . 10.0 105.304 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -120.17 169.51 10.17 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 114.913 -1.039 . . . . 10.0 113.543 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -100.22 -15.24 18.17 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 107.258 -1.386 . . . . 10.0 107.258 179.702 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 3.3 pp -141.72 -174.64 4.12 Favored 'General case' 0 C--N 1.314 -0.954 0 O-C-N 125.495 1.747 . . . . 10.0 114.706 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -141.88 -76.1 0.29 Allowed 'General case' 0 C--O 1.218 -0.582 0 N-CA-C 106.899 -1.519 . . . . 10.0 106.899 179.829 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -130.78 76.33 0.41 Allowed Glycine 0 C--O 1.238 0.37 0 CA-C-O 119.702 -0.499 . . . . 10.0 112.273 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 19.5 mt 64.63 -71.22 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.714 0 CA-C-O 118.262 -0.875 . . . . 10.0 109.928 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -45.25 -29.81 1.08 Allowed 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 124.917 1.287 . . . . 10.0 110.536 -179.53 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.8 p30 56.25 168.77 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 129.386 3.074 . . . . 10.0 118.595 179.348 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.9 ttm-85 169.03 118.23 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 116.107 -1.902 . . . . 10.0 108.134 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 23.3 mtpt -47.52 121.19 3.76 Favored 'General case' 0 C--N 1.314 -0.973 0 O-C-N 125.336 1.648 . . . . 10.0 107.583 -179.545 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -133.93 170.61 15.36 Favored 'General case' 0 C--N 1.315 -0.901 0 O-C-N 125.933 2.021 . . . . 10.0 109.696 179.868 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 4.3 mtp -126.75 98.43 5.37 Favored 'General case' 0 N--CA 1.44 -0.964 1 N-CA-C 100.063 -4.051 . . . . 10.0 100.063 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 26.1 m -99.94 131.24 46.03 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 124.371 2.034 . . . . 10.0 114.762 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 1.2 m -115.88 128.93 56.18 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 112.773 -2.012 . . . . 10.0 107.032 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 2.2 t -106.2 127.32 61.51 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.929 0 N-CA-C 103.384 -2.821 . . . . 10.0 103.384 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.2 t -151.13 147.11 26.65 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 123.143 1.449 . . . . 10.0 111.547 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 2.2 p-90 -95.75 130.4 42.68 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 105.589 -2.004 . . . . 10.0 105.589 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -78.3 -51.17 10.53 Favored 'General case' 0 C--O 1.247 0.93 1 N-CA-C 99.904 -4.11 . . . . 10.0 99.904 179.888 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -157.25 -76.55 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.445 0 N-CA-C 108.192 -1.963 . . . . 10.0 108.192 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -114.48 19.05 16.45 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 115.103 1.52 . . . . 10.0 115.103 179.798 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 9.0 mttm -129.98 -171.96 2.66 Favored 'General case' 0 C--O 1.244 0.792 0 CA-C-O 118.24 -0.886 . . . . 10.0 108.725 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.3 tt -137.34 131.92 32.86 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 104.57 -2.382 . . . . 10.0 104.57 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -137.43 -173.62 3.53 Favored 'General case' 0 C--O 1.219 -0.508 0 N-CA-C 114.78 1.4 . . . . 10.0 114.78 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 1.1 m -156.33 137.28 13.53 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 118.817 0.735 . . . . 10.0 110.156 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 3.7 t -95.8 -52.83 8.9 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 N-CA-C 106.845 -1.539 . . . . 10.0 106.845 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 71.44 114.37 0.05 Allowed 'General case' 0 C--O 1.244 0.809 0 C-N-CA 127.395 2.278 . . . . 10.0 109.572 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 13.4 mttt -97.21 74.58 2.54 Favored 'General case' 0 C--N 1.343 0.306 0 CA-C-O 116.756 -1.593 . . . . 10.0 112.41 -179.743 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -107.5 -93.22 2.29 Favored Glycine 0 N--CA 1.451 -0.305 0 O-C-N 125.473 1.733 . . . . 10.0 109.967 179.82 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -167.55 -39.01 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 117.553 2.427 . . . . 10.0 117.553 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.05 146.34 11.43 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 113.808 1.04 . . . . 10.0 113.808 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -78.82 83.37 4.95 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 125.08 1.352 . . . . 10.0 112.341 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 142.23 -1.75 1.71 Allowed Glycine 0 C--O 1.219 -0.802 0 O-C-N 126.516 2.385 . . . . 10.0 115.544 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 23.7 mtt180 -52.63 161.81 0.66 Allowed 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 118.572 1.186 . . . . 10.0 112.835 -179.671 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 107.65 152.88 17.82 Favored Glycine 0 C--O 1.224 -0.485 0 CA-C-N 112.522 -2.126 . . . . 10.0 110.562 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' TRP . . . . . 0.423 ' CD1' ' N ' ' A' ' 106' ' ' TRP . 0.0 OUTLIER -117.39 179.28 4.09 Favored 'General case' 0 C--N 1.33 -0.249 0 O-C-N 120.198 -1.766 . . . . 10.0 110.246 179.909 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -153.51 99.08 2.3 Favored 'General case' 0 CA--C 1.503 -0.839 0 O-C-N 124.748 1.28 . . . . 10.0 108.517 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 62.4 mt-30 -98.49 147.41 24.78 Favored 'General case' 0 C--O 1.239 0.52 0 O-C-N 126.564 2.415 . . . . 10.0 112.309 -179.674 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -169.41 128.76 1.01 Allowed 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 105.966 -1.864 . . . . 10.0 105.966 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 69.5 mt -88.56 160.28 2.86 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.802 0 N-CA-C 116.894 2.183 . . . . 10.0 116.894 -179.802 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -139.28 63.04 1.51 Allowed 'General case' 0 N--CA 1.463 0.194 0 O-C-N 126.36 2.287 . . . . 10.0 106.474 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 72.89 -98.64 0.88 Allowed Glycine 0 CA--C 1.531 1.036 0 N-CA-C 107.928 -2.069 . . . . 10.0 107.928 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -108.13 19.63 19.71 Favored 'General case' 0 C--N 1.321 -0.655 0 O-C-N 121.453 -1.028 . . . . 10.0 113.078 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -128.86 95.8 4.19 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 120.554 -1.341 . . . . 10.0 111.071 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.657 HD12 ' CE3' ' A' ' 8' ' ' TRP . 0.2 OUTLIER -64.89 120.1 11.91 Favored 'General case' 0 C--N 1.319 -0.738 0 O-C-N 121.123 -0.985 . . . . 10.0 109.677 -179.838 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 5.0 t60 -109.97 103.28 12.01 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 107.083 -1.451 . . . . 10.0 107.083 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.529 ' O ' HD23 ' A' ' 117' ' ' LEU . 0.2 OUTLIER -110.09 115.94 30.66 Favored 'General case' 0 C--N 1.321 -0.653 0 O-C-N 125.237 1.586 . . . . 10.0 109.11 -179.853 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -108.83 90.99 3.46 Favored 'General case' 0 CA--C 1.507 -0.711 0 N-CA-C 105.408 -2.071 . . . . 10.0 105.408 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -78.01 154.93 31.03 Favored 'General case' 0 N--CA 1.443 -0.823 0 C-N-CA 126.336 1.854 . . . . 10.0 111.15 179.776 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -136.98 137.62 39.68 Favored 'General case' 0 C--N 1.319 -0.734 0 O-C-N 126.027 2.079 . . . . 10.0 113.809 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 121' ' ' ALA . . . . . 0.722 ' O ' HG22 ' A' ' 124' ' ' VAL . . . -160.91 129.97 4.72 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 116.362 -1.78 . . . . 10.0 109.291 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 122' ' ' GLU . . . . . 0.468 ' HB3' ' HB1' ' A' ' 22' ' ' ALA . 3.5 tt0 40.23 49.42 2.46 Favored 'General case' 0 C--O 1.241 0.647 0 N-CA-C 115.639 1.718 . . . . 10.0 115.639 -179.747 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 70.49 16.87 74.1 Favored Glycine 0 CA--C 1.538 1.512 0 CA-C-O 115.945 -2.586 . . . . 10.0 115.847 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.722 HG22 ' O ' ' A' ' 121' ' ' ALA . 4.0 m -108.1 169.45 3.04 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 O-C-N 125.723 1.484 . . . . 10.0 108.698 179.758 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 2.7 m -136.39 91.08 2.63 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.98 -0.554 . . . . 10.0 111.573 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 26.2 t -95.23 99.62 11.55 Favored 'General case' 0 C--O 1.216 -0.66 0 N-CA-C 105.691 -1.966 . . . . 10.0 105.691 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.33 151.01 22.4 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 114.055 -1.429 . . . . 10.0 109.564 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 14.1 mt-30 -144.4 125.5 14.53 Favored 'General case' 0 C--N 1.315 -0.911 0 O-C-N 126.136 2.147 . . . . 10.0 113.462 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 19.4 t -91.03 114.4 28.31 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 107.077 -1.453 . . . . 10.0 107.077 -179.663 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -101.99 177.21 4.96 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.661 -0.866 . . . . 10.0 108.661 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -148.17 120.06 8.16 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 106.339 -1.726 . . . . 10.0 106.339 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -79.64 125.58 29.81 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 117.86 -1.536 . . . . 10.0 107.632 -179.619 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 18.3 t -82.61 -66.18 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-O 117.934 -1.031 . . . . 10.0 109.996 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.255 1.364 0 O-C-N 125.289 1.618 . . . . 10.0 109.711 179.841 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 . . . . . 0 C--O 1.237 0.4 0 N-CA-C 112.59 0.589 . . . . 10.0 112.59 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 68.1 -28.97 0.15 Allowed 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 117.296 2.332 . . . . 10.0 117.296 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -37.39 115.14 0.38 Allowed 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 116.499 2.037 . . . . 10.0 116.499 179.695 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -176.16 164.19 33.98 Favored Glycine 0 CA--C 1.527 0.808 0 N-CA-C 117.384 1.714 . . . . 10.0 117.384 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 16.9 m-30 -94.96 141.92 28.08 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 101.138 -3.653 . . . . 10.0 101.138 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.758 ' NE1' HD12 ' A' ' 42' ' ' ILE . 57.8 m95 -134.82 85.73 2.2 Favored 'General case' 0 C--N 1.313 -1.0 0 O-C-N 126.012 2.07 . . . . 10.0 111.591 179.726 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.06 149.39 27.82 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 104.912 -2.255 . . . . 10.0 104.912 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.425 ' HE2' ' CZ ' ' A' ' 130' ' ' PHE . 27.4 ttm -99.93 150.09 22.76 Favored 'General case' 0 N--CA 1.444 -0.748 0 N-CA-C 115.171 1.545 . . . . 10.0 115.171 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.8 mp -108.71 -64.71 1.2 Allowed 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 113.394 -1.73 . . . . 10.0 107.281 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -156.42 154.61 30.74 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 117.023 2.231 . . . . 10.0 117.023 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -113.8 165.79 12.21 Favored 'General case' 0 CA--C 1.509 -0.616 0 O-C-N 128.406 3.566 . . . . 10.0 109.154 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -142.37 138.06 30.92 Favored 'General case' 0 C--O 1.24 0.565 0 O-C-N 120.659 -1.275 . . . . 10.0 112.962 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 60.79 17.71 7.94 Favored 'General case' 0 C--O 1.247 0.959 0 CA-C-O 124.737 2.208 . . . . 10.0 115.686 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -52.24 -50.48 61.94 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 116.607 -3.808 . . . . 10.0 115.966 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 59.7 mt-10 -63.33 -30.43 71.57 Favored 'General case' 0 C--O 1.219 -0.535 0 N-CA-C 114.748 1.388 . . . . 10.0 114.748 179.496 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -79.87 -28.99 39.92 Favored 'General case' 0 C--N 1.328 -0.361 0 O-C-N 127.022 2.701 . . . . 10.0 109.989 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -65.5 -53.26 44.95 Favored 'General case' 0 C--N 1.317 -0.823 0 O-C-N 124.209 0.943 . . . . 10.0 111.369 179.59 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.55 ' HB3' HG22 ' A' ' 25' ' ' VAL . 12.8 mt -65.45 -21.7 66.68 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 114.091 1.145 . . . . 10.0 114.091 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -71.18 -31.41 67.62 Favored 'General case' 0 C--N 1.317 -0.81 0 C-N-CA 124.316 1.046 . . . . 10.0 110.534 -179.776 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.68 -48.64 79.89 Favored 'General case' 0 CA--C 1.531 0.24 0 O-C-N 125.204 1.565 . . . . 10.0 113.396 179.301 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -90.76 -12.3 36.96 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.406 -1.27 . . . . 10.0 109.167 179.906 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.2 t0 55.83 57.82 4.91 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 114.512 -1.222 . . . . 10.0 113.529 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.55 HG22 ' HB3' ' A' ' 20' ' ' LEU . 14.5 m -73.37 -164.8 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-N 114.703 -1.135 . . . . 10.0 109.123 -179.837 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -64.17 140.83 58.91 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 116.232 1.938 . . . . 10.0 116.232 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.408 ' H ' HG12 ' A' ' 27' ' ' VAL . 1.4 p -60.15 -39.14 79.67 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.945 0 C-N-CA 126.188 1.795 . . . . 10.0 115.775 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.63 -21.16 64.49 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 114.16 -1.382 . . . . 10.0 111.043 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.41 -43.18 23.87 Favored 'General case' 0 C--O 1.218 -0.603 0 O-C-N 124.773 1.296 . . . . 10.0 110.719 -179.762 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.5 ttm180 -59.58 -34.12 72.31 Favored 'General case' 0 C--O 1.243 0.763 0 C-N-CA 125.709 1.604 . . . . 10.0 114.291 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.0 ttpt -75.89 -46.73 28.6 Favored 'General case' 0 N--CA 1.438 -1.032 0 O-C-N 125.715 1.885 . . . . 10.0 112.659 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 7.8 mm -76.19 -39.36 35.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 O-C-N 121.427 -0.796 . . . . 10.0 111.451 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.468 ' HA ' ' HB3' ' A' ' 36' ' ' LEU . . . -63.64 -24.23 67.71 Favored 'General case' 0 C--O 1.215 -0.752 0 N-CA-C 115.732 1.752 . . . . 10.0 115.732 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -65.32 -56.54 12.06 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 119.522 -0.871 . . . . 10.0 109.903 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.534 ' C ' HD12 ' A' ' 35' ' ' LEU . 4.5 pp -79.89 0.87 29.38 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 113.031 0.752 . . . . 10.0 113.031 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.468 ' HB3' ' HA ' ' A' ' 33' ' ' ALA . 12.3 tp -105.68 125.1 50.6 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 124.451 1.094 . . . . 10.0 108.728 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.56 103.06 53.08 Favored Pre-proline 0 C--N 1.316 -0.862 0 CA-C-N 120.463 1.483 . . . . 10.0 109.582 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -70.59 112.41 3.22 Favored 'Trans proline' 0 C--N 1.354 0.826 0 CA-C-O 123.906 1.544 . . . . 10.0 114.516 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -71.5 169.61 15.07 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 114.407 -1.27 . . . . 10.0 109.443 -179.78 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.6 mtmt -136.58 153.21 51.03 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-O 122.575 1.178 . . . . 10.0 112.527 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -142.1 115.35 8.89 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 103.003 -2.962 . . . . 10.0 103.003 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.758 HD12 ' NE1' ' A' ' 8' ' ' TRP . 61.7 mt -100.49 147.65 7.58 Favored 'Isoleucine or valine' 0 C--O 1.247 0.925 0 N-CA-C 108.757 -0.831 . . . . 10.0 108.757 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.5 t -147.96 130.32 7.05 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.836 0 N-CA-C 105.727 -1.953 . . . . 10.0 105.727 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -132.56 151.98 51.75 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 122.68 1.229 . . . . 10.0 109.667 -179.787 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -149.82 100.47 2.96 Favored 'General case' 0 N--CA 1.444 -0.763 0 N-CA-C 106.876 -1.528 . . . . 10.0 106.876 179.841 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.17 -115.49 4.04 Favored Glycine 0 C--N 1.345 1.045 0 N-CA-C 109.056 -1.618 . . . . 10.0 109.056 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -119.12 18.46 13.09 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 108.62 -0.882 . . . . 10.0 108.62 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 7.6 t-160 -107.85 122.24 46.39 Favored 'General case' 0 CA--C 1.508 -0.671 0 N-CA-C 106.601 -1.629 . . . . 10.0 106.601 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 4.1 ttt -109.68 134.43 51.98 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 114.333 1.234 . . . . 10.0 114.333 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 7.1 mt -118.63 98.79 6.85 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.994 0 N-CA-C 107.751 -1.204 . . . . 10.0 107.751 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.418 ' N ' HD12 ' A' ' 51' ' ' ILE . 2.0 mp -89.0 131.37 36.5 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.969 0 N-CA-C 105.527 -2.027 . . . . 10.0 105.527 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 22.0 mtm180 -129.31 133.96 47.7 Favored 'General case' 0 C--O 1.215 -0.745 0 N-CA-C 113.506 0.928 . . . . 10.0 113.506 -179.749 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 54.1 m -114.13 99.37 7.58 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 101.048 -3.686 . . . . 10.0 101.048 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 8.4 mt -99.41 133.22 44.04 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 120.194 3.405 . . . . 10.0 120.194 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -158.33 155.26 28.46 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 126.679 1.992 . . . . 10.0 105.683 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 7.0 t -87.05 -1.96 58.27 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 105.753 -1.943 . . . . 10.0 105.753 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -124.49 102.41 7.63 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 105.27 -2.122 . . . . 10.0 105.27 179.761 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 63.85 129.83 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 125.434 2.54 . . . . 10.0 110.825 179.799 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -150.28 157.24 42.86 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-O 125.15 2.405 . . . . 10.0 110.376 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 32.3 p90 -152.25 139.74 19.62 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 104.743 -2.317 . . . . 10.0 104.743 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.534 ' N ' HD12 ' A' ' 61' ' ' ILE . 2.0 mp -130.87 139.64 50.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 O-C-N 125.299 1.625 . . . . 10.0 111.443 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 5.0 ptp -115.89 179.78 3.88 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 127.322 2.249 . . . . 10.0 104.975 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -157.08 102.93 1.99 Allowed 'General case' 0 N--CA 1.441 -0.876 0 N-CA-C 102.575 -3.12 . . . . 10.0 102.575 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -114.47 160.67 18.94 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 117.696 2.48 . . . . 10.0 117.696 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 5.6 mm-40 -116.31 152.01 34.71 Favored 'General case' 0 C--O 1.216 -0.706 0 N-CA-C 107.734 -1.21 . . . . 10.0 107.734 179.732 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 14.7 t -95.19 115.9 35.25 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 CA-C-O 123.492 1.615 . . . . 10.0 111.062 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 79.41 23.94 61.91 Favored Glycine 0 C--O 1.224 -0.481 0 CA-C-N 113.943 -1.481 . . . . 10.0 113.729 179.714 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.86 145.08 51.33 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 123.346 0.658 . . . . 10.0 111.145 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 66.5 tt0 -68.95 165.17 20.58 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 107.56 -1.274 . . . . 10.0 107.56 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -160.26 131.44 5.76 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 122.741 1.258 . . . . 10.0 112.465 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -96.24 67.52 2.56 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.514 -1.221 . . . . 10.0 109.916 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 57.1 tt0 -58.79 125.11 22.13 Favored 'General case' 0 N--CA 1.442 -0.865 0 O-C-N 126.798 2.561 . . . . 10.0 115.985 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -111.61 105.11 13.56 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-O 122.853 1.311 . . . . 10.0 108.337 179.729 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 20.9 mt -80.53 137.39 36.42 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 114.752 -1.113 . . . . 10.0 113.587 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 53.8 p -120.2 105.38 10.91 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 106.155 -1.794 . . . . 10.0 106.155 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 98.79 -169.39 23.17 Favored Glycine 0 C--O 1.243 0.69 0 CA-C-O 117.171 -1.905 . . . . 10.0 108.98 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.404 HG23 ' O ' ' A' ' 77' ' ' ILE . 0.1 OUTLIER 39.64 54.11 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 O-C-N 126.739 2.082 . . . . 10.0 110.474 179.83 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 5.0 t70 86.97 -26.85 0.08 Allowed 'General case' 0 C--O 1.239 0.526 0 O-C-N 126.126 2.141 . . . . 10.0 112.426 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 47.07 100.24 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 123.947 1.832 . . . . 10.0 115.931 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.89 93.73 1.98 Allowed 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 114.222 -1.354 . . . . 10.0 110.187 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 5.4 pttt -58.44 141.02 52.84 Favored 'General case' 0 N--CA 1.444 -0.743 0 N-CA-C 104.51 -2.404 . . . . 10.0 104.51 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -134.64 -177.3 4.55 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 113.715 -1.584 . . . . 10.0 110.002 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 25.6 mtm -119.85 66.15 0.81 Allowed 'General case' 0 CA--C 1.503 -0.844 0 N-CA-C 102.564 -3.125 . . . . 10.0 102.564 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 96.7 m -72.17 139.12 48.09 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 117.623 2.453 . . . . 10.0 117.623 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -120.63 116.64 25.73 Favored 'General case' 0 C--N 1.319 -0.752 0 O-C-N 126.955 2.659 . . . . 10.0 105.566 179.782 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 1.4 t -107.36 146.89 13.01 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 O-C-N 126.961 2.663 . . . . 10.0 104.407 179.647 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.9 t -148.78 -173.83 4.46 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 123.65 0.78 . . . . 10.0 109.091 -179.843 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 1.1 p-90 -151.65 122.71 7.64 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 106.834 -1.543 . . . . 10.0 106.834 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -112.24 56.67 0.66 Allowed 'General case' 0 CA--C 1.5 -0.976 0 N-CA-C 101.648 -3.464 . . . . 10.0 101.648 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 117.43 -154.0 16.94 Favored Glycine 0 C--N 1.338 0.659 0 N-CA-C 104.92 -3.272 . . . . 10.0 104.92 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 12.0 t0 -82.85 58.63 4.42 Favored 'General case' 0 C--O 1.219 -0.528 0 O-C-N 120.024 -1.868 . . . . 10.0 112.027 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.5 mtmt -136.03 -172.11 3.04 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 122.644 1.211 . . . . 10.0 108.249 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 1.5 tp -152.64 98.29 2.34 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 108.385 -0.968 . . . . 10.0 108.385 -179.773 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.31 138.31 40.25 Favored 'General case' 0 C--O 1.216 -0.688 0 CA-C-O 121.863 0.84 . . . . 10.0 110.023 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 7.7 m -128.81 143.99 51.05 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 123.784 0.834 . . . . 10.0 111.7 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 23.8 t -137.46 110.48 7.75 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 N-CA-C 105.157 -2.164 . . . . 10.0 105.157 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 -101.65 127.29 48.45 Favored 'General case' 0 C--O 1.244 0.79 0 C-N-CA 123.219 0.608 . . . . 10.0 110.041 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 1.3 pttt -114.62 88.39 2.85 Favored 'General case' 0 C--O 1.233 0.204 0 N-CA-C 113.06 0.763 . . . . 10.0 113.06 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -115.17 -91.49 1.77 Allowed Glycine 0 N--CA 1.437 -1.252 0 N-CA-C 110.361 -1.096 . . . . 10.0 110.361 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -134.83 -8.15 2.4 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 116.966 2.21 . . . . 10.0 116.966 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.04 -177.53 4.52 Favored 'General case' 0 C--N 1.326 -0.423 0 O-C-N 126.682 2.489 . . . . 10.0 113.856 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -123.04 30.64 6.29 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 126.962 2.105 . . . . 10.0 112.869 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -161.93 -19.32 0.03 OUTLIER Glycine 0 N--CA 1.467 0.758 0 N-CA-C 119.855 2.702 . . . . 10.0 119.855 -179.742 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 1.5 mtt180 -51.42 116.12 1.92 Allowed 'General case' 0 C--O 1.223 -0.339 0 CA-C-O 124.133 1.921 . . . . 10.0 110.989 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 165.11 150.39 6.18 Favored Glycine 0 CA--C 1.518 0.26 0 N-CA-C 108.963 -1.655 . . . . 10.0 108.963 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -135.27 -173.05 3.22 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-N 114.181 -1.01 . . . . 10.0 112.227 -179.869 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 107' ' ' THR . . . . . 0.518 ' O ' HD12 ' A' ' 117' ' ' LEU . 35.5 m -165.63 136.03 3.64 Favored 'General case' 0 N--CA 1.443 -0.782 0 C-N-CA 124.651 1.18 . . . . 10.0 108.544 -179.767 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -125.94 103.75 7.92 Favored 'General case' 0 C--O 1.244 0.807 0 C-N-CA 126.675 1.99 . . . . 10.0 108.944 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' TRP . . . . . 0.476 ' C ' ' CD1' ' A' ' 109' ' ' TRP . 0.0 OUTLIER -100.9 161.48 13.56 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 106.254 -1.758 . . . . 10.0 106.254 -179.805 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.421 ' N ' ' CD1' ' A' ' 109' ' ' TRP . 0.6 OUTLIER -131.28 143.03 41.87 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.028 0 N-CA-C 114.957 1.466 . . . . 10.0 114.957 179.999 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -136.59 90.14 2.53 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 112.703 -2.044 . . . . 10.0 108.993 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 47.4 -91.86 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.672 0 N-CA-C 109.278 -1.529 . . . . 10.0 109.278 179.781 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -96.94 -19.83 18.53 Favored 'General case' 0 C--N 1.333 -0.146 0 O-C-N 120.57 -1.547 . . . . 10.0 113.95 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -98.09 148.87 23.1 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 121.162 1.801 . . . . 10.0 113.937 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.442 ' HB3' ' HB2' ' A' ' 130' ' ' PHE . 13.7 tp -116.53 138.0 51.73 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 106.483 -1.673 . . . . 10.0 106.483 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 48.3 m80 -132.76 89.38 2.63 Favored 'General case' 0 C--N 1.315 -0.928 0 O-C-N 121.006 -1.058 . . . . 10.0 108.62 -179.651 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.518 HD12 ' O ' ' A' ' 107' ' ' THR . 31.6 tp -94.68 142.95 26.85 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 114.317 -1.31 . . . . 10.0 109.686 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -140.78 107.5 5.36 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 119.239 -0.984 . . . . 10.0 108.769 179.904 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 6.4 mtt -87.83 149.3 24.22 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 109.446 -0.575 . . . . 10.0 109.446 179.693 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -133.61 142.93 48.33 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 118.814 0.734 . . . . 10.0 109.481 179.616 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -154.27 134.5 13.28 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 108.828 -0.805 . . . . 10.0 108.828 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 36.0 44.14 0.24 Allowed 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 116.298 1.962 . . . . 10.0 116.298 -179.694 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 91.46 2.35 70.46 Favored Glycine 0 N--CA 1.468 0.807 0 CA-C-O 118.15 -1.361 . . . . 10.0 115.878 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -109.9 162.56 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 CA-C-N 120.398 2.099 . . . . 10.0 109.667 179.873 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 20.9 m -135.92 101.68 4.81 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 114.966 1.469 . . . . 10.0 114.966 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -86.09 143.78 27.88 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 107.538 -1.282 . . . . 10.0 107.538 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 2.1 mttt -140.17 118.8 12.32 Favored 'General case' 0 C--N 1.322 -0.612 0 O-C-N 124.081 0.863 . . . . 10.0 111.539 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 83.2 mt-30 -111.02 130.01 55.72 Favored 'General case' 0 C--O 1.244 0.811 0 O-C-N 125.068 1.48 . . . . 10.0 113.106 -179.491 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 4.8 t -97.58 127.12 50.22 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-O 122.302 1.048 . . . . 10.0 111.516 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 130' ' ' PHE . . . . . 0.442 ' HB2' ' HB3' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -121.39 155.7 34.24 Favored 'General case' 0 N--CA 1.443 -0.793 0 C-N-CA 126.156 1.782 . . . . 10.0 110.646 179.952 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 4.9 tptt -125.59 120.45 30.85 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 105.128 -2.175 . . . . 10.0 105.128 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.81 116.14 8.15 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 120.928 1.694 . . . . 10.0 111.182 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 27.6 m -122.98 52.29 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 113.772 1.027 . . . . 10.0 113.772 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 . . . . . 0 C--O 1.242 0.7 0 CA-C-N 114.639 -1.164 . . . . 10.0 113.701 -180.0 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 . . . . . 0 C--O 1.226 -0.14 0 CA-C-O 120.993 0.425 . . . . 10.0 110.394 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.524 ' CZ ' HD13 ' A' ' 93' ' ' LEU . 2.9 m-85 -128.74 -39.3 1.63 Allowed 'General case' 0 C--O 1.241 0.629 0 N-CA-C 117.531 2.419 . . . . 10.0 117.531 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -50.24 137.91 17.32 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 115.665 1.728 . . . . 10.0 115.665 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -167.04 -97.33 0.11 Allowed Glycine 0 C--N 1.341 0.827 0 CA-C-O 125.011 2.451 . . . . 10.0 112.903 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.492 ' CB ' ' CG1' ' A' ' 133' ' ' VAL . 0.1 OUTLIER 178.4 178.28 0.4 Allowed 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 104.626 -2.361 . . . . 10.0 104.626 -179.833 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.566 ' CD2' ' HB2' ' A' ' 39' ' ' ASP 0.297 36.0 p-90 -147.4 -179.6 6.97 Favored 'General case' 0 C--N 1.317 -0.809 0 O-C-N 127.403 2.939 . . . . 10.0 113.846 -178.384 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.2 ptmm? 166.42 99.8 0.0 OUTLIER 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 111.756 -2.475 . . . . 10.0 108.564 178.678 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.48 148.54 48.36 Favored 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 125.139 1.525 . . . . 10.0 114.44 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.501 HD13 ' HB2' ' A' ' 131' ' ' LYS . 0.1 OUTLIER -113.25 -10.93 13.29 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.263 -0.881 . . . . 10.0 109.572 179.973 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 42.3 t -172.06 168.19 5.89 Favored 'General case' 0 CA--C 1.515 -0.377 0 N-CA-C 115.199 1.555 . . . . 10.0 115.199 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.4 t-20 -163.76 122.97 2.02 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 105.198 -2.149 . . . . 10.0 105.198 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -125.28 178.09 5.78 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 119.734 1.152 . . . . 10.0 111.278 -179.785 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 37.7 m-20 34.22 33.59 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.478 0 O-C-N 127.057 2.723 . . . . 10.0 112.298 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.645 ' HE2' ' HB1' ' A' ' 33' ' ' ALA . 6.0 t80 -68.42 -42.87 78.31 Favored 'General case' 0 CA--C 1.546 0.796 0 O-C-N 120.018 -1.676 . . . . 10.0 112.939 179.607 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 74.7 mt-10 -71.22 -34.48 70.87 Favored 'General case' 0 N--CA 1.464 0.238 0 O-C-N 120.317 -1.489 . . . . 10.0 112.55 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -74.58 -34.43 62.89 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 106.968 -1.493 . . . . 10.0 106.968 179.524 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -69.63 -27.9 65.46 Favored 'General case' 0 C--O 1.245 0.832 0 O-C-N 126.04 2.088 . . . . 10.0 109.079 179.587 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 44.5 mt -79.0 -25.59 43.33 Favored 'General case' 0 C--O 1.22 -0.479 0 N-CA-C 112.652 0.612 . . . . 10.0 112.652 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 17.3 tpt180 -79.11 -20.37 48.82 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 113.629 -1.623 . . . . 10.0 109.437 179.889 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.68 -44.42 96.3 Favored 'General case' 0 C--O 1.213 -0.847 0 C-N-CA 126.383 1.873 . . . . 10.0 113.228 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -84.88 -21.56 29.69 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 123.714 1.721 . . . . 10.0 109.712 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.9 t0 74.45 67.73 0.09 Allowed 'General case' 0 N--CA 1.48 1.027 0 CA-C-N 113.404 -1.725 . . . . 10.0 113.519 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 5.8 m -98.44 -176.89 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.469 0 N-CA-C 105.316 -2.105 . . . . 10.0 105.316 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.43 133.54 55.17 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-O 123.617 1.675 . . . . 10.0 113.411 -179.771 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 4.2 m -63.69 -31.77 54.34 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 N-CA-C 116.409 2.003 . . . . 10.0 116.409 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -74.14 -30.22 62.18 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-O 123.593 1.663 . . . . 10.0 108.829 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 60.8 tp -73.63 -22.06 60.11 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 113.325 -1.761 . . . . 10.0 112.686 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.5 ttp-105 -71.97 -31.02 65.87 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 114.931 -1.031 . . . . 10.0 111.917 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 14.8 tttm -74.2 -39.13 63.36 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-O 122.943 1.354 . . . . 10.0 113.872 -179.447 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.615 ' N ' HD13 ' A' ' 32' ' ' ILE . 1.2 mm -72.61 -33.21 44.1 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.747 0 O-C-N 119.619 -1.926 . . . . 10.0 112.074 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.645 ' HB1' ' HE2' ' A' ' 16' ' ' PHE . . . -69.77 -33.15 72.01 Favored 'General case' 0 C--O 1.217 -0.654 0 CA-C-O 118.348 -0.834 . . . . 10.0 111.659 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.405 ' C ' HD23 ' A' ' 35' ' ' LEU . 26.8 t-20 -60.21 -14.3 16.93 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 118.04 -1.464 . . . . 10.0 113.109 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.534 HD23 ' N ' ' A' ' 35' ' ' LEU . 5.9 mt -93.8 -18.6 21.87 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 118.517 -1.273 . . . . 10.0 111.86 -179.793 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -91.28 134.39 34.62 Favored 'General case' 0 N--CA 1.48 1.05 0 O-C-N 124.654 1.221 . . . . 10.0 109.033 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 16.8 mtpp -123.33 103.93 35.13 Favored Pre-proline 0 N--CA 1.475 0.783 0 N-CA-C 104.785 -2.302 . . . . 10.0 104.785 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -60.69 136.64 68.02 Favored 'Trans proline' 0 C--N 1.357 1.009 0 N-CA-C 117.796 2.191 . . . . 10.0 117.796 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.566 ' HB2' ' CD2' ' A' ' 8' ' ' TRP . 0.4 OUTLIER -100.05 174.66 6.06 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 104.876 -2.268 . . . . 10.0 104.876 179.455 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.408 ' C ' ' CD1' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -167.77 119.05 0.85 Allowed 'General case' 0 CA--C 1.497 -1.075 0 C-N-CA 116.82 -1.952 . . . . 10.0 112.681 179.839 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.413 ' HA ' ' HD1' ' A' ' 8' ' ' TRP . 9.0 tt0 -103.71 137.6 41.51 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 107.084 -1.45 . . . . 10.0 107.084 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 16.0 mt -112.64 153.23 14.28 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-O 117.427 -1.273 . . . . 10.0 107.709 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -147.75 126.32 3.79 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.734 0 N-CA-C 105.523 -2.029 . . . . 10.0 105.523 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 6.5 mm100 -131.86 113.44 13.47 Favored 'General case' 0 C--N 1.314 -0.977 0 O-C-N 125.605 1.816 . . . . 10.0 110.404 179.667 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -104.66 -11.77 16.73 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 105.089 -2.189 . . . . 10.0 105.089 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 166.47 -123.89 1.18 Allowed Glycine 0 CA--C 1.511 -0.171 0 N-CA-C 108.958 -1.657 . . . . 10.0 108.958 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -84.37 -8.13 59.08 Favored 'General case' 0 C--O 1.216 -0.701 0 CA-C-N 121.242 2.521 . . . . 10.0 108.308 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -96.02 118.03 31.82 Favored 'General case' 0 C--O 1.219 -0.524 0 N-CA-C 105.907 -1.886 . . . . 10.0 105.907 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 17.9 ttp -115.46 127.29 55.22 Favored 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 115.216 1.561 . . . . 10.0 115.216 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 15.0 mt -113.5 145.37 19.48 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.057 0 N-CA-C 105.175 -2.157 . . . . 10.0 105.175 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.6 mt -136.75 114.15 13.66 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-O 122.956 1.36 . . . . 10.0 107.807 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -95.92 84.32 3.84 Favored 'General case' 0 CA--C 1.503 -0.83 0 CA-C-N 112.911 -1.95 . . . . 10.0 111.555 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.415 ' HB ' ' HB3' ' A' ' 60' ' ' TYR . 98.5 m -89.35 115.91 27.16 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 100.203 -3.999 . . . . 10.0 100.203 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 43.9 mt -117.47 73.79 0.9 Allowed 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 119.174 3.028 . . . . 10.0 119.174 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 4.3 m -69.01 101.09 1.32 Allowed 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 102.572 -3.122 . . . . 10.0 102.572 179.809 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.8 t -60.16 96.35 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 119.991 1.269 . . . . 10.0 108.466 -179.716 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER 160.08 -42.6 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 126.713 2.005 . . . . 10.0 106.247 -179.865 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -144.11 105.16 4.21 Favored 'General case' 0 CA--C 1.511 -0.55 0 O-C-N 126.117 2.135 . . . . 10.0 112.517 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.92 125.38 23.78 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 120.079 -1.638 . . . . 10.0 108.637 179.848 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.415 ' HB3' ' HB ' ' A' ' 53' ' ' THR . 0.3 OUTLIER -109.01 125.92 52.57 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 102.403 -3.184 . . . . 10.0 102.403 -179.817 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 5.1 mt -132.81 129.55 58.25 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.722 0 N-CA-C 112.931 0.715 . . . . 10.0 112.931 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -134.0 164.32 27.58 Favored 'General case' 0 C--O 1.216 -0.7 0 N-CA-C 108.033 -1.099 . . . . 10.0 108.033 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -157.61 77.21 0.83 Allowed 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 101.041 -3.689 . . . . 10.0 101.041 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 1.8 m-30 -91.59 -178.07 4.97 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 117.212 2.301 . . . . 10.0 117.212 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -132.69 145.04 50.72 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 107.099 -1.445 . . . . 10.0 107.099 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 95.3 t -81.74 85.41 1.63 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.207 0 O-C-N 124.669 1.231 . . . . 10.0 113.335 -179.679 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 110.16 55.21 0.54 Allowed Glycine 0 C--O 1.221 -0.676 0 C-N-CA 120.547 -0.835 . . . . 10.0 113.367 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 34.4 ttmt -157.93 138.46 12.85 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-N 118.663 1.231 . . . . 10.0 112.6 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -78.2 123.15 26.58 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-O 123.197 1.475 . . . . 10.0 110.142 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -106.54 178.04 4.68 Favored 'General case' 0 C--O 1.244 0.79 0 CA-C-N 112.737 -2.028 . . . . 10.0 108.444 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -145.84 81.82 1.61 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 113.265 -1.789 . . . . 10.0 109.439 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -75.31 139.99 42.82 Favored 'General case' 0 C--O 1.219 -0.545 0 O-C-N 124.768 1.293 . . . . 10.0 112.068 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -112.32 70.88 0.72 Allowed 'General case' 0 N--CA 1.456 -0.154 0 CA-C-O 124.082 1.896 . . . . 10.0 106.007 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.434 HD22 ' HA ' ' A' ' 74' ' ' LEU . 0.2 OUTLIER -65.63 129.96 41.61 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 123.789 1.757 . . . . 10.0 111.625 179.778 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -135.19 65.75 1.55 Allowed 'General case' 0 CA--C 1.51 -0.589 0 N-CA-C 105.806 -1.924 . . . . 10.0 105.806 179.78 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -159.5 -178.89 33.91 Favored Glycine 0 N--CA 1.438 -1.207 0 CA-C-O 117.334 -1.814 . . . . 10.0 109.705 -179.621 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.631 HD13 ' N ' ' A' ' 77' ' ' ILE . 0.0 OUTLIER 37.7 -93.99 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.51 -0.589 0 O-C-N 127.179 2.34 . . . . 10.0 110.035 -179.848 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -87.94 -31.19 19.55 Favored 'General case' 0 CA--C 1.51 -0.578 0 N-CA-C 114.963 1.468 . . . . 10.0 114.963 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.4 t0 77.91 116.25 0.06 Allowed 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 127.451 2.3 . . . . 10.0 113.587 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 3.6 mtt180 169.15 161.96 0.05 Allowed 'General case' 0 C--N 1.315 -0.899 0 O-C-N 120.676 -1.265 . . . . 10.0 109.152 -179.705 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.04 165.78 11.22 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 108.802 -0.814 . . . . 10.0 108.802 -179.732 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -135.13 -174.8 3.71 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 122.522 1.153 . . . . 10.0 110.179 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -145.86 44.49 1.27 Allowed 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 101.44 -3.541 . . . . 10.0 101.44 179.868 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.41 ' HA ' ' HA ' ' A' ' 97' ' ' GLN . 0.9 OUTLIER -42.14 150.13 0.13 Allowed 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 118.931 2.937 . . . . 10.0 118.931 179.869 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 87.6 m -139.16 104.36 4.99 Favored 'General case' 0 CA--C 1.506 -0.746 0 N-CA-C 104.785 -2.302 . . . . 10.0 104.785 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -91.53 107.02 18.26 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.068 0 N-CA-C 102.795 -3.039 . . . . 10.0 102.795 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 15.6 p -139.97 135.41 32.73 Favored 'General case' 0 C--O 1.243 0.724 0 C-N-CA 119.001 -1.08 . . . . 10.0 111.562 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -65.94 110.74 3.01 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-O 123.072 1.415 . . . . 10.0 108.21 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -84.96 -24.12 28.47 Favored 'General case' 0 C--O 1.248 1.001 0 N-CA-C 102.76 -3.052 . . . . 10.0 102.76 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 146.05 70.74 0.02 OUTLIER Glycine 0 C--N 1.317 -0.525 0 N-CA-C 103.175 -3.97 . . . . 10.0 103.175 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 86.56 -57.23 0.06 Allowed 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 124.812 1.245 . . . . 10.0 108.113 -179.865 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.7 ttpp -55.86 105.29 0.17 Allowed 'General case' 0 C--O 1.236 0.36 0 N-CA-C 106.112 -1.81 . . . . 10.0 106.112 -179.785 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.524 HD13 ' CZ ' ' A' ' 4' ' ' PHE . 4.2 tp -67.97 99.48 0.86 Allowed 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 103.935 -2.617 . . . . 10.0 103.935 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -88.44 113.62 24.22 Favored 'General case' 0 C--O 1.218 -0.598 0 N-CA-C 114.858 1.429 . . . . 10.0 114.858 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 27.1 m -104.83 98.43 8.16 Favored 'General case' 0 N--CA 1.443 -0.787 0 O-C-N 126.044 2.09 . . . . 10.0 110.068 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -108.24 116.89 52.6 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 N-CA-C 105.061 -2.2 . . . . 10.0 105.061 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.41 ' HA ' ' HA ' ' A' ' 84' ' ' THR . 1.4 pt20 -110.45 118.4 36.16 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 126.727 2.517 . . . . 10.0 112.942 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 12.0 mtmt -74.61 119.53 18.92 Favored 'General case' 0 C--O 1.215 -0.754 0 O-C-N 124.276 0.985 . . . . 10.0 112.431 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -173.99 -160.69 22.72 Favored Glycine 0 C--N 1.338 0.669 0 N-CA-C 109.683 -1.367 . . . . 10.0 109.683 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -82.54 -172.15 3.88 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-O 116.204 -1.855 . . . . 10.0 111.568 179.86 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 81.05 -157.07 0.02 OUTLIER 'General case' 0 C--N 1.317 -0.84 0 O-C-N 127.087 2.742 . . . . 10.0 111.319 -179.863 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -136.29 -41.34 0.64 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.983 0.897 . . . . 10.0 113.087 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -97.61 1.39 60.02 Favored Glycine 0 CA--C 1.526 0.78 0 CA-C-O 116.108 -2.496 . . . . 10.0 117.041 -179.7 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 1.8 mtt180 -53.16 129.69 32.01 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 123.289 1.518 . . . . 10.0 109.692 -179.815 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 134.88 133.29 3.26 Favored Glycine 0 C--O 1.219 -0.829 0 CA-C-N 113.493 -1.685 . . . . 10.0 109.558 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -110.75 -169.47 1.46 Allowed 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 108.812 -0.81 . . . . 10.0 108.812 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -162.03 132.94 5.06 Favored 'General case' 0 C--O 1.211 -0.933 0 O-C-N 125.684 1.865 . . . . 10.0 108.713 -179.753 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -115.74 95.3 5.06 Favored 'General case' 0 C--N 1.316 -0.877 0 O-C-N 125.69 1.869 . . . . 10.0 109.846 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' TRP . . . . . 0.461 ' CD1' ' C ' ' A' ' 109' ' ' TRP . 1.3 t90 -109.73 114.18 27.56 Favored 'General case' 0 C--O 1.221 -0.414 0 CA-C-N 114.592 -1.185 . . . . 10.0 108.859 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.623 HG23 ' O ' ' A' ' 114' ' ' GLU . 88.3 mt -91.52 140.08 16.67 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 CA-C-N 113.412 -1.722 . . . . 10.0 114.041 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -116.67 64.45 0.71 Allowed 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 104.143 -2.54 . . . . 10.0 104.143 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 66.68 -119.24 11.93 Favored Glycine 0 N--CA 1.467 0.744 0 N-CA-C 108.294 -1.923 . . . . 10.0 108.294 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -63.15 -4.37 2.36 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 121.121 -1.223 . . . . 10.0 113.247 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.623 ' O ' HG23 ' A' ' 110' ' ' ILE . 10.3 mt-10 -118.14 156.66 28.32 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 119.388 0.994 . . . . 10.0 110.047 179.848 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.406 HD12 ' C ' ' A' ' 115' ' ' LEU . 0.2 OUTLIER -124.19 105.86 9.85 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 105.299 -2.111 . . . . 10.0 105.299 179.755 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 18.8 m80 -97.81 85.96 3.66 Favored 'General case' 0 CA--C 1.505 -0.788 0 O-C-N 119.55 -1.969 . . . . 10.0 109.049 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.82 115.15 24.05 Favored 'General case' 0 N--CA 1.447 -0.599 0 O-C-N 125.271 1.607 . . . . 10.0 110.869 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -117.16 90.68 3.39 Favored 'General case' 0 CA--C 1.498 -1.055 0 CA-C-O 118.47 -0.776 . . . . 10.0 111.264 -179.781 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 34.6 mtm -82.28 162.22 22.37 Favored 'General case' 0 CA--C 1.514 -0.414 0 C-N-CA 119.193 -1.003 . . . . 10.0 110.425 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 3.8 ttm180 -150.53 150.24 30.99 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 122.396 1.093 . . . . 10.0 112.38 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -166.62 124.75 1.39 Allowed 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 114.338 -1.301 . . . . 10.0 108.457 -179.799 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 53.58 34.74 19.25 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 117.952 2.575 . . . . 10.0 117.952 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 91.01 -6.97 81.69 Favored Glycine 0 C--N 1.336 0.546 0 N-CA-C 117.551 1.78 . . . . 10.0 117.551 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 15.1 t -108.72 117.97 55.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 CA-C-N 118.213 1.007 . . . . 10.0 112.469 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 22.7 m -92.37 119.28 31.76 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 126.009 2.068 . . . . 10.0 112.352 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -107.96 139.29 42.8 Favored 'General case' 0 C--N 1.322 -0.595 0 O-C-N 127.513 3.008 . . . . 10.0 106.175 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.42 149.58 34.98 Favored 'General case' 0 C--N 1.319 -0.745 0 C-N-CA 118.759 -1.176 . . . . 10.0 112.926 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -132.96 117.7 17.97 Favored 'General case' 0 C--N 1.318 -0.78 0 O-C-N 127.877 3.236 . . . . 10.0 109.509 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 38.9 t -78.39 87.42 1.1 Allowed 'Isoleucine or valine' 0 C--O 1.217 -0.636 0 C-N-CA 118.549 -1.26 . . . . 10.0 110.227 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -73.42 167.68 20.78 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 108.451 -0.944 . . . . 10.0 108.451 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.501 ' HB2' HD13 ' A' ' 11' ' ' LEU . 1.0 OUTLIER -139.04 88.25 2.27 Favored 'General case' 0 C--O 1.241 0.616 0 N-CA-C 106.343 -1.725 . . . . 10.0 106.343 -179.962 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 9.2 ttpt -61.67 98.82 0.1 Allowed 'General case' 0 C--N 1.32 -0.702 0 O-C-N 121.95 -0.469 . . . . 10.0 110.017 179.771 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 133' ' ' VAL . . . . . 0.492 ' CG1' ' CB ' ' A' ' 7' ' ' TYR . 9.5 p -43.96 -31.18 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 C-N-CA 124.76 1.224 . . . . 10.0 111.275 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 54.7 t-80 . . . . . 0 C--O 1.245 0.826 0 O-C-N 126.189 2.181 . . . . 10.0 110.981 -179.72 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 . . . . . 0 C--O 1.24 0.601 0 N-CA-C 110.715 -0.106 . . . . 10.0 110.715 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.42 ' HB3' HG21 ' A' ' 42' ' ' ILE . 8.1 m-85 -74.08 -15.9 61.04 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 123.989 0.806 . . . . 10.0 112.652 179.747 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -58.01 115.38 2.84 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 122.493 1.14 . . . . 10.0 112.766 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -162.3 -101.33 0.16 Allowed Glycine 0 C--N 1.344 0.986 0 N-CA-C 118.87 2.308 . . . . 10.0 118.87 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.414 ' HA ' ' CE3' ' A' ' 8' ' ' TRP . 6.4 m-85 -167.9 163.28 13.85 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 102.535 -3.135 . . . . 10.0 102.535 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.566 ' CZ3' ' CG ' ' A' ' 41' ' ' GLU 0.285 29.6 p90 -144.41 -176.39 5.02 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 125.683 1.593 . . . . 10.0 113.51 -179.492 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 164.41 93.52 0.0 OUTLIER 'General case' 0 C--O 1.232 0.173 0 CA-C-N 111.984 -2.371 . . . . 10.0 107.999 179.3 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.402 ' HG3' ' HB3' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -41.68 153.36 0.06 Allowed 'General case' 0 C--N 1.311 -1.083 0 N-CA-C 115.164 1.542 . . . . 10.0 115.164 179.435 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.462 HD22 ' CG1' ' A' ' 129' ' ' VAL . 0.3 OUTLIER -118.61 -49.0 2.47 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 108.065 -1.087 . . . . 10.0 108.065 -179.976 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.8 t -161.76 164.36 29.01 Favored 'General case' 0 C--O 1.242 0.68 0 N-CA-C 115.079 1.511 . . . . 10.0 115.079 179.76 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -129.25 151.36 50.0 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 105.121 -2.177 . . . . 10.0 105.121 179.837 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -151.47 137.53 18.26 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 116.839 2.163 . . . . 10.0 116.839 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 74.1 m-20 55.56 19.97 3.54 Favored 'General case' 0 N--CA 1.444 -0.754 0 O-C-N 125.793 1.933 . . . . 10.0 112.657 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.421 ' CZ ' ' HA ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -69.01 -20.43 64.15 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 114.551 1.315 . . . . 10.0 114.551 179.723 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -78.58 -40.14 35.5 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 119.794 -1.816 . . . . 10.0 111.576 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -75.55 -20.89 58.35 Favored 'General case' 0 CA--C 1.51 -0.581 0 N-CA-C 108.256 -1.016 . . . . 10.0 108.256 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -72.93 -34.2 66.43 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 105.964 -1.865 . . . . 10.0 105.964 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 41.5 mt -78.81 -23.31 45.2 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 120.82 1.646 . . . . 10.0 108.858 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.5 ttm-85 -69.33 -30.39 68.43 Favored 'General case' 0 N--CA 1.447 -0.617 0 O-C-N 126.127 2.142 . . . . 10.0 108.652 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.86 -38.95 83.75 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 125.152 1.381 . . . . 10.0 110.923 -179.645 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 33.4 mt -75.9 -28.17 57.98 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 117.51 -1.233 . . . . 10.0 109.454 179.816 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.4 t70 78.51 45.96 0.06 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 126.762 2.539 . . . . 10.0 113.042 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 3.2 m -85.64 -162.65 0.08 OUTLIER 'Isoleucine or valine' 0 C--O 1.243 0.748 0 N-CA-C 106.998 -1.482 . . . . 10.0 106.998 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -93.4 170.83 9.32 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 116.599 2.074 . . . . 10.0 116.599 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.5 m -75.89 -35.46 29.99 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 CA-C-N 112.847 -1.979 . . . . 10.0 111.733 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.05 -34.19 74.79 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 122.884 1.326 . . . . 10.0 111.293 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.734 HD13 ' O ' ' A' ' 29' ' ' LEU . 1.7 tm? -76.9 -40.85 45.95 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.492 -1.231 . . . . 10.0 111.553 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.5 ttp85 -61.38 -29.08 69.69 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 125.432 1.493 . . . . 10.0 113.948 179.706 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.48 -41.47 39.37 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 106.495 -1.669 . . . . 10.0 106.495 179.75 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.452 HD13 ' HA ' ' A' ' 32' ' ' ILE . 2.1 mm -62.25 -40.57 88.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 O-C-N 120.204 -1.56 . . . . 10.0 112.196 -179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -73.79 -48.25 32.9 Favored 'General case' 0 N--CA 1.476 0.83 0 O-C-N 125.245 1.591 . . . . 10.0 110.943 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.421 ' HA ' ' CZ ' ' A' ' 16' ' ' PHE . 0.0 OUTLIER -67.79 175.24 3.09 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-O 115.381 -2.247 . . . . 10.0 107.976 179.085 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.412 ' N ' ' CG ' ' A' ' 34' ' ' ASN . 0.3 OUTLIER 84.0 -43.6 0.09 Allowed 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 114.957 1.466 . . . . 10.0 114.957 179.831 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.479 HD11 ' HB3' ' A' ' 57' ' ' PHE . 51.9 mt -83.79 152.13 24.81 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 126.626 2.454 . . . . 10.0 111.182 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.402 ' HB3' ' HG3' ' A' ' 10' ' ' MET . 6.9 mttt -125.52 96.22 39.06 Favored Pre-proline 0 C--N 1.318 -0.797 0 O-C-N 127.374 2.921 . . . . 10.0 107.132 -179.737 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -63.6 -170.35 0.11 Allowed 'Trans proline' 0 C--O 1.219 -0.447 0 O-C-N 124.806 1.95 . . . . 10.0 116.261 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.551 ' HB3' ' CD1' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -141.93 171.36 14.16 Favored 'General case' 0 C--O 1.235 0.33 0 O-C-N 126.665 2.478 . . . . 10.0 108.024 179.942 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.441 ' HB2' ' CZ ' ' A' ' 130' ' ' PHE . 0.8 OUTLIER -149.21 90.93 1.78 Allowed 'General case' 0 CA--C 1.498 -1.046 0 CA-C-O 123.63 1.681 . . . . 10.0 112.398 -179.698 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.566 ' CG ' ' CZ3' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -88.98 142.72 27.4 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 103.609 -2.737 . . . . 10.0 103.609 -179.793 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.42 HG21 ' HB3' ' A' ' 4' ' ' PHE . 7.7 mm -127.31 149.97 32.8 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.736 0 CA-C-N 119.403 1.001 . . . . 10.0 108.51 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.413 HG23 ' O ' ' A' ' 42' ' ' ILE . 16.9 t -153.82 132.43 2.95 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 N-CA-C 104.963 -2.236 . . . . 10.0 104.963 179.853 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -141.7 130.03 22.37 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 124.178 1.942 . . . . 10.0 107.397 179.625 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -88.8 -9.21 52.62 Favored 'General case' 0 C--N 1.313 -0.995 0 C-N-CA 126.399 1.88 . . . . 10.0 107.98 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 145.49 -96.1 0.18 Allowed Glycine 0 N--CA 1.468 0.786 0 O-C-N 127.333 2.896 . . . . 10.0 108.888 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -90.57 -23.67 20.8 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 118.555 1.177 . . . . 10.0 110.586 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.4 t-160 -85.51 116.8 24.03 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 104.447 -2.427 . . . . 10.0 104.447 179.866 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 58.3 ttp -101.81 147.11 26.88 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 113.637 -1.62 . . . . 10.0 114.179 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 31.9 mt -137.79 115.46 12.81 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.735 0 O-C-N 119.113 -2.242 . . . . 10.0 107.852 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.6 mp -105.89 127.63 60.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 105.415 -2.068 . . . . 10.0 105.415 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 83.4 mtt180 -116.33 138.48 51.29 Favored 'General case' 0 C--O 1.212 -0.88 0 O-C-N 126.687 2.492 . . . . 10.0 111.799 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.421 ' HB ' ' O ' ' A' ' 59' ' ' ASN . 5.8 m -131.19 134.28 46.33 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 100.547 -3.871 . . . . 10.0 100.547 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.2 mp -126.48 63.81 1.27 Allowed 'General case' 0 C--N 1.321 -0.636 1 N-CA-C 121.845 4.017 . . . . 10.0 121.845 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.3 m -84.57 153.05 23.47 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 105.376 -2.083 . . . . 10.0 105.376 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -63.54 -29.16 70.46 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 107.249 -1.389 . . . . 10.0 107.249 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.479 ' HB3' HD11 ' A' ' 36' ' ' LEU . 2.1 t80 -112.41 123.74 50.95 Favored 'General case' 0 C--O 1.243 0.76 0 O-C-N 125.831 1.957 . . . . 10.0 107.945 -179.899 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 53.53 91.67 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 113.813 1.042 . . . . 10.0 113.813 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ASN . . . . . 0.503 ' HB3' ' CD1' ' A' ' 61' ' ' ILE . 6.0 m-20 -58.32 -52.39 65.81 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 115.126 -0.943 . . . . 10.0 110.736 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER 76.42 84.95 0.09 Allowed 'General case' 0 C--N 1.311 -1.105 0 C-N-CA 126.325 1.85 . . . . 10.0 106.105 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.503 ' CD1' ' HB3' ' A' ' 59' ' ' ASN . 1.7 mp -105.75 135.54 43.55 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.81 0 O-C-N 120.834 -1.166 . . . . 10.0 110.33 -179.868 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 7.8 mtt -125.58 166.58 16.43 Favored 'General case' 0 C--O 1.214 -0.802 0 N-CA-C 107.692 -1.225 . . . . 10.0 107.692 179.813 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -146.02 89.61 1.9 Allowed 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 100.301 -3.963 . . . . 10.0 100.301 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.654 ' CD2' HG21 ' A' ' 86' ' ' VAL . 3.7 m-30 -100.63 157.43 16.68 Favored 'General case' 0 C--N 1.32 -0.714 0 O-C-N 126.168 2.168 . . . . 10.0 113.999 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -120.22 104.47 10.09 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 105.504 -2.035 . . . . 10.0 105.504 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.433 ' O ' HG12 ' A' ' 66' ' ' VAL . 1.7 t -59.48 113.12 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.921 0 CA-C-N 115.423 -0.808 . . . . 10.0 109.49 -179.678 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 103.2 22.01 9.56 Favored Glycine 0 C--O 1.224 -0.5 0 CA-C-O 117.613 -1.659 . . . . 10.0 114.98 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.1 tttm -140.95 159.36 42.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 121.055 2.428 . . . . 10.0 115.951 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.86 144.19 35.22 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 107.765 -1.198 . . . . 10.0 107.765 -179.846 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -144.02 98.69 3.26 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-O 123.543 1.639 . . . . 10.0 112.686 179.735 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -70.33 103.4 2.39 Favored 'General case' 0 C--O 1.22 -0.474 0 O-C-N 119.364 -2.085 . . . . 10.0 105.639 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.458 ' HB3' ' HG ' ' A' ' 74' ' ' LEU . 3.5 mt-10 -75.86 -34.39 60.04 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-O 117.214 -1.374 . . . . 10.0 114.342 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 41.53 73.65 0.12 Allowed 'General case' 0 C--N 1.317 -0.816 0 O-C-N 126.409 2.318 . . . . 10.0 109.702 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.458 ' HG ' ' HB3' ' A' ' 72' ' ' GLU . 1.2 mt -95.55 126.77 41.07 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 115.742 1.756 . . . . 10.0 115.742 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 35.6 p -123.84 41.56 3.45 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 103.845 -2.65 . . . . 10.0 103.845 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -155.0 165.99 32.36 Favored Glycine 0 N--CA 1.446 -0.668 0 N-CA-C 109.733 -1.347 . . . . 10.0 109.733 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.472 HD13 ' N ' ' A' ' 77' ' ' ILE . 3.0 mm 64.21 -73.81 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 O-C-N 126.089 1.699 . . . . 10.0 107.772 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 23.7 p30 -139.09 39.02 2.12 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 117.548 -1.215 . . . . 10.0 108.567 179.635 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 4.26 91.16 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.646 0 O-C-N 127.523 3.014 . . . . 10.0 117.528 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.46 112.59 8.59 Favored 'General case' 0 CA--C 1.506 -0.726 0 CA-C-O 121.645 0.736 . . . . 10.0 112.828 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 7.3 pttt -80.25 121.54 25.76 Favored 'General case' 0 N--CA 1.438 -1.074 0 N-CA-C 103.515 -2.772 . . . . 10.0 103.515 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 28.2 p -153.21 -178.59 7.06 Favored 'General case' 0 C--O 1.216 -0.705 0 CA-C-N 114.906 -1.043 . . . . 10.0 108.204 -179.856 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.1 ptt? -130.48 132.78 45.83 Favored 'General case' 0 CA--C 1.505 -0.773 1 N-CA-C 99.003 -4.443 . . . . 10.0 99.003 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 25.6 m -132.64 120.71 22.12 Favored 'General case' 0 CA--C 1.505 -0.769 0 N-CA-C 118.179 2.659 . . . . 10.0 118.179 -179.737 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.12 118.6 36.83 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 112.313 -2.221 . . . . 10.0 108.471 -179.811 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.654 HG21 ' CD2' ' A' ' 64' ' ' PHE . 96.5 t -104.66 120.3 54.89 Favored 'Isoleucine or valine' 0 C--O 1.24 0.561 0 N-CA-C 105.795 -1.928 . . . . 10.0 105.795 -179.922 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -127.15 -159.14 0.91 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 123.94 1.829 . . . . 10.0 109.821 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 7.4 p-90 -148.77 123.59 9.93 Favored 'General case' 0 CA--C 1.51 -0.573 0 O-C-N 120.569 -1.332 . . . . 10.0 107.9 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -80.0 -38.33 32.33 Favored 'General case' 0 N--CA 1.447 -0.62 1 N-CA-C 98.862 -4.495 . . . . 10.0 98.862 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 134.4 126.81 2.67 Favored Glycine 0 N--CA 1.44 -1.034 0 N-CA-C 103.857 -3.697 . . . . 10.0 103.857 -179.855 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 58.14 20.44 7.01 Favored 'General case' 0 N--CA 1.468 0.426 0 O-C-N 120.706 -1.467 . . . . 10.0 110.247 179.821 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 5.0 ttpt -156.7 143.47 18.55 Favored 'General case' 0 C--N 1.341 0.211 0 O-C-N 125.879 1.987 . . . . 10.0 108.501 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 2.9 tp -111.45 82.94 1.69 Allowed 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 106.137 -1.801 . . . . 10.0 106.137 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -86.79 145.31 26.67 Favored 'General case' 0 CA--C 1.505 -0.769 0 O-C-N 119.716 -1.865 . . . . 10.0 111.303 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -144.07 141.72 30.23 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-N 114.392 -1.277 . . . . 10.0 109.777 179.75 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 1.6 t -122.62 142.71 38.08 Favored 'Isoleucine or valine' 0 C--O 1.242 0.702 0 N-CA-C 105.217 -2.142 . . . . 10.0 105.217 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 31.3 mt-30 -125.15 100.01 6.36 Favored 'General case' 0 C--O 1.246 0.881 0 CA-C-N 114.074 -1.421 . . . . 10.0 112.247 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 28.8 mmtt -63.45 113.49 3.3 Favored 'General case' 0 CA--C 1.505 -0.77 0 N-CA-C 115.396 1.628 . . . . 10.0 115.396 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -145.99 -114.11 0.85 Allowed Glycine 0 C--O 1.217 -0.953 0 C-N-CA 118.584 -1.769 . . . . 10.0 113.357 -179.651 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 18.8 tp10 -126.8 -9.02 6.1 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 115.348 1.611 . . . . 10.0 115.348 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 21.5 mmtt -107.57 158.26 17.38 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 117.699 2.481 . . . . 10.0 117.699 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -51.55 -63.07 1.25 Allowed 'General case' 0 C--O 1.238 0.48 0 O-C-N 119.674 -1.891 . . . . 10.0 109.948 -179.778 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -78.09 -82.76 0.6 Allowed Glycine 0 CA--C 1.505 -0.558 0 C-N-CA 121.14 -0.552 . . . . 10.0 114.143 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 46.2 81.85 0.04 OUTLIER 'General case' 0 N--CA 1.44 -0.956 0 CA-C-O 124.524 2.107 . . . . 10.0 114.398 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 179.23 174.57 45.46 Favored Glycine 0 C--O 1.219 -0.841 0 CA-C-N 112.686 -2.052 . . . . 10.0 111.191 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' TRP . . . . . 0.673 ' CE3' HD11 ' A' ' 117' ' ' LEU . 15.5 m0 -123.02 144.47 49.24 Favored 'General case' 0 C--O 1.217 -0.613 0 N-CA-C 108.077 -1.083 . . . . 10.0 108.077 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -131.1 133.34 45.55 Favored 'General case' 0 C--O 1.21 -0.979 0 N-CA-C 106.252 -1.759 . . . . 10.0 106.252 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.484 ' NE2' HD13 ' A' ' 115' ' ' LEU . 9.5 tp60 -141.97 112.79 7.32 Favored 'General case' 0 C--N 1.323 -0.569 0 O-C-N 125.706 1.879 . . . . 10.0 113.462 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -126.46 104.11 7.98 Favored 'General case' 0 C--O 1.212 -0.89 0 CA-C-O 122.929 1.347 . . . . 10.0 112.102 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 14.6 mt -55.21 109.29 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 112.968 -1.924 . . . . 10.0 112.614 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -96.46 -175.96 3.49 Favored 'General case' 0 C--N 1.333 -0.123 0 O-C-N 126.685 2.491 . . . . 10.0 106.865 -179.745 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -52.5 94.31 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.638 0 O-C-N 126.103 2.127 . . . . 10.0 111.378 179.786 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 44.86 33.42 0.99 Allowed 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 123.555 1.645 . . . . 10.0 111.669 -179.656 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -139.39 124.17 18.56 Favored 'General case' 0 C--O 1.241 0.613 0 N-CA-C 115.539 1.681 . . . . 10.0 115.539 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.484 HD13 ' NE2' ' A' ' 108' ' ' GLN . 0.5 OUTLIER -84.96 125.51 32.74 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 103.643 -2.725 . . . . 10.0 103.643 179.797 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -129.13 91.62 3.23 Favored 'General case' 0 N--CA 1.445 -0.689 0 O-C-N 121.784 -0.573 . . . . 10.0 110.239 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.673 HD11 ' CE3' ' A' ' 106' ' ' TRP . 1.1 tp -95.79 122.17 38.29 Favored 'General case' 0 N--CA 1.442 -0.857 0 O-C-N 124.988 1.43 . . . . 10.0 110.722 179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -122.23 108.0 12.79 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 117.999 -1.0 . . . . 10.0 109.085 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -98.32 136.51 38.39 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 118.571 0.623 . . . . 10.0 112.124 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -113.65 146.63 39.48 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 113.022 0.749 . . . . 10.0 113.022 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -162.44 113.54 1.56 Allowed 'General case' 0 C--N 1.32 -0.699 0 O-C-N 125.527 1.767 . . . . 10.0 109.639 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 52.72 46.7 26.23 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 117.279 -1.343 . . . . 10.0 112.899 179.804 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 74.13 14.49 80.45 Favored Glycine 0 N--CA 1.469 0.888 0 O-C-N 125.72 1.888 . . . . 10.0 117.205 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 97.3 t -116.31 112.98 41.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 N-CA-C 106.974 -1.491 . . . . 10.0 106.974 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 37.0 m -90.97 87.65 6.7 Favored 'General case' 0 N--CA 1.444 -0.736 0 O-C-N 125.169 1.543 . . . . 10.0 114.508 179.811 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 8.6 t -76.31 136.28 39.58 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 105.148 -2.168 . . . . 10.0 105.148 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -127.46 157.46 40.0 Favored 'General case' 0 N--CA 1.474 0.773 0 O-C-N 125.284 1.615 . . . . 10.0 112.055 -179.61 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -140.38 97.1 3.15 Favored 'General case' 0 CA--C 1.503 -0.846 0 CA-C-O 122.478 1.132 . . . . 10.0 110.044 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.462 ' CG1' HD22 ' A' ' 11' ' ' LEU . 40.7 t -72.93 129.09 36.11 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 O-C-N 120.62 -1.3 . . . . 10.0 107.92 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 130' ' ' PHE . . . . . 0.441 ' CZ ' ' HB2' ' A' ' 40' ' ' LYS . 0.6 OUTLIER -128.21 160.13 33.05 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 113.614 -1.63 . . . . 10.0 110.218 179.776 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.448 ' CG ' HD11 ' A' ' 11' ' ' LEU . 4.4 mmtt -132.54 127.78 35.87 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 105.817 -1.92 . . . . 10.0 105.817 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 12.7 tttt -90.7 102.84 15.59 Favored 'General case' 0 C--O 1.219 -0.536 0 O-C-N 125.178 1.549 . . . . 10.0 108.904 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 133' ' ' VAL . . . . . 0.43 ' H ' HG23 ' A' ' 133' ' ' VAL . 16.5 t -41.83 -55.17 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 127.491 2.994 . . . . 10.0 114.257 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.445 -0.699 0 O-C-N 125.508 1.755 . . . . 10.0 111.463 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.241 0.615 0 N-CA-C 108.936 -0.765 . . . . 10.0 108.936 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.541 ' CD1' ' CD1' ' A' ' 110' ' ' ILE . 20.8 m-30 -59.0 -14.85 10.52 Favored 'General case' 0 C--O 1.22 -0.486 0 N-CA-C 112.828 0.677 . . . . 10.0 112.828 -179.751 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -59.49 124.9 21.55 Favored 'General case' 0 C--O 1.244 0.765 0 N-CA-C 114.347 1.24 . . . . 10.0 114.347 -179.704 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -155.91 -105.39 0.23 Allowed Glycine 0 CA--C 1.532 1.106 0 C-N-CA 118.447 -1.835 . . . . 10.0 116.198 -179.737 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -166.11 166.38 17.14 Favored 'General case' 0 C--O 1.241 0.619 0 N-CA-C 102.445 -3.169 . . . . 10.0 102.445 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.529 ' CZ3' ' HB2' ' A' ' 41' ' ' GLU 0.302 18.1 p90 -144.3 -173.71 4.1 Favored 'General case' 0 C--N 1.314 -0.942 0 C-N-CA 126.591 1.957 . . . . 10.0 113.458 179.964 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.59 ' HD2' HG22 ' A' ' 133' ' ' VAL . 0.0 OUTLIER 162.5 72.71 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.575 0 O-C-N 127.428 2.955 . . . . 10.0 106.271 177.757 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.414 ' CE ' ' HB2' ' A' ' 37' ' ' LYS . 0.0 OUTLIER 0.51 -58.46 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.924 0 O-C-N 127.697 3.123 . . . . 10.0 117.57 -179.459 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.449 ' N ' ' O ' ' A' ' 9' ' ' LYS . 0.2 OUTLIER 81.71 -58.17 0.24 Allowed 'General case' 0 C--O 1.246 0.92 0 C-N-CA 127.421 2.288 . . . . 10.0 107.671 179.83 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -163.71 159.3 21.34 Favored 'General case' 0 C--N 1.323 -0.574 0 O-C-N 125.178 1.549 . . . . 10.0 114.114 179.844 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 4.6 p-10 -157.57 164.16 37.59 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 112.429 -2.169 . . . . 10.0 108.291 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -144.31 -178.92 6.21 Favored 'General case' 0 C--O 1.219 -0.515 0 O-C-N 125.623 1.827 . . . . 10.0 111.88 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 28.09 44.13 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.555 0 O-C-N 126.458 2.349 . . . . 10.0 114.119 179.879 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -72.13 -45.79 59.16 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-O 117.88 -1.057 . . . . 10.0 110.608 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -78.4 -22.51 47.69 Favored 'General case' 0 C--O 1.218 -0.567 0 CA-C-O 123.488 1.613 . . . . 10.0 110.358 179.82 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -76.55 -27.06 55.77 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 123.499 1.619 . . . . 10.0 107.11 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -77.25 -33.65 55.98 Favored 'General case' 0 CA--C 1.55 0.947 0 CA-C-N 113.475 -1.693 . . . . 10.0 110.49 -179.856 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 83.5 mt -70.55 -31.28 68.27 Favored 'General case' 0 C--O 1.215 -0.712 0 O-C-N 124.501 1.126 . . . . 10.0 110.561 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.56 -22.77 58.83 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 114.972 -1.013 . . . . 10.0 110.383 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.93 -31.34 67.92 Favored 'General case' 0 C--O 1.214 -0.807 0 CA-C-N 119.154 0.888 . . . . 10.0 112.287 179.793 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.8 mt -92.26 -21.36 20.37 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 124.658 1.224 . . . . 10.0 109.175 179.568 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 34.9 t0 76.98 49.36 0.05 Allowed 'General case' 0 C--O 1.244 0.788 0 N-CA-C 115.849 1.796 . . . . 10.0 115.849 -179.726 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 33.1 m -80.12 -179.2 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.815 0 O-C-N 118.716 -2.49 . . . . 10.0 108.406 179.816 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -60.54 155.48 18.48 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 119.093 -1.043 . . . . 10.0 111.769 179.583 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.6 m -75.91 -26.09 17.51 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.921 0 N-CA-C 116.834 2.161 . . . . 10.0 116.834 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -77.52 -25.26 50.09 Favored 'General case' 0 C--O 1.243 0.755 0 O-C-N 121.047 -1.033 . . . . 10.0 109.866 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.38 -31.14 65.33 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 114.625 -1.171 . . . . 10.0 111.757 -179.693 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.4 ttm180 -68.39 -33.3 74.0 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 125.791 1.636 . . . . 10.0 110.223 179.667 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -74.39 -40.29 62.15 Favored 'General case' 0 CA--C 1.508 -0.65 0 CA-C-N 113.168 -1.833 . . . . 10.0 111.535 -179.746 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.468 HG21 ' CE1' ' A' ' 57' ' ' PHE . 0.4 OUTLIER -73.58 -52.57 20.74 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 CA-C-O 122.471 1.129 . . . . 10.0 112.975 179.968 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -56.06 -21.8 23.96 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 112.511 -2.131 . . . . 10.0 112.659 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -66.87 -47.67 71.16 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-O 118.231 -0.89 . . . . 10.0 112.656 -179.742 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.422 ' O ' HD12 ' A' ' 35' ' ' LEU . 1.2 pp -73.01 -2.53 21.48 Favored 'General case' 0 CA--C 1.517 -0.303 0 O-C-N 125.091 1.494 . . . . 10.0 114.088 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -103.66 156.04 18.1 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 122.928 1.347 . . . . 10.0 112.748 179.504 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.414 ' HB2' ' CE ' ' A' ' 10' ' ' MET . 17.4 mttt -140.32 126.94 12.08 Favored Pre-proline 0 N--CA 1.466 0.347 0 N-CA-C 105.689 -1.967 . . . . 10.0 105.689 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_exo -86.27 153.14 9.4 Favored 'Trans proline' 0 CA--C 1.538 0.715 0 C-N-CA 124.836 3.69 . . . . 10.0 116.632 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.48 ' HB2' ' NE1' ' A' ' 8' ' ' TRP . 0.5 OUTLIER -114.63 166.74 11.41 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 125.571 1.548 . . . . 10.0 106.974 179.872 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.4 ttmt -161.36 104.93 1.27 Allowed 'General case' 0 CA--C 1.496 -1.103 0 C-N-CA 116.697 -2.001 . . . . 10.0 112.148 -179.643 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.529 ' HB2' ' CZ3' ' A' ' 8' ' ' TRP . 27.6 tt0 -94.79 135.64 36.04 Favored 'General case' 0 C--O 1.24 0.556 0 N-CA-C 102.41 -3.182 . . . . 10.0 102.41 179.881 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.435 HG23 HD12 ' A' ' 51' ' ' ILE . 62.4 mt -120.62 150.78 23.42 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 CA-C-N 120.291 1.405 . . . . 10.0 109.319 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -141.84 127.19 17.87 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 N-CA-C 103.898 -2.63 . . . . 10.0 103.898 -179.882 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 -132.62 103.52 6.18 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 125.203 1.564 . . . . 10.0 110.953 -179.757 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -69.45 -63.05 1.14 Allowed 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 106.262 -1.755 . . . . 10.0 106.262 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -163.67 -78.75 0.03 OUTLIER Glycine 0 CA--C 1.532 1.108 0 N-CA-C 109.614 -1.394 . . . . 10.0 109.614 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -107.24 53.71 0.69 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 123.351 1.548 . . . . 10.0 109.089 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -163.43 168.52 20.16 Favored 'General case' 0 C--O 1.215 -0.733 0 N-CA-C 105.041 -2.207 . . . . 10.0 105.041 -179.846 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.481 ' HE1' HD21 ' A' ' 93' ' ' LEU . 6.6 ttp -163.41 102.54 0.95 Allowed 'General case' 0 C--O 1.216 -0.659 0 O-C-N 126.112 2.132 . . . . 10.0 112.317 179.66 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.592 HD12 ' N ' ' A' ' 50' ' ' ILE . 2.3 mp -93.98 100.6 11.43 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.759 0 O-C-N 124.483 1.115 . . . . 10.0 108.177 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.466 ' N ' HD13 ' A' ' 51' ' ' ILE . 0.4 OUTLIER -95.59 114.82 33.12 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.805 0 CA-C-O 123.722 1.725 . . . . 10.0 106.745 -179.897 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -115.03 125.97 54.19 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 112.926 -1.943 . . . . 10.0 111.843 179.817 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 26.7 m -112.32 121.71 45.66 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 100.908 -3.738 . . . . 10.0 100.908 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.9 mt -94.64 12.82 26.3 Favored 'General case' 0 CA--C 1.513 -0.467 0 N-CA-C 121.597 3.925 . . . . 10.0 121.597 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.2 p -68.19 129.08 38.86 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 103.908 -2.627 . . . . 10.0 103.908 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -83.32 156.53 23.0 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 107.869 -1.16 . . . . 10.0 107.869 -179.906 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.468 ' CE1' HG21 ' A' ' 32' ' ' ILE . 3.9 t80 83.75 10.77 0.46 Allowed 'General case' 0 C--N 1.324 -0.506 0 O-C-N 126.468 2.355 . . . . 10.0 105.308 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.759 ' HG2' HD11 ' A' ' 77' ' ' ILE . 5.7 mtp85 -151.45 -69.01 0.17 Allowed 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 126.066 1.747 . . . . 10.0 111.235 -179.795 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 24.49 88.91 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.775 0 O-C-N 128.441 3.588 . . . . 10.0 112.139 179.66 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 46.3 p90 -121.78 148.85 44.14 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 106.86 -1.533 . . . . 10.0 106.86 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.417 HG22 ' N ' ' A' ' 62' ' ' MET . 3.2 mp -133.27 158.87 43.14 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.869 0 N-CA-C 112.475 0.546 . . . . 10.0 112.475 180.0 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' MET . . . . . 0.417 ' N ' HG22 ' A' ' 61' ' ' ILE . 0.7 OUTLIER -141.86 158.31 43.94 Favored 'General case' 0 C--O 1.215 -0.715 0 N-CA-C 107.031 -1.47 . . . . 10.0 107.031 -179.672 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 29.9 t0 -125.63 77.73 1.68 Allowed 'General case' 0 N--CA 1.441 -0.876 0 N-CA-C 104.279 -2.489 . . . . 10.0 104.279 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 8.4 m-30 -76.8 177.03 7.95 Favored 'General case' 0 C--O 1.242 0.686 0 N-CA-C 115.898 1.814 . . . . 10.0 115.898 -179.726 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 56.5 mt-30 -151.61 123.65 8.14 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 125.038 1.461 . . . . 10.0 108.089 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 53.2 t -58.16 137.79 19.96 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 C-N-CA 125.848 1.659 . . . . 10.0 109.156 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 65.74 9.89 47.59 Favored Glycine 0 N--CA 1.439 -1.108 0 CA-C-O 118.418 -1.212 . . . . 10.0 114.506 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.06 165.58 12.49 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 120.714 2.257 . . . . 10.0 112.442 179.668 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -122.34 149.11 44.22 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 108.09 -1.078 . . . . 10.0 108.09 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -152.38 -170.66 3.7 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 122.98 1.371 . . . . 10.0 110.528 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -143.73 110.38 5.56 Favored 'General case' 0 C--N 1.319 -0.73 0 C-N-CA 119.139 -1.024 . . . . 10.0 110.468 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -95.8 72.77 3.07 Favored 'General case' 0 N--CA 1.441 -0.877 0 O-C-N 120.385 -1.447 . . . . 10.0 111.172 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.419 ' HA ' ' CB ' ' A' ' 81' ' ' LYS . 6.0 p-10 -44.59 137.33 3.86 Favored 'General case' 0 C--N 1.315 -0.929 0 O-C-N 128.945 3.903 . . . . 10.0 105.815 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.71 HD13 ' O ' ' A' ' 74' ' ' LEU . 0.8 OUTLIER 63.85 119.72 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 116.748 2.129 . . . . 10.0 116.748 -179.717 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.533 ' N ' HD22 ' A' ' 74' ' ' LEU . 1.7 m -104.6 102.42 12.03 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 106.794 -1.558 . . . . 10.0 106.794 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -57.9 101.35 0.18 Allowed Glycine 0 CA--C 1.531 1.054 0 CA-C-O 115.945 -2.586 . . . . 10.0 110.216 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.759 HD11 ' HG2' ' A' ' 58' ' ' ARG . 7.0 mt 134.32 -68.53 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.954 0 O-C-N 127.748 2.675 . . . . 10.0 109.81 179.522 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -103.41 8.29 38.03 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 112.908 0.707 . . . . 10.0 112.908 -179.526 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.404 ' N ' ' O ' ' A' ' 75' ' ' THR . 0.0 OUTLIER 44.02 -166.71 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 127.136 2.174 . . . . 10.0 116.472 -179.694 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.402 ' HG3' ' N ' ' A' ' 81' ' ' LYS . 0.0 OUTLIER 78.08 156.52 0.17 Allowed 'General case' 0 CA--C 1.505 -0.766 0 CA-C-O 122.35 1.072 . . . . 10.0 110.998 179.761 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.419 ' CB ' ' HA ' ' A' ' 73' ' ' ASP . 1.4 pttm -96.11 136.61 36.34 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 105.32 -2.104 . . . . 10.0 105.32 179.804 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -120.45 137.71 54.19 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 125.651 1.58 . . . . 10.0 107.481 179.701 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.3 mtp -100.95 91.48 4.6 Favored 'General case' 0 N--CA 1.441 -0.897 0 N-CA-C 102.926 -2.99 . . . . 10.0 102.926 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 68.7 m -91.83 129.13 37.85 Favored 'General case' 0 C--O 1.215 -0.761 0 N-CA-C 114.121 1.156 . . . . 10.0 114.121 179.843 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 40.9 m -127.2 118.02 23.48 Favored 'General case' 0 N--CA 1.44 -0.94 0 O-C-N 126.564 2.415 . . . . 10.0 104.594 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 22.9 m -91.42 -175.75 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 N-CA-C 104.084 -2.561 . . . . 10.0 104.084 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 172.2 132.76 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.86 0 O-C-N 124.256 0.973 . . . . 10.0 111.268 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' TRP . . . . . 0.627 ' CD1' ' HA ' ' A' ' 91' ' ' ASP . 0.7 OUTLIER -78.74 80.83 5.08 Favored 'General case' 0 C--O 1.22 -0.469 0 N-CA-C 105.209 -2.145 . . . . 10.0 105.209 179.873 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -95.22 105.47 17.41 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 103.986 -2.598 . . . . 10.0 103.986 179.777 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 67.13 31.62 78.13 Favored Glycine 0 CA--C 1.504 -0.608 0 N-CA-C 108.552 -1.819 . . . . 10.0 108.552 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.627 ' HA ' ' CD1' ' A' ' 88' ' ' TRP . 0.5 OUTLIER 73.81 -11.59 0.94 Allowed 'General case' 0 C--O 1.236 0.394 0 CA-C-N 119.694 1.747 . . . . 10.0 114.768 179.911 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.502 ' HD3' ' CZ3' ' A' ' 109' ' ' TRP . 11.0 pttm -90.45 151.76 21.25 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 106.797 -1.557 . . . . 10.0 106.797 -179.863 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.481 HD21 ' HE1' ' A' ' 49' ' ' MET . 0.2 OUTLIER -82.41 92.73 7.07 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 106.104 -1.813 . . . . 10.0 106.104 179.962 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -98.41 95.88 7.63 Favored 'General case' 0 C--O 1.214 -0.789 0 O-C-N 120.515 -1.366 . . . . 10.0 110.003 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 30.8 p -106.25 143.87 33.76 Favored 'General case' 0 CA--C 1.507 -0.693 0 CA-C-O 124.382 2.039 . . . . 10.0 114.102 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -123.02 138.91 51.44 Favored 'Isoleucine or valine' 0 C--O 1.245 0.827 0 N-CA-C 104.551 -2.389 . . . . 10.0 104.551 179.801 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -123.41 76.23 1.38 Allowed 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.33 1.019 . . . . 10.0 112.642 -179.802 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 3.5 mmmt -46.39 124.92 6.24 Favored 'General case' 0 CA--C 1.512 -0.492 0 N-CA-C 113.753 1.02 . . . . 10.0 113.753 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 172.34 62.48 0.04 OUTLIER Glycine 0 CA--C 1.501 -0.82 0 O-C-N 126.081 2.113 . . . . 10.0 112.337 179.903 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 75.88 -172.44 0.1 Allowed 'General case' 0 C--N 1.316 -0.864 0 O-C-N 126.433 1.902 . . . . 10.0 114.574 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 13.0 mmtt 65.34 -177.25 0.18 Allowed 'General case' 0 N--CA 1.442 -0.873 0 CA-C-O 123.689 1.709 . . . . 10.0 113.184 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -124.3 49.6 1.77 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 113.519 -1.673 . . . . 10.0 114.231 179.903 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 153.21 36.59 0.03 OUTLIER Glycine 0 C--O 1.218 -0.885 0 N-CA-C 118.814 2.285 . . . . 10.0 118.814 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 43.3 mtp180 -75.95 163.64 26.97 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 116.951 0.375 . . . . 10.0 110.11 179.592 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 119.29 144.54 7.38 Favored Glycine 0 N--CA 1.437 -1.27 0 C-N-CA 118.956 -1.592 . . . . 10.0 110.225 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 19.1 m0 -111.27 173.89 6.12 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-O 117.123 -1.418 . . . . 10.0 109.267 179.714 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 2.7 m -147.96 135.73 20.94 Favored 'General case' 0 C--O 1.209 -1.07 0 O-C-N 124.908 1.38 . . . . 10.0 108.384 179.853 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -120.56 131.25 54.57 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 125.758 1.911 . . . . 10.0 107.974 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' TRP . . . . . 0.502 ' CZ3' ' HD3' ' A' ' 92' ' ' LYS . 2.6 t-105 -146.37 124.87 12.4 Favored 'General case' 0 CA--C 1.5 -0.959 0 CA-C-O 122.453 1.121 . . . . 10.0 110.134 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.541 ' CD1' ' CD1' ' A' ' 4' ' ' PHE . 43.2 mt -99.16 124.6 52.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 116.281 1.956 . . . . 10.0 116.281 179.63 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -129.78 110.25 11.6 Favored 'General case' 0 CA--C 1.509 -0.611 0 O-C-N 126.318 2.261 . . . . 10.0 105.514 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 53.97 -104.4 0.23 Allowed Glycine 0 N--CA 1.459 0.227 0 N-CA-C 108.682 -1.767 . . . . 10.0 108.682 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -114.86 4.0 14.75 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 125.331 1.253 . . . . 10.0 110.683 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 73.5 tt0 -102.96 101.52 11.54 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 115.176 1.547 . . . . 10.0 115.176 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.648 HD12 ' C ' ' A' ' 115' ' ' LEU . 0.2 OUTLIER -67.48 107.65 2.54 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 103.574 -2.75 . . . . 10.0 103.574 179.764 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 116' ' ' HIS . . . . . 0.405 ' N ' HD12 ' A' ' 115' ' ' LEU . 0.3 OUTLIER -99.34 103.63 15.46 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 119.671 -1.893 . . . . 10.0 110.372 -179.902 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.856 HD21 ' CE ' ' A' ' 119' ' ' MET . 0.0 OUTLIER -103.73 143.06 33.3 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 124.228 1.966 . . . . 10.0 111.534 179.814 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -141.01 120.14 12.88 Favored 'General case' 0 CA--C 1.5 -0.98 0 O-C-N 120.507 -1.37 . . . . 10.0 108.758 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.856 ' CE ' HD21 ' A' ' 117' ' ' LEU . 3.5 mtm -95.53 -174.85 3.29 Favored 'General case' 0 N--CA 1.439 -1.007 0 N-CA-C 113.779 1.029 . . . . 10.0 113.779 179.974 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 9.2 tpt180 -167.84 129.8 1.51 Allowed 'General case' 0 N--CA 1.445 -0.695 0 O-C-N 124.238 0.961 . . . . 10.0 112.912 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 121' ' ' ALA . . . . . 0.614 ' O ' HG22 ' A' ' 124' ' ' VAL . . . -156.91 121.16 4.36 Favored 'General case' 0 CA--C 1.503 -0.832 0 CA-C-O 122.936 1.35 . . . . 10.0 110.037 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 59.99 14.52 4.39 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 124.022 1.868 . . . . 10.0 115.338 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 105.9 9.55 32.22 Favored Glycine 0 C--O 1.241 0.591 0 O-C-N 120.818 -1.176 . . . . 10.0 115.775 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.614 HG22 ' O ' ' A' ' 121' ' ' ALA . 20.1 m -101.69 164.32 3.05 Favored 'Isoleucine or valine' 0 C--O 1.239 0.539 0 CA-C-N 118.77 1.285 . . . . 10.0 110.061 179.776 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 1.3 m -131.41 108.67 9.78 Favored 'General case' 0 N--CA 1.447 -0.599 0 O-C-N 125.3 1.625 . . . . 10.0 114.558 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -111.47 137.45 49.26 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 104.753 -2.314 . . . . 10.0 104.753 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.88 166.98 23.15 Favored 'General case' 0 CA--C 1.509 -0.618 0 O-C-N 125.362 1.664 . . . . 10.0 114.913 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -139.99 163.76 31.83 Favored 'General case' 0 C--O 1.242 0.7 0 O-C-N 125.902 2.001 . . . . 10.0 108.665 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 6.9 m -125.98 66.95 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 N-CA-C 105.713 -1.958 . . . . 10.0 105.713 179.735 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 130' ' ' PHE . . . . . 0.528 ' HB3' ' HB3' ' A' ' 115' ' ' LEU . 0.1 OUTLIER -56.22 132.34 50.33 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 125.576 1.55 . . . . 10.0 109.309 -179.927 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 37.4 tptt -111.48 104.78 13.22 Favored 'General case' 0 C--O 1.242 0.68 0 N-CA-C 106.387 -1.708 . . . . 10.0 106.387 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 1.4 ttpt -73.72 97.62 2.74 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 105.467 -2.049 . . . . 10.0 105.467 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 133' ' ' VAL . . . . . 0.59 HG22 ' HD2' ' A' ' 9' ' ' LYS . 2.6 t -42.97 -31.9 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 124.546 1.154 . . . . 10.0 112.947 -179.865 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 10.1 t60 . . . . . 0 C--N 1.317 -0.837 0 O-C-N 127.372 2.92 . . . . 10.0 110.924 179.677 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.0 t0 . . . . . 0 C--O 1.233 0.235 0 CA-C-O 118.69 -0.671 . . . . 10.0 111.268 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.524 ' HE2' HD13 ' A' ' 93' ' ' LEU . 2.2 m-85 -175.45 -49.38 0.01 OUTLIER 'General case' 0 C--O 1.244 0.776 0 N-CA-C 116.356 1.984 . . . . 10.0 116.356 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 35.0 t-20 -35.91 104.5 0.03 OUTLIER 'General case' 0 C--O 1.241 0.655 0 N-CA-C 115.659 1.726 . . . . 10.0 115.659 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -148.06 -137.04 2.83 Favored Glycine 0 C--O 1.217 -0.906 0 N-CA-C 117.61 1.804 . . . . 10.0 117.61 179.726 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 15.4 t80 -156.26 101.08 2.04 Favored 'General case' 0 C--O 1.242 0.691 0 N-CA-C 102.964 -2.976 . . . . 10.0 102.964 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.668 ' CE3' ' CE2' ' A' ' 130' ' ' PHE . 0.0 OUTLIER -90.59 121.93 32.95 Favored 'General case' 0 C--N 1.312 -1.04 0 N-CA-C 114.657 1.354 . . . . 10.0 114.657 -179.972 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.69 132.25 42.54 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 103.033 -2.951 . . . . 10.0 103.033 178.825 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.98 150.52 31.97 Favored 'General case' 0 C--N 1.312 -1.049 0 N-CA-C 116.386 1.995 . . . . 10.0 116.386 -179.419 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.9 tp -124.02 -59.21 1.51 Allowed 'General case' 0 CA--C 1.505 -0.778 0 CA-C-N 113.265 -1.789 . . . . 10.0 111.535 -179.765 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -131.73 172.38 12.34 Favored 'General case' 0 C--O 1.221 -0.413 0 N-CA-C 115.958 1.836 . . . . 10.0 115.958 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -161.57 135.32 6.62 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 111.375 -2.648 . . . . 10.0 109.037 179.814 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -107.05 -77.13 0.6 Allowed 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 115.818 1.784 . . . . 10.0 115.818 -179.828 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 36.1 m120 -96.4 58.51 1.77 Allowed 'General case' 0 C--N 1.32 -0.683 0 O-C-N 126.525 2.391 . . . . 10.0 111.389 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -70.06 -58.56 3.68 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 113.651 0.982 . . . . 10.0 113.651 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.614 ' HA ' HD12 ' A' ' 20' ' ' LEU . 64.3 mt-10 -67.86 -29.06 68.1 Favored 'General case' 0 C--O 1.243 0.719 0 C-N-CA 123.758 0.823 . . . . 10.0 112.74 -179.849 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -76.39 -23.33 54.08 Favored 'General case' 0 C--O 1.218 -0.561 0 C-N-CA 119.118 -1.033 . . . . 10.0 109.652 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -73.98 -41.91 61.24 Favored 'General case' 0 CA--C 1.557 1.235 0 C-N-CA 124.455 1.102 . . . . 10.0 109.146 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.614 HD12 ' HA ' ' A' ' 17' ' ' GLU . 1.8 mt -70.7 -28.27 64.62 Favored 'General case' 0 C--O 1.217 -0.645 0 O-C-N 126.35 2.281 . . . . 10.0 112.891 -179.839 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.8 ttm-85 -73.61 -29.3 62.28 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 113.464 -1.698 . . . . 10.0 108.517 -179.787 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.3 -29.89 67.85 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 120.625 -1.297 . . . . 10.0 113.678 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.4 HD21 ' HB1' ' A' ' 121' ' ' ALA . 20.4 mt -105.45 1.2 27.49 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 125.35 1.656 . . . . 10.0 114.529 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 43.64 82.83 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.01 0 O-C-N 126.158 2.161 . . . . 10.0 110.164 -179.757 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 15.5 m -113.79 46.02 0.31 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.54 0 CA-C-N 113.344 -1.753 . . . . 10.0 111.167 -179.714 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 65.44 138.47 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 114.676 1.361 . . . . 10.0 114.676 179.781 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 31.1 m -64.12 -31.26 52.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 117.181 2.289 . . . . 10.0 117.181 -179.708 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -73.64 -41.48 62.69 Favored 'General case' 0 C--O 1.245 0.85 0 CA-C-N 114.373 -1.285 . . . . 10.0 111.748 -179.9 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.406 HD11 HH12 ' A' ' 58' ' ' ARG . 0.5 OUTLIER -64.54 -34.73 78.92 Favored 'General case' 0 C--O 1.223 -0.333 0 C-N-CA 123.628 0.771 . . . . 10.0 112.646 -179.604 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.93 -33.41 51.73 Favored 'General case' 0 CA--C 1.542 0.636 0 O-C-N 125.074 1.484 . . . . 10.0 111.488 179.718 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 33.1 ttmt -77.67 -33.71 53.28 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 123.064 1.411 . . . . 10.0 108.502 179.347 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -78.28 -38.93 23.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 N-CA-C 108.446 -0.946 . . . . 10.0 108.446 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -73.15 -20.1 60.98 Favored 'General case' 0 C--N 1.317 -0.814 0 O-C-N 124.386 1.054 . . . . 10.0 110.314 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -77.35 -33.11 55.41 Favored 'General case' 0 C--N 1.32 -0.689 0 O-C-N 121.46 -0.775 . . . . 10.0 111.677 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 73.3 mt -95.0 31.79 1.8 Allowed 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 122.24 1.019 . . . . 10.0 108.611 179.55 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 10.3 tp -153.83 140.59 19.06 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.495 1.118 . . . . 10.0 109.35 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -122.02 119.43 28.8 Favored Pre-proline 0 N--CA 1.47 0.57 0 N-CA-C 105.348 -2.093 . . . . 10.0 105.348 179.823 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -76.43 111.49 3.27 Favored 'Trans proline' 0 N--CA 1.446 -1.313 1 C-N-CA 126.365 4.71 . . . . 10.0 118.925 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -83.41 122.01 27.93 Favored 'General case' 0 C--O 1.219 -0.518 0 N-CA-C 104.329 -2.471 . . . . 10.0 104.329 179.12 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.598 ' HE3' ' CH2' ' A' ' 8' ' ' TRP . 2.5 ttpt -104.62 131.84 51.56 Favored 'General case' 0 C--O 1.209 -1.067 0 CA-C-O 123.293 1.521 . . . . 10.0 112.905 -179.511 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -115.88 129.34 56.37 Favored 'General case' 0 C--O 1.239 0.522 0 N-CA-C 104.841 -2.281 . . . . 10.0 104.841 179.835 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.5 mt -102.76 144.62 13.42 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 C-N-CA 119.012 -1.075 . . . . 10.0 113.331 179.684 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 92.8 t -140.73 124.2 16.83 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.938 0 N-CA-C 104.427 -2.434 . . . . 10.0 104.427 179.849 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -111.04 154.19 24.56 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 108.718 -0.845 . . . . 10.0 108.718 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -131.75 53.71 1.98 Allowed 'General case' 0 C--O 1.236 0.359 0 CA-C-O 123.163 1.459 . . . . 10.0 107.352 179.834 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 77.03 -92.45 1.04 Allowed Glycine 0 C--N 1.339 0.708 0 N-CA-C 105.602 -2.999 . . . . 10.0 105.602 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -92.48 -49.2 6.25 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 108.138 -1.06 . . . . 10.0 108.138 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 43.4 m170 -60.52 141.73 56.18 Favored 'General case' 0 C--O 1.218 -0.581 0 CA-C-O 122.482 1.134 . . . . 10.0 108.556 179.755 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 33.1 ttp -135.1 141.95 46.15 Favored 'General case' 0 N--CA 1.437 -1.101 0 CA-C-N 113.635 -1.62 . . . . 10.0 111.493 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 3.2 mt -130.19 136.73 58.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 106.701 -1.592 . . . . 10.0 106.701 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.7 mm -119.93 105.36 17.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 122.998 1.38 . . . . 10.0 108.759 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.514 ' HB3' HD23 ' A' ' 54' ' ' LEU . 21.5 mtp85 -89.98 113.36 25.01 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 113.7 -1.591 . . . . 10.0 109.423 179.859 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.447 HG23 ' HE2' ' A' ' 40' ' ' LYS . 4.3 m -108.83 95.52 5.71 Favored 'General case' 0 C--O 1.239 0.543 0 N-CA-C 100.286 -3.968 . . . . 10.0 100.286 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.514 HD23 ' HB3' ' A' ' 52' ' ' ARG . 2.8 mm? -95.33 146.09 24.63 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 117.531 2.419 . . . . 10.0 117.531 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -159.19 174.49 14.77 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 113.008 -1.905 . . . . 10.0 106.898 179.817 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 19.9 p -95.47 -8.71 34.61 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 121.647 -0.658 . . . . 10.0 110.82 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 6.4 t80 -92.6 -50.33 5.66 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 124.996 1.319 . . . . 10.0 109.461 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.406 HH12 HD11 ' A' ' 29' ' ' LEU . 0.0 OUTLIER -162.89 -177.1 5.29 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 125.332 1.645 . . . . 10.0 111.052 179.714 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 51.8 p30 -138.68 156.83 47.08 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-O 124.276 1.989 . . . . 10.0 113.883 179.631 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -123.87 112.79 17.67 Favored 'General case' 0 C--O 1.211 -0.928 0 N-CA-C 104.904 -2.258 . . . . 10.0 104.904 179.827 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 19.9 mm -114.19 129.86 69.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 O-C-N 124.184 0.928 . . . . 10.0 110.65 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 3.0 mtt -130.19 156.3 44.82 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 107.134 -1.432 . . . . 10.0 107.134 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -141.43 75.13 1.48 Allowed 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 103.797 -2.668 . . . . 10.0 103.797 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.525 ' CD2' HG21 ' A' ' 86' ' ' VAL . 2.6 m-30 -76.66 162.87 27.38 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 114.378 1.251 . . . . 10.0 114.378 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -131.32 107.1 8.72 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 113.322 -1.763 . . . . 10.0 108.34 -179.804 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -64.29 135.19 28.31 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 N-CA-C 108.255 -1.017 . . . . 10.0 108.255 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 56.39 36.25 69.08 Favored Glycine 0 N--CA 1.437 -1.257 0 O-C-N 126.016 2.073 . . . . 10.0 117.254 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -156.42 139.23 15.21 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 115.256 1.576 . . . . 10.0 115.256 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -52.7 138.83 27.88 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-O 119.16 -0.448 . . . . 10.0 111.786 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -140.75 96.22 2.98 Favored 'General case' 0 C--O 1.243 0.753 0 CA-C-O 123.209 1.48 . . . . 10.0 113.02 179.831 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -74.86 137.82 42.06 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 105.003 -2.221 . . . . 10.0 105.003 -179.861 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -138.58 130.53 28.16 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 124.228 1.011 . . . . 10.0 113.288 -179.854 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 20.9 p-10 -104.6 118.42 36.53 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-O 125.233 2.444 . . . . 10.0 111.684 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -124.66 126.62 46.04 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 116.658 2.096 . . . . 10.0 116.658 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -144.04 104.68 4.17 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 107.955 -1.128 . . . . 10.0 107.955 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 140.66 -80.42 0.26 Allowed Glycine 0 N--CA 1.442 -0.951 0 C-N-CA 119.766 -1.207 . . . . 10.0 111.047 -179.887 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -84.74 96.18 4.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 N-CA-C 106.302 -1.74 . . . . 10.0 106.302 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.48 -19.33 0.4 Allowed 'General case' 0 C--O 1.243 0.741 0 N-CA-C 115.16 1.541 . . . . 10.0 115.16 -179.919 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.0 p30 49.75 -164.25 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 125.756 1.622 . . . . 10.0 114.733 -179.802 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 8.6 ttm-85 83.82 143.74 0.07 Allowed 'General case' 0 C--N 1.32 -0.7 0 O-C-N 125.303 1.627 . . . . 10.0 110.906 179.775 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 5.5 pttt -93.98 165.34 12.7 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 102.412 -3.181 . . . . 10.0 102.412 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -155.1 144.42 21.12 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 120.89 -1.131 . . . . 10.0 108.695 179.848 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 31.2 mtt -114.34 52.05 0.85 Allowed 'General case' 0 N--CA 1.439 -1.001 0 N-CA-C 102.865 -3.013 . . . . 10.0 102.865 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 50.2 m -52.23 126.09 17.84 Favored 'General case' 0 N--CA 1.442 -0.862 0 N-CA-C 117.44 2.385 . . . . 10.0 117.44 -179.88 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 9.3 m -125.46 112.74 16.61 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 103.668 -2.716 . . . . 10.0 103.668 179.762 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.525 HG21 ' CD2' ' A' ' 64' ' ' PHE . 31.6 t -85.06 159.55 3.34 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.594 0 N-CA-C 101.095 -3.669 . . . . 10.0 101.095 -179.805 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -156.0 165.75 35.53 Favored 'General case' 0 C--N 1.318 -0.789 0 O-C-N 125.022 1.451 . . . . 10.0 113.296 179.857 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' TRP . . . . . 0.465 ' CD1' ' C ' ' A' ' 88' ' ' TRP . 0.0 OUTLIER -115.41 125.37 53.06 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 105.308 -2.108 . . . . 10.0 105.308 179.922 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -142.77 103.75 4.25 Favored 'General case' 0 CA--C 1.506 -0.726 0 N-CA-C 101.559 -3.497 . . . . 10.0 101.559 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 74.63 -146.94 36.27 Favored Glycine 0 CA--C 1.501 -0.796 0 N-CA-C 109.271 -1.531 . . . . 10.0 109.271 179.821 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -97.32 20.32 11.73 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-O 122.446 1.117 . . . . 10.0 109.681 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 6.6 mtmm -104.58 -174.67 2.59 Favored 'General case' 0 CA--C 1.508 -0.647 0 O-C-N 120.741 -1.225 . . . . 10.0 109.633 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.524 HD13 ' HE2' ' A' ' 4' ' ' PHE . 8.1 tp -131.36 128.6 39.99 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 103.125 -2.917 . . . . 10.0 103.125 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 6.6 mp0 -128.07 125.66 39.71 Favored 'General case' 0 C--N 1.316 -0.873 0 O-C-N 124.941 1.401 . . . . 10.0 112.515 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -124.7 125.62 44.38 Favored 'General case' 0 C--N 1.321 -0.667 0 O-C-N 121.9 -0.5 . . . . 10.0 109.845 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 71.1 t -120.8 142.95 34.57 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 N-CA-C 107.326 -1.361 . . . . 10.0 107.326 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 11.2 mt-30 -126.47 146.31 50.15 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 117.702 -1.142 . . . . 10.0 110.983 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 25.6 mmtt -86.24 -96.95 0.08 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 117.426 -1.273 . . . . 10.0 110.183 -179.839 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 51.4 -166.52 0.75 Allowed Glycine 0 CA--C 1.503 -0.674 0 O-C-N 124.126 0.891 . . . . 10.0 111.307 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -82.13 -170.11 2.73 Favored 'General case' 0 N--CA 1.447 -0.603 0 N-CA-C 112.788 0.662 . . . . 10.0 112.788 179.747 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 4.3 mttm 71.18 -158.75 0.13 Allowed 'General case' 0 N--CA 1.442 -0.867 0 CA-C-O 122.878 1.323 . . . . 10.0 113.178 179.78 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -146.75 18.2 1.29 Allowed 'General case' 0 CA--C 1.506 -0.736 0 O-C-N 119.861 -1.775 . . . . 10.0 115.272 -179.845 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -156.55 27.12 0.53 Allowed Glycine 0 C--O 1.226 -0.386 0 N-CA-C 118.226 2.05 . . . . 10.0 118.226 -179.571 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 8.6 mtm180 -86.07 117.78 25.12 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 121.492 -1.005 . . . . 10.0 109.641 179.621 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 163.24 151.58 6.48 Favored Glycine 0 N--CA 1.437 -1.242 0 O-C-N 125.66 1.85 . . . . 10.0 110.57 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 1.8 m0 -114.1 161.27 17.97 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 108.035 -1.098 . . . . 10.0 108.035 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.9 m -142.31 131.23 23.0 Favored 'General case' 0 C--O 1.212 -0.92 0 O-C-N 124.628 1.205 . . . . 10.0 110.984 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.463 ' NE2' HD21 ' A' ' 115' ' ' LEU . 3.0 mt-30 -119.3 131.57 55.77 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.602 1.161 . . . . 10.0 109.603 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 109' ' ' TRP . . . . . 0.492 ' CD1' ' C ' ' A' ' 109' ' ' TRP . 0.0 OUTLIER -137.47 113.71 10.04 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 106.871 -1.529 . . . . 10.0 106.871 179.977 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -86.27 146.41 6.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 N-CA-C 116.38 1.992 . . . . 10.0 116.38 179.76 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -149.94 127.49 11.57 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-O 116.072 -1.918 . . . . 10.0 107.575 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 46.61 -129.23 11.37 Favored Glycine 0 CA--C 1.534 1.233 0 N-CA-C 106.24 -2.744 . . . . 10.0 106.24 179.857 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -95.51 29.11 2.68 Favored 'General case' 0 C--N 1.321 -0.659 0 O-C-N 124.829 0.958 . . . . 10.0 113.304 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -140.71 151.8 44.8 Favored 'General case' 0 C--O 1.24 0.595 0 CA-C-N 119.801 1.182 . . . . 10.0 111.634 179.855 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.655 ' HG ' ' CE2' ' A' ' 130' ' ' PHE . 0.7 OUTLIER -108.99 130.8 55.48 Favored 'General case' 0 C--N 1.316 -0.869 0 O-C-N 125.949 2.03 . . . . 10.0 108.992 179.882 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 116' ' ' HIS . . . . . 0.644 ' N ' HD12 ' A' ' 115' ' ' LEU . 13.0 m80 -111.59 98.77 7.67 Favored 'General case' 0 CA--C 1.503 -0.83 0 N-CA-C 108.369 -0.974 . . . . 10.0 108.369 -179.809 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 15.7 tp -80.49 121.9 26.34 Favored 'General case' 0 CA--C 1.51 -0.567 0 C-N-CA 118.141 -1.424 . . . . 10.0 113.606 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -113.34 88.13 2.76 Favored 'General case' 0 C--O 1.214 -0.79 0 N-CA-C 104.239 -2.504 . . . . 10.0 104.239 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.47 149.96 26.31 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-N 114.387 -1.278 . . . . 10.0 111.447 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 24.4 mtt180 -144.56 137.52 26.84 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 120.466 1.485 . . . . 10.0 114.237 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 121' ' ' ALA . . . . . 0.4 ' HB1' HD21 ' A' ' 23' ' ' LEU . . . -150.18 133.61 16.49 Favored 'General case' 0 CA--C 1.507 -0.701 0 N-CA-C 107.073 -1.454 . . . . 10.0 107.073 -179.84 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 40.74 44.73 1.93 Allowed 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 116.943 2.201 . . . . 10.0 116.943 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 91.95 -11.96 70.76 Favored Glycine 0 CA--C 1.533 1.201 0 O-C-N 120.711 -1.243 . . . . 10.0 115.935 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 92.7 t -90.28 154.74 3.13 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 N-CA-C 107.385 -1.339 . . . . 10.0 107.385 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 34.5 m -144.57 92.35 2.29 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-O 124.728 2.204 . . . . 10.0 111.062 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -79.93 144.18 33.58 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-N 112.847 -1.978 . . . . 10.0 106.615 -179.839 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.18 101.01 5.4 Favored 'General case' 0 CA--C 1.504 -0.818 0 O-C-N 125.127 1.517 . . . . 10.0 110.948 -179.806 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.79 156.47 18.02 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 122.715 1.245 . . . . 10.0 108.625 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 11.0 p -143.73 137.29 24.67 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-O 117.296 -1.335 . . . . 10.0 107.756 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 130' ' ' PHE . . . . . 0.668 ' CE2' ' CE3' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -138.61 -169.98 2.73 Favored 'General case' 0 C--N 1.315 -0.894 0 O-C-N 125.138 1.524 . . . . 10.0 108.751 -179.858 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . 0.287 16.3 tptp -142.97 129.43 20.08 Favored 'General case' 0 C--N 1.32 -0.714 0 O-C-N 119.362 -2.086 . . . . 10.0 105.962 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 11.5 mtpt -81.47 110.55 16.98 Favored 'General case' 0 CA--C 1.503 -0.84 0 CA-C-O 123.464 1.602 . . . . 10.0 111.856 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 2.5 t -92.53 -0.45 10.02 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 114.773 -1.103 . . . . 10.0 109.091 179.679 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 12.1 m80 . . . . . 0 N--CA 1.434 -1.271 0 CA-C-N 113.938 -1.483 . . . . 10.0 111.572 179.79 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.54 0.587 0 CA-C-O 122.738 1.256 . . . . 10.0 108.934 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -70.73 -33.71 71.12 Favored 'General case' 0 C--O 1.224 -0.26 0 C-N-CA 125.653 1.581 . . . . 10.0 112.363 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 30.1 t-20 -46.38 94.49 0.01 OUTLIER 'General case' 0 C--O 1.243 0.711 0 O-C-N 124.613 1.196 . . . . 10.0 111.305 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -148.96 -114.23 0.73 Allowed Glycine 0 N--CA 1.443 -0.859 0 N-CA-C 119.2 2.44 . . . . 10.0 119.2 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -155.64 -166.37 2.21 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 104.912 -2.255 . . . . 10.0 104.912 -179.792 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.464 ' NE1' ' CB ' ' A' ' 39' ' ' ASP 0.359 41.9 p90 -157.93 -170.44 3.16 Favored 'General case' 0 C--N 1.311 -1.077 0 C-N-CA 125.228 1.411 . . . . 10.0 113.966 -178.104 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.501 ' HE3' ' CG1' ' A' ' 133' ' ' VAL . 5.7 ttmt 166.19 98.95 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 111.733 -2.485 . . . . 10.0 109.07 176.676 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.49 ' HA ' ' CD1' ' A' ' 130' ' ' PHE . 0.0 OUTLIER -53.85 137.49 38.43 Favored 'General case' 0 N--CA 1.442 -0.836 0 N-CA-C 115.72 1.748 . . . . 10.0 115.72 -179.746 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -108.65 -55.53 2.38 Favored 'General case' 0 C--O 1.246 0.878 0 N-CA-C 108.394 -0.965 . . . . 10.0 108.394 -179.77 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -169.24 145.62 3.39 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 123.646 1.688 . . . . 10.0 115.337 -179.985 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -119.17 157.31 28.2 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 111.407 -2.633 . . . . 10.0 104.094 179.735 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -152.58 170.86 19.16 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 117.353 -1.308 . . . . 10.0 111.711 179.867 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 47.87 38.19 8.58 Favored 'General case' 0 C--O 1.243 0.738 0 O-C-N 125.063 1.477 . . . . 10.0 111.699 -179.855 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -76.0 -33.67 59.7 Favored 'General case' 0 C--N 1.34 0.178 0 CA-C-N 114.342 -1.299 . . . . 10.0 114.328 -179.546 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -77.08 -34.88 56.93 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 122.344 1.069 . . . . 10.0 112.557 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -76.89 -25.37 52.96 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 113.754 -1.566 . . . . 10.0 109.124 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.408 ' HA ' HG11 ' A' ' 124' ' ' VAL . 2.6 t80 -65.91 -44.29 85.63 Favored 'General case' 0 CA--C 1.55 0.948 0 O-C-N 126.122 2.139 . . . . 10.0 110.01 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.803 HD12 ' HG2' ' A' ' 30' ' ' ARG . 19.6 mt -76.37 -23.58 54.14 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 119.578 1.081 . . . . 10.0 112.825 -179.982 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.43 -25.56 67.58 Favored 'General case' 0 C--O 1.244 0.807 0 O-C-N 125.479 1.737 . . . . 10.0 109.001 -179.752 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.7 -45.06 72.62 Favored 'General case' 0 N--CA 1.466 0.341 0 O-C-N 124.829 1.331 . . . . 10.0 111.47 -179.598 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.9 mt -85.07 -15.85 42.62 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 120.018 -1.676 . . . . 10.0 112.115 -179.669 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 19.3 t0 65.79 70.93 0.43 Allowed 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 114.642 1.349 . . . . 10.0 114.642 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.628 HG21 HD23 ' A' ' 29' ' ' LEU . 0.9 OUTLIER -103.65 167.34 2.64 Favored 'Isoleucine or valine' 0 C--N 1.344 0.367 0 N-CA-C 108.996 -0.742 . . . . 10.0 108.996 -179.825 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -51.57 160.02 0.68 Allowed 'General case' 0 C--O 1.244 0.77 0 O-C-N 125.148 1.53 . . . . 10.0 114.331 -179.959 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 39.3 t -76.18 -25.54 16.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 115.038 1.495 . . . . 10.0 115.038 -179.762 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -74.81 -33.62 62.24 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 114.482 -1.235 . . . . 10.0 112.629 179.746 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.628 HD23 HG21 ' A' ' 25' ' ' VAL . 13.1 tp -68.75 -26.25 65.14 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 122.003 0.906 . . . . 10.0 112.737 179.782 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.803 ' HG2' HD12 ' A' ' 20' ' ' LEU . 0.0 OUTLIER -77.54 -22.21 51.43 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 113.395 -1.729 . . . . 10.0 113.682 179.869 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.9 tptm -73.13 -46.72 49.49 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 124.621 1.168 . . . . 10.0 110.195 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.449 HG21 ' CE2' ' A' ' 57' ' ' PHE . 5.8 mm -61.69 -57.29 12.77 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 O-C-N 125.531 1.769 . . . . 10.0 111.498 -179.9 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -48.87 -66.23 0.43 Allowed 'General case' 0 C--N 1.319 -0.725 0 O-C-N 126.524 2.39 . . . . 10.0 113.255 179.808 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -59.74 83.3 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.453 0 O-C-N 119.481 -2.012 . . . . 10.0 115.194 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.511 HD12 HD23 ' A' ' 36' ' ' LEU . 0.8 OUTLIER 159.69 -29.87 0.0 OUTLIER 'General case' 0 N--CA 1.445 -0.696 0 O-C-N 125.407 1.692 . . . . 10.0 109.61 179.95 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.511 HD23 HD12 ' A' ' 35' ' ' LEU . 35.0 mt -79.39 145.21 33.5 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 119.581 -0.848 . . . . 10.0 112.964 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.2 mttt -129.89 103.11 17.36 Favored Pre-proline 0 N--CA 1.466 0.346 0 N-CA-C 107.129 -1.434 . . . . 10.0 107.129 -179.836 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 0.2 OUTLIER -82.66 155.5 15.85 Favored 'Trans proline' 0 N--CA 1.448 -1.198 1 C-N-CA 126.599 4.866 . . . . 10.0 117.384 179.999 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.464 ' CB ' ' NE1' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -107.86 159.4 16.55 Favored 'General case' 0 C--N 1.313 -0.984 0 O-C-N 128.661 3.725 . . . . 10.0 106.538 179.752 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.418 ' HG3' ' CZ ' ' A' ' 130' ' ' PHE . 2.4 mtpm? -144.82 109.98 5.15 Favored 'General case' 0 N--CA 1.435 -1.197 0 C-N-CA 117.837 -1.545 . . . . 10.0 113.54 -179.543 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.429 ' OE1' HG23 ' A' ' 43' ' ' VAL . 1.0 OUTLIER -96.19 146.71 24.46 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 102.602 -3.11 . . . . 10.0 102.602 179.086 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 13.0 mt -132.26 139.44 50.11 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 O-C-N 124.902 1.376 . . . . 10.0 111.007 179.82 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.429 HG23 ' OE1' ' A' ' 41' ' ' GLU . 49.5 t -132.18 114.04 22.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 113.03 -1.896 . . . . 10.0 106.248 179.742 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.448 ' HG2' ' CG ' ' A' ' 49' ' ' MET . 0.0 OUTLIER -115.86 135.17 54.25 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 108.043 -1.095 . . . . 10.0 108.043 179.603 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -142.52 101.29 3.85 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 107.148 -1.426 . . . . 10.0 107.148 -179.756 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 61.14 -121.33 26.09 Favored Glycine 0 C--O 1.243 0.717 0 CA-C-O 123.154 1.419 . . . . 10.0 110.228 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -103.01 37.49 1.95 Allowed 'General case' 0 N--CA 1.472 0.668 0 O-C-N 121.907 -0.761 . . . . 10.0 109.259 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 20.5 m80 -147.39 129.35 15.38 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 106.955 -1.498 . . . . 10.0 106.955 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.561 ' HE1' HD11 ' A' ' 93' ' ' LEU . 2.6 ttm -133.89 158.11 44.27 Favored 'General case' 0 C--O 1.215 -0.728 0 N-CA-C 114.279 1.215 . . . . 10.0 114.279 179.802 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.401 ' N ' ' HG2' ' A' ' 49' ' ' MET . 35.1 mt -134.19 136.48 53.25 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.98 0 N-CA-C 105.191 -2.152 . . . . 10.0 105.191 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.2 mp -122.18 143.86 33.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 N-CA-C 104.528 -2.397 . . . . 10.0 104.528 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 5.1 mtt180 -133.37 109.96 9.71 Favored 'General case' 0 C--O 1.212 -0.913 0 O-C-N 125.79 1.932 . . . . 10.0 115.295 -179.934 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.9 m -90.23 125.14 35.38 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 100.554 -3.869 . . . . 10.0 100.554 -179.885 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -120.2 33.56 5.55 Favored 'General case' 0 C--N 1.319 -0.723 1 N-CA-C 122.555 4.28 . . . . 10.0 122.555 -179.631 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 43.0 t -69.45 177.86 2.7 Favored 'General case' 0 C--N 1.323 -0.572 0 O-C-N 120.143 -1.598 . . . . 10.0 107.046 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.5 m -108.61 64.36 0.61 Allowed 'General case' 0 C--N 1.328 -0.356 0 O-C-N 125.819 1.949 . . . . 10.0 112.05 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.449 ' CE2' HG21 ' A' ' 32' ' ' ILE . 0.8 OUTLIER -173.47 -62.23 0.02 OUTLIER 'General case' 0 C--N 1.347 0.475 0 CA-C-N 113.758 -1.565 . . . . 10.0 107.504 -179.891 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 5.6 mtp180 -118.81 110.4 17.17 Favored 'General case' 0 C--N 1.328 -0.345 0 O-C-N 124.569 1.168 . . . . 10.0 112.412 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -114.71 91.44 3.62 Favored 'General case' 0 C--N 1.327 -0.381 0 O-C-N 124.807 1.317 . . . . 10.0 112.258 -179.912 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.563 ' C ' HD12 ' A' ' 61' ' ' ILE . 54.4 p90 -110.82 134.22 52.7 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 103.07 -2.937 . . . . 10.0 103.07 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.563 HD12 ' C ' ' A' ' 60' ' ' TYR . 1.4 mp -112.11 158.18 12.63 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.362 0 O-C-N 123.98 0.8 . . . . 10.0 111.912 179.801 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 1.2 mmm -134.93 152.0 51.35 Favored 'General case' 0 C--N 1.322 -0.614 0 O-C-N 125.056 1.472 . . . . 10.0 107.517 179.774 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -134.38 90.44 2.67 Favored 'General case' 0 C--N 1.309 -1.156 0 N-CA-C 102.182 -3.266 . . . . 10.0 102.182 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -81.88 171.06 14.92 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 117.106 2.262 . . . . 10.0 117.106 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.98 93.09 2.21 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 103.812 -2.662 . . . . 10.0 103.812 -179.78 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.437 ' CG1' ' HB2' ' A' ' 88' ' ' TRP . 22.6 t -49.47 145.53 1.22 Allowed 'Isoleucine or valine' 0 C--O 1.246 0.901 0 CA-C-N 114.439 -1.255 . . . . 10.0 109.407 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 69.78 -3.17 9.84 Favored Glycine 0 C--O 1.213 -1.205 0 N-CA-C 116.571 1.389 . . . . 10.0 116.571 179.718 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.5 tttt -109.9 146.94 34.3 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 119.212 1.506 . . . . 10.0 111.846 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.36 164.98 3.87 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 107.479 -1.304 . . . . 10.0 107.479 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -166.96 117.32 0.89 Allowed 'General case' 0 N--CA 1.439 -1.006 0 O-C-N 124.629 1.206 . . . . 10.0 113.473 -179.79 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -76.89 154.1 34.06 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 117.454 -1.698 . . . . 10.0 106.722 -179.824 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -140.92 72.37 1.39 Allowed 'General case' 0 C--O 1.22 -0.494 0 N-CA-C 115.537 1.68 . . . . 10.0 115.537 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -78.22 121.51 24.47 Favored 'General case' 0 N--CA 1.439 -0.977 0 N-CA-C 106.552 -1.647 . . . . 10.0 106.552 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 5.7 mt -110.96 67.79 0.65 Allowed 'General case' 0 C--N 1.318 -0.777 0 O-C-N 126.628 2.455 . . . . 10.0 114.692 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 1.4 p -88.44 66.39 8.26 Favored 'General case' 0 C--O 1.241 0.635 0 N-CA-C 105.527 -2.027 . . . . 10.0 105.527 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -156.25 -43.46 0.02 OUTLIER Glycine 0 C--O 1.241 0.583 0 C-N-CA 117.608 -2.234 . . . . 10.0 112.318 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 55.4 mt -113.5 -29.66 2.25 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.912 0 CA-C-N 119.257 1.529 . . . . 10.0 110.96 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -145.67 15.09 1.41 Allowed 'General case' 0 C--O 1.239 0.506 0 N-CA-C 114.053 1.131 . . . . 10.0 114.053 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 38.27 83.34 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 115.253 1.575 . . . . 10.0 115.253 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -141.49 -176.08 4.6 Favored 'General case' 0 C--N 1.316 -0.876 0 O-C-N 127.344 2.903 . . . . 10.0 111.965 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.14 156.82 27.34 Favored 'General case' 0 N--CA 1.445 -0.707 0 N-CA-C 103.656 -2.72 . . . . 10.0 103.656 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 1.5 p -166.84 -176.8 3.58 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 106.08 -1.822 . . . . 10.0 106.08 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 33.0 mtp -127.66 95.63 4.29 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 100.243 -3.984 . . . . 10.0 100.243 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 59.6 m -95.87 139.3 32.28 Favored 'General case' 0 CA--C 1.513 -0.471 0 N-CA-C 117.149 2.277 . . . . 10.0 117.149 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 19.8 m -133.21 97.47 3.99 Favored 'General case' 0 N--CA 1.437 -1.122 0 N-CA-C 106.89 -1.522 . . . . 10.0 106.89 179.748 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 2.5 t -76.64 97.87 1.71 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.466 0 N-CA-C 104.657 -2.349 . . . . 10.0 104.657 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.0 t -89.7 170.39 10.49 Favored 'General case' 0 C--N 1.316 -0.857 0 O-C-N 124.946 1.404 . . . . 10.0 108.959 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' TRP . . . . . 0.437 ' HB2' ' CG1' ' A' ' 66' ' ' VAL . 5.8 t90 -123.88 96.7 5.05 Favored 'General case' 0 C--O 1.24 0.579 0 N-CA-C 107.203 -1.406 . . . . 10.0 107.203 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -57.3 -64.51 0.86 Allowed 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 103.433 -2.803 . . . . 10.0 103.433 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 141.88 115.1 1.11 Allowed Glycine 0 CA--C 1.499 -0.914 0 N-CA-C 103.973 -3.651 . . . . 10.0 103.973 179.79 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 20.1 t0 87.9 -30.83 0.04 OUTLIER 'General case' 0 N--CA 1.448 -0.55 0 O-C-N 125.894 1.585 . . . . 10.0 109.834 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 8.5 mtmt -125.06 139.82 53.46 Favored 'General case' 0 C--N 1.32 -0.682 0 O-C-N 121.215 -0.928 . . . . 10.0 110.239 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.561 HD11 ' HE1' ' A' ' 49' ' ' MET . 0.4 OUTLIER -91.04 108.38 19.83 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 103.107 -2.923 . . . . 10.0 103.107 -179.899 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -121.29 138.64 54.15 Favored 'General case' 0 C--O 1.216 -0.706 0 O-C-N 125.136 1.522 . . . . 10.0 114.077 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 19.3 p -138.42 152.75 48.64 Favored 'General case' 0 C--N 1.321 -0.667 0 O-C-N 125.022 1.451 . . . . 10.0 108.396 -179.92 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 2.9 t -109.66 -54.83 5.3 Favored 'Isoleucine or valine' 0 C--O 1.247 0.922 0 N-CA-C 107.143 -1.429 . . . . 10.0 107.143 179.866 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.406 ' CG ' ' HB3' ' A' ' 104' ' ' ARG . 0.0 OUTLIER 71.08 111.99 0.06 Allowed 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 123.802 1.763 . . . . 10.0 109.263 179.926 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.33 67.2 7.18 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-O 123.578 1.656 . . . . 10.0 115.012 179.711 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -92.04 147.91 18.95 Favored Glycine 0 C--O 1.218 -0.86 0 N-CA-C 107.754 -2.138 . . . . 10.0 107.754 179.759 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -48.38 -25.99 1.86 Allowed 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 116.993 2.22 . . . . 10.0 116.993 179.855 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.55 -158.56 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.804 0 CA-C-N 119.788 1.176 . . . . 10.0 113.688 179.799 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -117.01 -24.93 7.38 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 126.186 1.795 . . . . 10.0 114.0 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -117.0 10.58 15.26 Favored Glycine 0 C--N 1.342 0.865 0 N-CA-C 116.757 1.463 . . . . 10.0 116.757 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.406 ' HB3' ' CG ' ' A' ' 97' ' ' GLN . 24.2 mmm-85 -55.34 143.16 29.4 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 119.031 1.416 . . . . 10.0 113.404 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 120.07 146.02 7.59 Favored Glycine 0 C--O 1.217 -0.922 0 O-C-N 124.576 1.173 . . . . 10.0 111.376 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -124.96 176.34 6.72 Favored 'General case' 0 CA--C 1.509 -0.623 0 O-C-N 120.854 -1.38 . . . . 10.0 109.961 179.871 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 76.7 m -145.74 132.74 20.27 Favored 'General case' 0 CA--C 1.509 -0.63 0 CA-C-O 118.799 -0.62 . . . . 10.0 109.593 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -123.92 126.58 46.61 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 123.929 0.891 . . . . 10.0 111.741 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 8.5 p90 -145.4 149.34 34.56 Favored 'General case' 0 C--O 1.213 -0.848 0 C-N-CA 124.301 1.04 . . . . 10.0 110.919 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 44.1 mt -89.82 147.18 5.38 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 O-C-N 125.541 1.776 . . . . 10.0 114.81 -179.799 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -131.74 75.05 1.62 Allowed 'General case' 0 C--O 1.24 0.589 0 N-CA-C 107.047 -1.464 . . . . 10.0 107.047 179.679 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 43.53 81.73 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.544 0 CA-C-O 118.176 -1.346 . . . . 10.0 110.71 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 71.15 23.78 4.04 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 118.277 -0.868 . . . . 10.0 110.947 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -143.0 103.1 4.12 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 114.774 1.398 . . . . 10.0 114.774 -179.723 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.437 ' CB ' ' HB2' ' A' ' 130' ' ' PHE . 0.8 OUTLIER -63.18 123.89 19.78 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 103.86 -2.644 . . . . 10.0 103.86 -179.97 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 8.2 t-80 -134.32 99.43 4.38 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 106.906 -1.516 . . . . 10.0 106.906 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 13.8 tp -89.23 149.22 23.2 Favored 'General case' 0 C--N 1.314 -0.935 0 O-C-N 125.665 1.853 . . . . 10.0 113.43 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -133.96 124.09 25.74 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 104.999 -2.223 . . . . 10.0 104.999 -179.856 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.01 131.77 53.36 Favored 'General case' 0 C--N 1.319 -0.757 0 O-C-N 120.834 -1.166 . . . . 10.0 108.423 -179.693 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 77.2 mtm-85 -125.88 145.66 50.16 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 122.568 1.175 . . . . 10.0 110.49 179.712 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -153.62 115.04 4.18 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 106.465 -1.68 . . . . 10.0 106.465 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 45.95 57.08 5.43 Favored 'General case' 0 C--O 1.245 0.843 0 O-C-N 126.154 2.159 . . . . 10.0 116.697 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 87.69 -22.18 18.64 Favored Glycine 0 CA--C 1.534 1.278 0 N-CA-C 116.543 1.377 . . . . 10.0 116.543 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.408 HG11 ' HA ' ' A' ' 19' ' ' TYR . 2.6 t -75.64 151.73 6.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 CA-C-N 119.478 1.639 . . . . 10.0 109.556 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 125' ' ' THR . . . . . 0.479 ' O ' HG22 ' A' ' 125' ' ' THR . 12.8 m -136.56 86.12 2.19 Favored 'General case' 0 C--N 1.318 -0.782 0 O-C-N 124.473 1.108 . . . . 10.0 110.811 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 30.6 p -98.66 154.48 17.92 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 112.337 -2.21 . . . . 10.0 105.062 -179.726 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.01 146.38 27.75 Favored 'General case' 0 C--O 1.221 -0.445 0 CA-C-O 123.374 1.559 . . . . 10.0 114.397 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -113.11 124.58 52.9 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 114.035 -1.439 . . . . 10.0 111.133 179.902 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 55.2 t -105.57 138.4 30.86 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.82 0 CA-C-N 113.41 -1.723 . . . . 10.0 107.203 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 130' ' ' PHE . . . . . 0.49 ' CD1' ' HA ' ' A' ' 10' ' ' MET . 15.3 m-85 -128.93 -177.68 4.31 Favored 'General case' 0 C--O 1.215 -0.72 0 C-N-CA 124.996 1.319 . . . . 10.0 110.452 -179.619 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.416 ' CB ' ' HD2' ' A' ' 9' ' ' LYS . 0.0 OUTLIER -134.1 99.37 4.39 Favored 'General case' 0 C--O 1.24 0.597 0 CA-C-N 113.972 -1.467 . . . . 10.0 107.454 179.852 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -68.07 98.3 0.76 Allowed 'General case' 0 CA--C 1.508 -0.659 0 C-N-CA 117.345 -1.742 . . . . 10.0 107.623 179.888 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 133' ' ' VAL . . . . . 0.501 ' CG1' ' HE3' ' A' ' 9' ' ' LYS . 20.2 m -76.15 -4.26 5.95 Favored 'Isoleucine or valine' 0 C--O 1.241 0.62 0 C-N-CA 118.689 -1.204 . . . . 10.0 112.574 -179.696 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 66.5 t-80 . . . . . 0 C--N 1.325 -0.493 0 O-C-N 125.623 1.827 . . . . 10.0 111.751 179.766 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' ASP . . . . . 0.4 ' O ' ' N ' ' A' ' 5' ' ' ASN . 0.4 OUTLIER . . . . . 0 C--O 1.216 -0.661 0 N-CA-C 110.859 -0.052 . . . . 10.0 110.859 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.468 ' CE1' HD12 ' A' ' 93' ' ' LEU . 43.1 m-85 62.72 -67.11 0.08 Allowed 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 115.968 1.84 . . . . 10.0 115.968 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.4 ' N ' ' O ' ' A' ' 3' ' ' ASP . 0.1 OUTLIER -49.64 149.05 2.58 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.1 0.96 . . . . 10.0 111.854 179.981 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 170.15 -61.9 0.18 Allowed Glycine 0 N--CA 1.438 -1.203 0 O-C-N 125.082 1.489 . . . . 10.0 116.386 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -177.18 -166.65 0.14 Allowed 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 102.805 -3.035 . . . . 10.0 102.805 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.622 ' CZ3' ' HB3' ' A' ' 39' ' ' ASP 0.257 0.5 OUTLIER -153.36 -44.57 0.09 Allowed 'General case' 0 N--CA 1.442 -0.857 0 CA-C-O 116.663 -1.637 . . . . 10.0 115.108 -178.036 . . . . . . . . 4 4 . 1 . 015 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.465 ' HA ' ' CE3' ' A' ' 8' ' ' TRP . 1.3 pttt 12.46 98.94 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.001 1 O-C-N 129.45 4.218 . . . . 10.0 111.859 -177.201 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.72 157.58 17.5 Favored 'General case' 0 N--CA 1.441 -0.878 0 O-C-N 118.087 -2.883 . . . . 10.0 116.058 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.421 ' HA ' HD22 ' A' ' 11' ' ' LEU . 0.2 OUTLIER -111.89 -51.01 2.88 Favored 'General case' 0 C--O 1.245 0.859 0 CA-C-N 112.703 -2.044 . . . . 10.0 107.311 -179.692 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.1 p -146.45 -172.9 4.06 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 115.51 1.67 . . . . 10.0 115.51 179.765 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -169.16 133.84 1.48 Allowed 'General case' 0 C--O 1.22 -0.497 0 O-C-N 126.92 2.638 . . . . 10.0 106.961 -179.621 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -155.39 159.4 39.86 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-O 122.38 1.086 . . . . 10.0 111.497 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.453 ' HB3' ' HA ' ' A' ' 126' ' ' CYS . 0.9 OUTLIER 72.16 5.7 5.37 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 116.103 1.89 . . . . 10.0 116.103 179.983 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -57.58 -23.75 52.48 Favored 'General case' 0 CA--C 1.551 0.991 0 N-CA-C 115.054 1.501 . . . . 10.0 115.054 179.577 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -79.54 -41.54 27.07 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-O 123.979 1.847 . . . . 10.0 110.762 -179.757 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.99 -27.2 63.53 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 122.486 1.136 . . . . 10.0 110.343 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -67.84 -58.11 5.14 Favored 'General case' 0 C--O 1.242 0.706 0 C-N-CA 124.521 1.128 . . . . 10.0 108.951 -179.795 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.444 HD13 ' HB2' ' A' ' 30' ' ' ARG . 0.3 OUTLIER -67.59 -22.49 65.37 Favored 'General case' 0 C--O 1.211 -0.93 0 O-C-N 120.034 -1.666 . . . . 10.0 111.491 179.573 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.7 ttm-85 -75.4 -35.0 61.11 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 106.866 -1.531 . . . . 10.0 106.866 -179.802 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.14 -44.67 91.45 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 127.123 2.764 . . . . 10.0 112.435 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 26.5 mt -78.33 -34.15 48.75 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 125.493 1.517 . . . . 10.0 112.02 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 80.64 48.33 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.108 0 O-C-N 127.011 2.694 . . . . 10.0 113.529 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 27.9 m -82.85 164.46 2.77 Favored 'Isoleucine or valine' 0 C--O 1.242 0.71 0 O-C-N 124.996 1.435 . . . . 10.0 107.141 -179.658 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 9.0 m-20 -36.71 148.37 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.436 0 O-C-N 125.778 1.923 . . . . 10.0 115.213 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -70.63 -35.68 62.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 116.412 2.005 . . . . 10.0 116.412 -179.67 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -72.53 -21.06 61.23 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 123.517 1.627 . . . . 10.0 110.851 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.89 -41.96 77.59 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 119.31 -2.119 . . . . 10.0 111.733 179.632 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.444 ' HB2' HD13 ' A' ' 20' ' ' LEU . 15.8 ttp180 -56.5 -36.41 69.12 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 127.016 2.126 . . . . 10.0 113.51 179.695 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.8 tmtp? -68.53 -38.79 81.14 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 112.855 -1.975 . . . . 10.0 111.234 179.664 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 66.8 mt -75.36 -58.84 3.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 114.035 -1.439 . . . . 10.0 109.94 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -48.98 -31.97 8.35 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 116.335 1.976 . . . . 10.0 116.335 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -65.68 -18.24 65.18 Favored 'General case' 0 CA--C 1.516 -0.332 0 O-C-N 125.084 1.49 . . . . 10.0 110.888 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 53.1 mt -105.96 -7.38 18.17 Favored 'General case' 0 N--CA 1.448 -0.552 0 O-C-N 125.358 1.661 . . . . 10.0 113.44 -179.544 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -96.26 154.69 17.12 Favored 'General case' 0 C--O 1.219 -0.525 0 N-CA-C 114.203 1.186 . . . . 10.0 114.203 179.754 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 3.6 mtmt -139.93 100.32 7.29 Favored Pre-proline 0 C--N 1.327 -0.413 0 N-CA-C 104.717 -2.327 . . . . 10.0 104.717 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_exo -70.02 167.47 24.7 Favored 'Trans proline' 0 C--O 1.24 0.6 1 C-N-CA 125.74 4.293 . . . . 10.0 116.322 -179.711 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.622 ' HB3' ' CZ3' ' A' ' 8' ' ' TRP . 2.9 p30 -124.71 166.72 15.66 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 106.207 -1.775 . . . . 10.0 106.207 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.94 90.04 1.43 Allowed 'General case' 0 N--CA 1.434 -1.254 0 CA-C-O 122.93 1.348 . . . . 10.0 112.848 179.903 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.405 ' HA ' ' CD1' ' A' ' 8' ' ' TRP . 15.4 tt0 -85.72 103.94 14.97 Favored 'General case' 0 N--CA 1.442 -0.859 0 N-CA-C 105.232 -2.136 . . . . 10.0 105.232 179.825 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 10.2 mt -91.28 146.56 6.08 Favored 'Isoleucine or valine' 0 C--O 1.248 0.979 0 CA-C-N 113.691 -1.595 . . . . 10.0 109.384 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -151.44 121.53 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.817 0 CA-C-O 123.875 1.798 . . . . 10.0 109.466 -179.849 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.11 147.42 40.24 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 119.31 -2.119 . . . . 10.0 110.969 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -131.74 73.74 1.55 Allowed 'General case' 0 C--O 1.225 -0.217 0 CA-C-O 124.387 2.041 . . . . 10.0 106.375 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 88.81 -117.1 4.79 Favored Glycine 0 CA--C 1.533 1.189 0 N-CA-C 107.381 -2.288 . . . . 10.0 107.381 179.596 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -91.83 -13.83 30.77 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 118.142 -1.423 . . . . 10.0 108.062 -179.898 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -81.01 138.38 36.04 Favored 'General case' 0 CA--C 1.518 -0.272 0 O-C-N 120.831 -1.168 . . . . 10.0 108.262 179.641 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 3.1 ttt -134.78 142.1 46.61 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.45 1.094 . . . . 10.0 110.923 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 8.8 mt -127.02 124.48 64.61 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.682 0 N-CA-C 106.573 -1.64 . . . . 10.0 106.573 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.438 ' CD1' ' N ' ' A' ' 51' ' ' ILE . 0.3 OUTLIER -106.84 100.17 10.11 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.901 0 N-CA-C 106.939 -1.504 . . . . 10.0 106.939 179.686 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.693 ' HG2' HD12 ' A' ' 61' ' ' ILE . 0.0 OUTLIER -93.58 127.55 39.3 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-O 122.136 0.969 . . . . 10.0 111.107 -179.868 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 57.5 m -106.69 121.43 44.33 Favored 'General case' 0 C--O 1.219 -0.507 0 N-CA-C 102.789 -3.041 . . . . 10.0 102.789 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.42 ' HB2' ' CG ' ' A' ' 39' ' ' ASP . 5.2 mp -104.1 58.05 0.72 Allowed 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 119.57 3.174 . . . . 10.0 119.57 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.8 t -83.36 172.53 12.41 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 104.475 -2.417 . . . . 10.0 104.475 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 9.6 t -106.09 -39.4 5.98 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.874 0.845 . . . . 10.0 109.648 179.873 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 48.1 m-85 -72.38 -21.8 61.23 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 116.949 -1.501 . . . . 10.0 108.12 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.448 ' NE ' HD11 ' A' ' 77' ' ' ILE . 18.7 ptt-85 -151.7 -170.84 3.76 Favored 'General case' 0 C--N 1.328 -0.361 0 O-C-N 126.678 2.486 . . . . 10.0 111.698 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -179.51 82.21 0.01 OUTLIER 'General case' 0 C--O 1.243 0.733 0 CA-C-N 114.479 -1.237 . . . . 10.0 111.257 -179.624 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.413 ' CD1' ' O ' ' A' ' 60' ' ' TYR . 0.1 OUTLIER -93.22 127.84 38.95 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 124.991 2.329 . . . . 10.0 106.797 -179.702 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.693 HD12 ' HG2' ' A' ' 52' ' ' ARG . 17.9 mm -108.67 137.69 39.29 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.818 0 O-C-N 118.201 -2.812 . . . . 10.0 111.001 -179.746 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 20.4 mtm -110.66 162.83 14.36 Favored 'General case' 0 CA--C 1.515 -0.37 0 O-C-N 126.411 2.32 . . . . 10.0 108.983 179.842 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -144.48 78.3 1.57 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 102.126 -3.287 . . . . 10.0 102.126 179.736 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 1.9 m-30 -85.53 125.11 32.82 Favored 'General case' 0 N--CA 1.445 -0.699 0 O-C-N 126.045 2.091 . . . . 10.0 114.657 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 25.8 tt0 -105.72 139.55 40.14 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 111.94 -2.391 . . . . 10.0 105.703 -179.821 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.574 HG21 ' CD1' ' A' ' 88' ' ' TRP . 0.3 OUTLIER -93.85 121.25 44.34 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-O 123.726 1.727 . . . . 10.0 108.67 -179.79 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 97.56 -12.74 64.62 Favored Glycine 0 C--O 1.213 -1.212 0 O-C-N 120.422 -1.423 . . . . 10.0 113.993 179.776 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.77 138.98 41.06 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 115.948 1.832 . . . . 10.0 115.948 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -80.16 135.95 36.4 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-O 122.317 1.056 . . . . 10.0 110.579 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -116.12 167.63 10.82 Favored 'General case' 0 C--O 1.248 1.0 0 CA-C-O 118.256 -0.878 . . . . 10.0 110.263 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 19.8 tt0 -137.44 82.63 1.94 Allowed 'General case' 0 C--N 1.317 -0.828 0 O-C-N 125.89 1.994 . . . . 10.0 108.443 -179.951 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -73.18 133.59 44.1 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 116.677 2.103 . . . . 10.0 116.677 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -104.46 -13.8 15.93 Favored 'General case' 0 C--O 1.221 -0.414 0 N-CA-C 106.372 -1.714 . . . . 10.0 106.372 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.43 HD12 ' HA ' ' A' ' 74' ' ' LEU . 0.9 OUTLIER 61.09 -84.36 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 118.812 -0.613 . . . . 10.0 112.066 -179.984 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 29.4 m 55.05 60.8 3.24 Favored 'General case' 0 C--N 1.32 -0.704 0 O-C-N 126.169 2.168 . . . . 10.0 108.682 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 172.26 137.47 2.35 Favored Glycine 0 N--CA 1.44 -1.056 0 O-C-N 126.886 2.616 . . . . 10.0 108.123 -179.816 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.448 HD11 ' NE ' ' A' ' 58' ' ' ARG . 11.3 mt 72.46 -64.91 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 N-CA-C 104.21 -2.515 . . . . 10.0 104.21 179.902 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -107.52 -80.05 0.57 Allowed 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 117.017 -1.468 . . . . 10.0 112.186 -179.885 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 21.1 p-10 122.39 28.83 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.699 0 O-C-N 128.203 3.439 . . . . 10.0 117.779 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.95 164.48 13.63 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 123.081 1.419 . . . . 10.0 111.096 179.614 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 38.3 mttt -114.74 179.16 4.03 Favored 'General case' 0 CA--C 1.509 -0.606 0 O-C-N 119.72 -1.862 . . . . 10.0 107.805 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 5.6 p 175.79 170.67 0.37 Allowed 'General case' 0 CA--C 1.503 -0.848 0 CA-C-O 123.288 1.518 . . . . 10.0 110.475 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -117.55 108.72 15.83 Favored 'General case' 0 N--CA 1.443 -0.824 0 N-CA-C 100.692 -3.818 . . . . 10.0 100.692 179.629 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 3.0 m -115.1 150.25 36.26 Favored 'General case' 0 CA--C 1.499 -1.019 0 N-CA-C 118.608 2.818 . . . . 10.0 118.608 -179.348 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 2.8 m -142.5 114.4 8.12 Favored 'General case' 0 CA--C 1.5 -0.967 0 CA-C-N 114.249 -1.341 . . . . 10.0 108.613 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 5.6 t -89.22 136.08 24.37 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 N-CA-C 101.591 -3.485 . . . . 10.0 101.591 -179.797 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 46.9 t -134.48 176.24 8.8 Favored 'General case' 0 N--CA 1.444 -0.728 0 O-C-N 124.989 1.43 . . . . 10.0 109.358 -179.772 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' TRP . . . . . 0.574 ' CD1' HG21 ' A' ' 66' ' ' VAL . 0.0 OUTLIER -125.96 92.13 3.53 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 104.495 -2.409 . . . . 10.0 104.495 -179.995 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -87.52 83.56 7.25 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 100.885 -3.746 . . . . 10.0 100.885 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 62.9 -105.62 1.06 Allowed Glycine 0 C--O 1.237 0.3 0 N-CA-C 106.456 -2.658 . . . . 10.0 106.456 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -114.33 60.62 0.67 Allowed 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 114.123 -1.038 . . . . 10.0 112.133 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 7.3 mtmt -158.83 139.08 12.27 Favored 'General case' 0 C--O 1.24 0.595 0 O-C-N 120.441 -1.412 . . . . 10.0 110.191 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.468 HD12 ' CE1' ' A' ' 4' ' ' PHE . 0.2 OUTLIER -95.47 94.58 7.88 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 105.931 -1.877 . . . . 10.0 105.931 179.91 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -104.03 137.81 41.46 Favored 'General case' 0 CA--C 1.506 -0.741 0 O-C-N 126.215 2.197 . . . . 10.0 110.519 179.737 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 19.1 m -142.89 129.16 19.89 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 126.655 2.472 . . . . 10.0 113.678 -179.896 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 96.2 t -116.28 122.98 70.91 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 N-CA-C 105.583 -2.006 . . . . 10.0 105.583 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -105.6 107.72 18.87 Favored 'General case' 0 C--O 1.238 0.452 0 O-C-N 125.783 1.927 . . . . 10.0 107.994 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 40.3 tttt -87.22 120.74 28.82 Favored 'General case' 0 C--O 1.221 -0.419 0 C-N-CA 120.088 -0.645 . . . . 10.0 112.453 179.666 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -143.22 -151.28 5.45 Favored Glycine 0 N--CA 1.447 -0.577 0 CA-C-O 123.252 1.473 . . . . 10.0 110.302 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -81.22 -1.49 45.02 Favored 'General case' 0 C--O 1.243 0.723 0 O-C-N 119.917 -1.931 . . . . 10.0 114.576 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.415 ' HB2' ' HG2' ' A' ' 104' ' ' ARG . 14.2 mttp -93.37 -166.72 1.57 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 124.599 2.142 . . . . 10.0 113.486 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -132.96 30.97 3.94 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 114.015 -1.448 . . . . 10.0 112.074 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 177.51 33.63 0.05 OUTLIER Glycine 0 N--CA 1.443 -0.861 0 CA-C-O 116.835 -2.092 . . . . 10.0 118.118 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.415 ' HG2' ' HB2' ' A' ' 101' ' ' LYS . 0.0 OUTLIER -95.37 135.86 36.46 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 119.168 1.484 . . . . 10.0 109.304 179.732 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 148.17 148.16 4.69 Favored Glycine 0 N--CA 1.446 -0.686 0 N-CA-C 109.25 -1.54 . . . . 10.0 109.25 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -116.03 -178.67 3.46 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 117.538 0.669 . . . . 10.0 110.057 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.1 m -158.49 126.92 5.35 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 105.068 -2.197 . . . . 10.0 105.068 179.763 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.658 ' CD ' HD21 ' A' ' 115' ' ' LEU . 0.8 OUTLIER -110.35 127.97 55.33 Favored 'General case' 0 C--O 1.219 -0.503 0 O-C-N 125.908 2.005 . . . . 10.0 110.306 -179.839 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 1.6 t-105 -135.54 146.39 48.0 Favored 'General case' 0 C--O 1.214 -0.801 0 N-CA-C 107.465 -1.309 . . . . 10.0 107.465 -179.847 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 17.7 mt -113.81 116.89 53.92 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 N-CA-C 117.662 2.468 . . . . 10.0 117.662 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -81.72 179.17 7.94 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 112.595 -2.093 . . . . 10.0 106.321 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -52.51 99.57 0.04 OUTLIER Glycine 0 C--O 1.221 -0.715 0 N-CA-C 108.375 -1.89 . . . . 10.0 108.375 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 53.75 30.64 11.52 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 123.62 1.676 . . . . 10.0 112.848 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -146.77 109.96 4.76 Favored 'General case' 0 CA--C 1.502 -0.894 0 CA-C-O 124.925 2.297 . . . . 10.0 113.409 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.658 HD21 ' CD ' ' A' ' 108' ' ' GLN . 2.6 tm? -74.92 131.19 40.51 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 104.315 -2.476 . . . . 10.0 104.315 -179.849 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 9.3 t-160 -128.41 91.11 3.18 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 107.725 -1.213 . . . . 10.0 107.725 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.612 ' C ' HD23 ' A' ' 117' ' ' LEU . 6.5 tt -95.19 142.77 27.24 Favored 'General case' 0 N--CA 1.44 -0.953 0 O-C-N 124.759 1.287 . . . . 10.0 111.498 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.574 ' N ' HD23 ' A' ' 117' ' ' LEU . 16.2 pm0 -128.56 133.91 48.5 Favored 'General case' 0 C--O 1.216 -0.708 0 N-CA-C 108.011 -1.107 . . . . 10.0 108.011 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 48.1 mtt -112.62 162.02 16.16 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-O 123.366 1.555 . . . . 10.0 108.164 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 2.7 mtm180 -158.65 148.5 19.47 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 113.952 -1.476 . . . . 10.0 109.49 179.84 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 121' ' ' ALA . . . . . 0.635 ' O ' HG22 ' A' ' 124' ' ' VAL . . . -171.17 122.34 0.56 Allowed 'General case' 0 CA--C 1.504 -0.801 0 O-C-N 123.588 0.555 . . . . 10.0 109.766 179.595 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 61.34 31.6 19.25 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 126.306 1.843 . . . . 10.0 114.486 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 97.9 -15.38 61.77 Favored Glycine 0 CA--C 1.536 1.404 0 CA-C-O 117.032 -1.982 . . . . 10.0 116.792 -179.702 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.635 HG22 ' O ' ' A' ' 121' ' ' ALA . 19.8 m -94.73 -179.78 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 CA-C-N 119.171 1.485 . . . . 10.0 111.003 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 1.1 m -149.93 133.89 16.99 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 122.19 0.995 . . . . 10.0 113.213 179.819 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 126' ' ' CYS . . . . . 0.453 ' HA ' ' HB3' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -123.12 142.39 50.93 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 105.126 -2.176 . . . . 10.0 105.126 179.911 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.26 145.86 36.09 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 114.176 1.176 . . . . 10.0 114.176 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.09 109.19 10.29 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 113.951 -1.477 . . . . 10.0 111.984 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 84.8 t -72.27 123.06 26.04 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 N-CA-C 105.142 -2.17 . . . . 10.0 105.142 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 130' ' ' PHE . . . . . 0.441 ' HB2' HD12 ' A' ' 115' ' ' LEU . 2.7 m-85 -103.25 161.97 13.37 Favored 'General case' 0 C--N 1.316 -0.866 0 C-N-CA 124.685 1.194 . . . . 10.0 108.73 -179.656 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -137.61 102.71 4.83 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 122.449 1.118 . . . . 10.0 108.217 -179.734 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.27 128.22 35.47 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-O 122.155 0.979 . . . . 10.0 110.253 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 1.3 t -101.38 -21.65 5.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 C-N-CA 124.641 1.176 . . . . 10.0 109.486 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 54.7 t60 . . . . . 0 C--O 1.251 1.164 0 O-C-N 124.746 1.279 . . . . 10.0 114.11 -179.985 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.24 0.571 0 CA-C-O 118.981 -0.533 . . . . 10.0 111.033 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -98.19 -20.77 17.09 Favored 'General case' 0 C--O 1.24 0.602 0 N-CA-C 115.687 1.736 . . . . 10.0 115.687 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -56.3 116.77 3.25 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 117.061 -1.447 . . . . 10.0 112.03 -179.816 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -132.22 -158.78 9.09 Favored Glycine 0 CA--C 1.534 1.227 0 CA-C-O 123.193 1.441 . . . . 10.0 115.681 -179.842 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.692 ' O ' HG12 ' A' ' 133' ' ' VAL . 0.3 OUTLIER -160.57 82.76 0.68 Allowed 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 100.377 -3.934 . . . . 10.0 100.377 179.97 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.649 ' CG ' ' N ' ' A' ' 9' ' ' LYS 0.284 0.2 OUTLIER -61.32 -160.09 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 127.106 2.163 . . . . 10.0 111.941 -179.706 . . . . . . . . 4 4 . 1 . 016 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.649 ' N ' ' CG ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER 153.09 74.4 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.611 0 O-C-N 126.295 2.247 . . . . 10.0 106.174 176.539 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 27.9 ttm -36.26 139.89 0.15 Allowed 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 112.179 -2.282 . . . . 10.0 115.379 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.3 tp -95.09 -38.66 10.52 Favored 'General case' 0 C--N 1.317 -0.832 0 O-C-N 126.708 2.505 . . . . 10.0 106.424 -179.776 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -178.22 162.0 1.51 Allowed 'General case' 0 C--N 1.345 0.412 0 CA-C-O 123.528 1.632 . . . . 10.0 112.977 179.776 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -121.04 165.79 14.79 Favored 'General case' 0 CA--C 1.51 -0.569 0 CA-C-N 112.651 -2.068 . . . . 10.0 106.326 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -157.91 129.89 6.97 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.823 -0.626 . . . . 10.0 111.046 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 69.73 44.1 0.9 Allowed 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 125.443 1.497 . . . . 10.0 113.469 -179.813 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -76.92 -39.92 49.09 Favored 'General case' 0 CA--C 1.55 0.96 0 O-C-N 125.453 1.721 . . . . 10.0 109.231 179.771 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -71.14 -36.89 72.25 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 114.306 -1.315 . . . . 10.0 112.118 179.904 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.602 ' HB3' HG11 ' A' ' 124' ' ' VAL . 3.2 mt-10 -70.29 -33.18 71.26 Favored 'General case' 0 N--CA 1.442 -0.865 0 O-C-N 125.588 1.805 . . . . 10.0 108.948 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.424 ' O ' ' HB3' ' A' ' 22' ' ' ALA . 1.1 t80 -71.97 -38.22 69.77 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 113.758 -1.565 . . . . 10.0 110.439 179.851 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 80.4 mt -71.59 -25.8 62.34 Favored 'General case' 0 C--O 1.213 -0.832 0 O-C-N 121.645 -0.659 . . . . 10.0 110.583 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.26 -29.29 60.12 Favored 'General case' 0 C--O 1.243 0.714 0 CA-C-O 123.143 1.449 . . . . 10.0 107.775 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.424 ' HB3' ' O ' ' A' ' 19' ' ' TYR . . . -62.36 -28.41 69.74 Favored 'General case' 0 C--O 1.212 -0.872 0 C-N-CA 125.463 1.505 . . . . 10.0 112.722 179.725 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 22.3 mt -104.92 -6.19 20.36 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.631 1.172 . . . . 10.0 111.124 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 42.9 m-20 48.71 58.97 4.72 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 125.897 1.679 . . . . 10.0 114.177 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 26.2 m -93.39 161.29 2.58 Favored 'Isoleucine or valine' 0 C--O 1.243 0.754 0 N-CA-C 106.555 -1.646 . . . . 10.0 106.555 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -41.59 142.15 0.66 Allowed 'General case' 0 CA--C 1.544 0.745 0 CA-C-O 123.817 1.77 . . . . 10.0 113.452 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 52.9 t -67.07 -26.26 36.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 N-CA-C 115.875 1.805 . . . . 10.0 115.875 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.546 ' O ' HD13 ' A' ' 32' ' ' ILE . . . -73.89 -26.9 60.79 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 119.673 -0.811 . . . . 10.0 111.697 179.881 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.8 -44.3 73.86 Favored 'General case' 0 C--N 1.317 -0.813 0 O-C-N 125.774 1.921 . . . . 10.0 114.646 179.743 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.07 -31.28 69.92 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-O 123.864 1.792 . . . . 10.0 112.065 -179.49 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 14.8 mttt -77.3 -33.64 55.65 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 113.465 -1.698 . . . . 10.0 110.86 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.546 HD13 ' O ' ' A' ' 28' ' ' ALA . 1.4 mp -77.26 -39.77 28.78 Favored 'Isoleucine or valine' 0 C--O 1.243 0.759 0 CA-C-N 114.922 -1.036 . . . . 10.0 111.032 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -81.5 -19.35 42.44 Favored 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 116.069 1.877 . . . . 10.0 116.069 -179.711 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 -76.37 -14.86 60.06 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 122.551 1.167 . . . . 10.0 110.63 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.413 ' HA ' HD23 ' A' ' 35' ' ' LEU . 14.6 mt -83.21 -9.67 59.02 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 123.793 0.837 . . . . 10.0 113.066 -179.64 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 21.0 mt -116.52 165.38 13.3 Favored 'General case' 0 CA--C 1.507 -0.675 0 CA-C-O 122.588 1.185 . . . . 10.0 109.066 -179.788 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.53 99.17 8.71 Favored Pre-proline 0 N--CA 1.481 1.099 0 N-CA-C 103.163 -2.902 . . . . 10.0 103.163 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_exo -51.16 -174.95 0.01 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.382 0 C-N-CA 124.693 3.596 . . . . 10.0 115.521 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.5 ' HB2' ' CZ2' ' A' ' 8' ' ' TRP . 0.5 OUTLIER -139.54 -174.77 3.98 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-N 113.096 -1.866 . . . . 10.0 108.222 -179.929 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.7 mttm -173.63 122.79 0.35 Allowed 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 119.109 0.868 . . . . 10.0 111.01 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -121.19 121.0 36.82 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 119.82 1.191 . . . . 10.0 108.424 179.388 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 2.4 mt -97.07 142.01 14.78 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.923 0 O-C-N 124.861 1.351 . . . . 10.0 111.223 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 56.1 t -147.28 138.14 17.73 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.998 0 N-CA-C 104.964 -2.235 . . . . 10.0 104.964 -179.918 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -143.29 126.08 16.1 Favored 'General case' 0 C--O 1.211 -0.93 0 N-CA-C 106.058 -1.83 . . . . 10.0 106.058 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -104.24 23.87 12.4 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-O 122.965 1.364 . . . . 10.0 107.568 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 87.83 106.27 0.94 Allowed Glycine 0 C--N 1.336 0.539 0 N-CA-C 110.138 -1.185 . . . . 10.0 110.138 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 57.27 31.58 20.33 Favored 'General case' 0 C--N 1.321 -0.654 0 O-C-N 124.829 0.958 . . . . 10.0 110.088 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -162.36 92.99 0.84 Allowed 'General case' 0 C--O 1.213 -0.818 0 N-CA-C 103.189 -2.893 . . . . 10.0 103.189 179.832 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.496 ' SD ' HD11 ' A' ' 51' ' ' ILE . 4.9 ttm -105.34 142.64 34.74 Favored 'General case' 0 C--N 1.316 -0.875 0 O-C-N 126.389 2.306 . . . . 10.0 116.588 -179.592 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 6.0 mm -128.28 130.91 69.5 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.732 0 N-CA-C 106.273 -1.751 . . . . 10.0 106.273 -179.751 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.496 HD11 ' SD ' ' A' ' 49' ' ' MET . 1.3 mp -121.58 113.61 39.89 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.07 0 O-C-N 126.87 2.607 . . . . 10.0 106.059 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.8 mtp180 -111.61 98.75 7.65 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 113.924 1.083 . . . . 10.0 113.924 -179.799 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 32.4 m -96.25 89.3 5.06 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 104.736 -2.32 . . . . 10.0 104.736 -179.814 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.73 44.43 0.01 OUTLIER 'General case' 0 C--N 1.315 -0.905 1 N-CA-C 122.824 4.379 . . . . 10.0 122.824 -179.709 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 36.1 t -64.95 138.56 58.44 Favored 'General case' 0 C--O 1.242 0.695 0 N-CA-C 103.622 -2.733 . . . . 10.0 103.622 -179.735 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 15.9 p -87.39 -37.27 17.21 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 121.389 1.904 . . . . 10.0 108.401 179.789 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 22.0 t80 -53.46 -35.81 60.92 Favored 'General case' 0 C--O 1.242 0.688 0 O-C-N 125.979 2.049 . . . . 10.0 110.076 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -174.82 90.04 0.06 Allowed 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 115.577 -0.738 . . . . 10.0 112.243 -179.845 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -46.16 144.58 1.91 Allowed 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.61 1.194 . . . . 10.0 113.554 179.775 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -122.72 89.19 3.07 Favored 'General case' 0 CA--C 1.503 -0.859 0 N-CA-C 103.236 -2.876 . . . . 10.0 103.236 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 19.7 mm -90.13 128.38 42.1 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 O-C-N 120.217 -1.552 . . . . 10.0 110.943 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 1.7 mtm -125.65 142.6 51.43 Favored 'General case' 0 C--N 1.341 0.226 0 N-CA-C 105.303 -2.11 . . . . 10.0 105.303 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -140.95 96.56 3.02 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 100.73 -3.804 . . . . 10.0 100.73 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 1.5 m-30 -110.86 167.27 10.36 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 117.623 2.453 . . . . 10.0 117.623 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -126.68 99.9 5.98 Favored 'General case' 0 C--O 1.241 0.624 0 CA-C-N 111.389 -2.642 . . . . 10.0 104.223 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 33.3 t -43.8 112.4 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 CA-C-N 114.225 -1.352 . . . . 10.0 112.424 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.99 30.9 60.55 Favored Glycine 0 CA--C 1.528 0.901 0 O-C-N 126.63 2.456 . . . . 10.0 115.758 -179.887 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.6 tmmm? -107.79 2.38 23.56 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 115.783 1.772 . . . . 10.0 115.783 -179.693 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 59.6 tt0 61.84 138.04 0.01 OUTLIER 'General case' 0 C--N 1.311 -1.074 0 O-C-N 128.354 3.534 . . . . 10.0 113.526 179.505 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 56.4 m-85 -141.26 143.89 34.37 Favored 'General case' 0 C--N 1.319 -0.721 0 O-C-N 121.046 -1.034 . . . . 10.0 110.47 -179.776 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -109.93 90.33 3.28 Favored 'General case' 0 C--N 1.321 -0.638 0 O-C-N 126.057 2.098 . . . . 10.0 110.23 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -78.89 134.98 36.87 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 113.982 -1.463 . . . . 10.0 114.672 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -129.82 95.23 3.91 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 106.205 -1.776 . . . . 10.0 106.205 179.779 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.406 ' HB3' ' HA ' ' A' ' 79' ' ' ASP . 1.0 OUTLIER -68.56 -167.23 0.09 Allowed 'General case' 0 C--N 1.322 -0.607 0 O-C-N 125.0 1.438 . . . . 10.0 112.718 -179.98 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -158.61 -70.55 0.09 Allowed 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 107.809 -1.182 . . . . 10.0 107.809 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -92.28 -173.41 41.88 Favored Glycine 0 N--CA 1.434 -1.448 0 O-C-N 126.965 2.666 . . . . 10.0 111.579 -179.796 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 78.5 mt 75.03 -92.03 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 O-C-N 126.225 1.779 . . . . 10.0 107.704 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -115.7 -48.58 2.76 Favored 'General case' 0 C--N 1.318 -0.775 0 C-N-CA 124.287 1.035 . . . . 10.0 109.967 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.406 ' HA ' ' HB3' ' A' ' 74' ' ' LEU . 0.0 OUTLIER 75.9 128.25 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 118.171 2.656 . . . . 10.0 118.171 179.785 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 6.4 ttm105 -177.81 144.49 0.36 Allowed 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 114.544 -1.207 . . . . 10.0 110.742 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 1.8 mtpp -96.18 148.78 22.35 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 104.327 -2.472 . . . . 10.0 104.327 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 1.8 p -168.23 168.72 11.39 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 107.224 -1.399 . . . . 10.0 107.224 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 7.0 mtt -115.29 92.12 3.82 Favored 'General case' 0 C--O 1.245 0.818 0 N-CA-C 102.051 -3.314 . . . . 10.0 102.051 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.2 m -88.37 115.57 25.96 Favored 'General case' 0 CA--C 1.504 -0.814 0 O-C-N 119.498 -2.001 . . . . 10.0 113.38 179.825 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 11.2 m -119.8 111.35 17.88 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-N 114.594 -1.184 . . . . 10.0 108.857 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 1.3 t -84.79 119.86 34.36 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 N-CA-C 101.296 -3.594 . . . . 10.0 101.296 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.4 p -145.03 141.93 29.32 Favored 'General case' 0 C--O 1.217 -0.621 0 CA-C-O 124.407 2.051 . . . . 10.0 114.82 -179.496 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -72.39 137.96 46.89 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 113.368 -1.742 . . . . 10.0 109.488 179.339 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.436 ' CB ' HE22 ' A' ' 94' ' ' GLN . 8.6 t0 -97.94 8.94 43.93 Favored 'General case' 0 CA--C 1.506 -0.716 0 N-CA-C 103.401 -2.815 . . . . 10.0 103.401 179.854 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 129.66 -29.8 3.72 Favored Glycine 0 CA--C 1.497 -1.062 0 N-CA-C 103.392 -3.883 . . . . 10.0 103.392 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -157.6 -51.28 0.07 Allowed 'General case' 0 C--O 1.24 0.563 0 CA-C-N 118.011 0.906 . . . . 10.0 109.857 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -61.39 160.92 10.04 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-O 117.396 -1.288 . . . . 10.0 110.442 -179.915 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 49.0 tp -104.26 116.06 31.51 Favored 'General case' 0 N--CA 1.442 -0.851 0 N-CA-C 104.757 -2.312 . . . . 10.0 104.757 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' GLN . . . . . 0.436 HE22 ' CB ' ' A' ' 89' ' ' ASP . 10.4 mp0 -124.45 142.52 51.25 Favored 'General case' 0 CA--C 1.501 -0.942 0 N-CA-C 115.799 1.777 . . . . 10.0 115.799 -179.753 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -134.81 157.69 46.12 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 116.851 -1.547 . . . . 10.0 107.653 179.849 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 8.3 t -130.56 -67.1 0.58 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.755 0 C-N-CA 118.329 -1.348 . . . . 10.0 110.924 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 72.86 116.18 0.05 Allowed 'General case' 0 C--O 1.245 0.849 0 N-CA-C 105.506 -2.035 . . . . 10.0 105.506 -179.504 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 5.2 ptpp? -107.47 170.74 7.79 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 114.88 1.437 . . . . 10.0 114.88 -179.527 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 176.86 -124.14 0.94 Allowed Glycine 0 N--CA 1.447 -0.568 0 O-C-N 124.723 1.264 . . . . 10.0 110.653 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -130.31 22.07 5.21 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 114.977 1.473 . . . . 10.0 114.977 179.882 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -110.7 177.2 4.75 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 116.084 1.883 . . . . 10.0 116.084 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -90.9 120.6 32.05 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 128.625 2.77 . . . . 10.0 108.959 179.651 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 86.49 -97.49 2.24 Favored Glycine 0 C--O 1.22 -0.72 0 O-C-N 119.808 -1.807 . . . . 10.0 115.214 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 21.3 mtm-85 59.82 165.76 0.06 Allowed 'General case' 0 N--CA 1.441 -0.876 0 N-CA-C 114.896 1.443 . . . . 10.0 114.896 -179.699 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 74.43 166.52 15.59 Favored Glycine 0 N--CA 1.444 -0.792 0 CA-C-N 112.036 -2.347 . . . . 10.0 112.903 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -112.46 -173.81 2.33 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 124.565 1.146 . . . . 10.0 109.757 -179.793 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 55.9 m -162.35 123.34 2.57 Favored 'General case' 0 C--O 1.214 -0.814 0 CA-C-O 118.304 -0.855 . . . . 10.0 110.259 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 10.0 mt-30 -120.17 124.9 46.87 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 118.258 -0.877 . . . . 10.0 112.462 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -134.15 164.64 26.9 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 106.519 -1.66 . . . . 10.0 106.519 179.704 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 37.5 mt -129.28 136.21 59.99 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 N-CA-C 116.282 1.956 . . . . 10.0 116.282 -179.822 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -109.24 -162.17 0.8 Allowed 'General case' 0 CA--C 1.522 -0.117 0 C-N-CA 125.869 1.668 . . . . 10.0 107.356 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -77.48 103.11 1.8 Allowed Glycine 0 CA--C 1.528 0.868 0 O-C-N 125.741 1.901 . . . . 10.0 108.833 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 9.6 t70 50.07 17.41 0.3 Allowed 'General case' 0 C--N 1.324 -0.504 0 O-C-N 127.151 2.324 . . . . 10.0 111.812 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -137.28 88.8 2.38 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 120.5 1.5 . . . . 10.0 110.716 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.795 HD12 ' N ' ' A' ' 116' ' ' HIS . 0.9 OUTLIER -60.48 134.06 56.7 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 105.198 -2.149 . . . . 10.0 105.198 -179.946 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 116' ' ' HIS . . . . . 0.795 ' N ' HD12 ' A' ' 115' ' ' LEU . 3.6 t60 -119.2 99.05 6.47 Favored 'General case' 0 C--O 1.213 -0.859 0 O-C-N 118.96 -2.337 . . . . 10.0 109.156 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.29 149.15 21.99 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 114.449 -1.25 . . . . 10.0 111.197 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -146.01 128.56 16.05 Favored 'General case' 0 CA--C 1.505 -0.757 0 O-C-N 125.205 1.566 . . . . 10.0 108.621 179.716 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -113.51 125.73 54.53 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 114.117 -1.402 . . . . 10.0 108.026 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.416 ' HD3' ' N ' ' A' ' 120' ' ' ARG . 0.0 OUTLIER -121.43 160.8 23.38 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-O 125.584 2.611 . . . . 10.0 115.534 -179.943 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -179.03 137.49 0.14 Allowed 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 112.698 -2.046 . . . . 10.0 110.579 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 46.85 31.54 1.5 Allowed 'General case' 0 C--O 1.246 0.896 0 CA-C-N 113.596 -1.638 . . . . 10.0 114.5 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 93.61 -15.38 63.17 Favored Glycine 0 N--CA 1.444 -0.78 0 C-N-CA 124.36 0.981 . . . . 10.0 115.533 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.602 HG11 ' HB3' ' A' ' 18' ' ' GLU . 3.0 t -94.04 131.32 41.27 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 CA-C-N 119.589 1.695 . . . . 10.0 109.983 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 36.4 m -115.43 118.84 34.34 Favored 'General case' 0 N--CA 1.445 -0.709 0 O-C-N 125.991 2.057 . . . . 10.0 113.21 179.457 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -99.58 155.02 17.81 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 105.195 -2.15 . . . . 10.0 105.195 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 25.0 mtmt -145.54 159.29 43.32 Favored 'General case' 0 CA--C 1.507 -0.677 0 O-C-N 120.999 -1.063 . . . . 10.0 110.88 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -140.19 125.36 18.68 Favored 'General case' 0 C--N 1.321 -0.636 0 O-C-N 125.45 1.719 . . . . 10.0 108.235 -179.67 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 2.5 t -85.66 108.31 17.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 N-CA-C 105.873 -1.899 . . . . 10.0 105.873 179.561 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 130' ' ' PHE . . . . . 0.422 ' HB2' ' HB3' ' A' ' 115' ' ' LEU . 3.9 m-85 -86.06 151.98 23.26 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 115.631 -0.713 . . . . 10.0 110.781 -179.741 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 17.6 tptt -130.31 85.72 2.32 Favored 'General case' 0 C--N 1.321 -0.651 0 O-C-N 126.854 2.596 . . . . 10.0 108.991 -179.768 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.47 104.54 0.13 Allowed 'General case' 0 C--O 1.235 0.341 0 O-C-N 125.723 1.889 . . . . 10.0 109.837 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 133' ' ' VAL . . . . . 0.692 HG12 ' O ' ' A' ' 7' ' ' TYR . 1.4 p -73.88 -24.67 19.76 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.492 0 C-N-CA 118.593 -1.243 . . . . 10.0 110.662 179.599 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 35.1 t-80 . . . . . 0 N--CA 1.441 -0.913 0 CA-C-O 115.871 -2.014 . . . . 10.0 110.814 -179.853 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.443 -0.793 0 N-CA-C 112.742 0.645 . . . . 10.0 112.742 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 62.8 -73.2 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 O-C-N 125.469 1.73 . . . . 10.0 111.99 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -35.32 111.17 0.12 Allowed 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.457 1.503 . . . . 10.0 113.04 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -157.23 -140.7 3.0 Favored Glycine 0 N--CA 1.445 -0.7 0 C-N-CA 118.861 -1.638 . . . . 10.0 114.069 179.56 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 93.1 m-85 -160.36 65.8 0.33 Allowed 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 104.499 -2.408 . . . . 10.0 104.499 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.589 ' CD2' ' CD1' ' A' ' 115' ' ' LEU . 8.5 m0 -68.03 105.95 2.2 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 118.34 -1.344 . . . . 10.0 108.464 179.715 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.403 ' HG2' ' HB ' ' A' ' 133' ' ' VAL . 4.5 pttp -81.93 12.27 4.25 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 117.196 -1.383 . . . . 10.0 110.666 -179.763 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.477 ' HG2' ' N ' ' A' ' 11' ' ' LEU . 0.0 OUTLIER 62.94 140.26 0.02 OUTLIER 'General case' 0 C--N 1.311 -1.084 0 CA-C-O 124.199 1.952 . . . . 10.0 116.15 179.58 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.574 HD12 ' HB2' ' A' ' 131' ' ' LYS . 4.1 tt -108.83 -50.15 3.05 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 120.306 -1.496 . . . . 10.0 108.967 -179.847 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -174.15 157.6 2.87 Favored 'General case' 0 C--O 1.241 0.632 0 C-N-CA 119.544 -0.863 . . . . 10.0 112.773 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -116.2 161.0 19.61 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 127.205 2.202 . . . . 10.0 107.402 -179.711 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 -123.39 -89.39 0.59 Allowed 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 114.218 1.192 . . . . 10.0 114.218 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -80.61 46.82 0.89 Allowed 'General case' 0 N--CA 1.469 0.512 0 O-C-N 124.572 1.17 . . . . 10.0 113.271 -179.701 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -66.36 -36.76 83.69 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 113.85 1.056 . . . . 10.0 113.85 179.555 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -76.55 -32.93 58.5 Favored 'General case' 0 CA--C 1.515 -0.397 0 O-C-N 118.783 -2.448 . . . . 10.0 111.423 179.81 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -79.61 -24.74 41.76 Favored 'General case' 0 C--O 1.219 -0.502 0 N-CA-C 107.165 -1.421 . . . . 10.0 107.165 179.796 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.575 ' HA ' HG11 ' A' ' 124' ' ' VAL . 42.4 t80 -68.16 -41.12 82.0 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-O 117.44 -1.267 . . . . 10.0 110.848 -179.82 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.421 HD12 ' HG2' ' A' ' 30' ' ' ARG . 84.5 mt -78.35 -21.89 48.8 Favored 'General case' 0 C--O 1.214 -0.769 0 CA-C-O 123.69 1.71 . . . . 10.0 112.747 -179.909 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.411 ' CZ ' ' HA ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -66.25 -42.61 88.31 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 113.66 -1.609 . . . . 10.0 108.415 -179.774 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.57 -21.54 65.43 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 126.17 1.788 . . . . 10.0 110.795 -179.861 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.512 HD21 ' NH2' ' A' ' 104' ' ' ARG . 35.3 mt -95.78 -9.55 31.39 Favored 'General case' 0 C--O 1.241 0.622 0 C-N-CA 124.746 1.218 . . . . 10.0 108.981 179.79 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 62.59 38.57 12.21 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-O 116.697 -1.62 . . . . 10.0 112.086 179.866 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.935 HG11 HD22 ' A' ' 29' ' ' LEU . 2.1 t -91.18 154.33 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.82 0 N-CA-C 107.421 -1.326 . . . . 10.0 107.421 179.547 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.26 0.0 OUTLIER -58.08 163.17 2.96 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 127.071 2.732 . . . . 10.0 116.948 -179.687 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 68.9 t -71.97 -26.32 25.21 Favored 'Isoleucine or valine' 0 C--O 1.236 0.372 0 N-CA-C 113.964 1.098 . . . . 10.0 113.964 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.88 -38.16 76.29 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 123.615 0.766 . . . . 10.0 111.105 179.394 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.935 HD22 HG11 ' A' ' 25' ' ' VAL . 8.1 tt -79.32 -24.17 42.98 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 122.373 1.082 . . . . 10.0 108.562 179.448 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.421 ' HG2' HD12 ' A' ' 20' ' ' LEU . 0.2 OUTLIER -78.78 -41.92 29.27 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 114.837 -1.074 . . . . 10.0 108.881 179.787 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.4 tttt -63.76 -48.31 77.49 Favored 'General case' 0 N--CA 1.442 -0.865 0 C-N-CA 125.135 1.374 . . . . 10.0 113.504 -179.524 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 11.8 mm -72.37 -38.06 59.85 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.575 0 O-C-N 119.707 -1.871 . . . . 10.0 113.783 -179.872 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -68.15 -37.52 81.14 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 115.835 1.791 . . . . 10.0 115.835 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -57.98 -31.38 66.86 Favored 'General case' 0 C--O 1.216 -0.71 0 N-CA-C 115.075 1.509 . . . . 10.0 115.075 -179.806 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 40.4 mt -81.31 -25.32 36.56 Favored 'General case' 0 C--O 1.217 -0.647 0 CA-C-O 122.172 0.987 . . . . 10.0 113.553 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 11.6 mt -96.58 157.79 15.74 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.572 -0.74 . . . . 10.0 112.866 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 30.1 mttm -145.74 146.02 27.58 Favored Pre-proline 0 N--CA 1.48 1.039 0 N-CA-C 102.422 -3.177 . . . . 10.0 102.422 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 0.1 OUTLIER -100.46 -172.24 0.11 Allowed 'Trans proline' 0 CA--C 1.543 0.952 0 C-N-CA 122.636 2.224 . . . . 10.0 117.427 -179.785 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -142.96 136.69 28.78 Favored 'General case' 0 C--N 1.315 -0.921 0 O-C-N 127.54 3.025 . . . . 10.0 104.329 179.57 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.518 ' HB2' ' CE2' ' A' ' 130' ' ' PHE . 0.1 OUTLIER -119.58 112.13 18.95 Favored 'General case' 0 N--CA 1.438 -1.051 0 C-N-CA 119.417 -0.913 . . . . 10.0 112.503 -179.933 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -105.4 132.04 52.08 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 102.162 -3.273 . . . . 10.0 102.162 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.527 HG13 ' CH2' ' A' ' 8' ' ' TRP . 0.9 OUTLIER -115.01 161.97 13.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 118.554 0.616 . . . . 10.0 110.274 -179.918 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.607 HG12 HD12 ' A' ' 50' ' ' ILE . 2.6 t -144.5 123.17 6.33 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.854 0 N-CA-C 105.412 -2.07 . . . . 10.0 105.412 179.958 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 12.0 tt0 -119.9 104.2 9.98 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 122.739 1.257 . . . . 10.0 111.584 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -99.69 86.16 3.27 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 104.498 -2.408 . . . . 10.0 104.498 -179.85 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 70.03 -112.41 4.37 Favored Glycine 0 C--N 1.34 0.803 0 N-CA-C 106.684 -2.566 . . . . 10.0 106.684 -179.684 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -107.17 -12.35 15.41 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 119.811 -0.756 . . . . 10.0 110.154 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 13.2 m170 -74.42 109.48 7.93 Favored 'General case' 0 N--CA 1.445 -0.723 0 O-C-N 120.88 -1.137 . . . . 10.0 109.043 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.539 ' HG2' HD13 ' A' ' 51' ' ' ILE . 2.8 ttt -87.84 140.02 29.93 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 114.395 1.257 . . . . 10.0 114.395 -179.876 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.607 HD12 HG12 ' A' ' 43' ' ' VAL . 6.9 mt -134.99 110.8 12.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 N-CA-C 102.913 -2.995 . . . . 10.0 102.913 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.539 HD13 ' HG2' ' A' ' 49' ' ' MET . 0.3 OUTLIER -100.69 132.96 45.37 Favored 'Isoleucine or valine' 0 C--O 1.241 0.612 0 N-CA-C 106.472 -1.677 . . . . 10.0 106.472 179.98 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.427 ' CZ ' ' HB3' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -135.16 88.44 2.42 Favored 'General case' 0 N--CA 1.438 -1.025 0 O-C-N 125.377 1.673 . . . . 10.0 110.426 179.695 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 24.3 m -80.2 112.75 17.82 Favored 'General case' 0 C--N 1.318 -0.78 1 N-CA-C 99.913 -4.106 . . . . 10.0 99.913 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.1 mt -78.85 61.91 3.2 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 117.317 2.34 . . . . 10.0 117.317 -179.863 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.7 m -90.61 84.6 5.93 Favored 'General case' 0 C--O 1.242 0.698 0 CA-C-N 112.143 -2.299 . . . . 10.0 106.044 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -66.36 111.03 3.31 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 106.248 -1.76 . . . . 10.0 106.248 179.814 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 68.8 t80 153.89 -62.34 0.0 OUTLIER 'General case' 0 C--O 1.241 0.646 0 O-C-N 128.06 3.35 . . . . 10.0 105.14 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 10.2 tpp180 -152.52 75.52 1.11 Allowed 'General case' 0 N--CA 1.444 -0.727 0 O-C-N 125.195 1.559 . . . . 10.0 110.072 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -63.13 177.84 0.56 Allowed 'General case' 0 CA--C 1.541 0.606 0 O-C-N 126.162 2.163 . . . . 10.0 114.053 -179.759 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 49.6 m-85 -102.25 -132.76 0.29 Allowed 'General case' 0 C--N 1.308 -1.196 0 O-C-N 128.613 3.696 . . . . 10.0 101.24 179.349 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 6.7 mt 108.56 122.33 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.3 -1.561 0 O-C-N 128.48 3.612 . . . . 10.0 111.306 179.548 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' MET . . . . . 0.409 ' CE ' ' HG2' ' A' ' 72' ' ' GLU . 4.6 mmt -150.69 170.07 20.09 Favored 'General case' 0 CA--C 1.532 0.275 0 O-C-N 127.555 3.034 . . . . 10.0 104.376 -179.567 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -134.62 63.85 1.61 Allowed 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 101.459 -3.534 . . . . 10.0 101.459 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.403 ' O ' ' N ' ' A' ' 49' ' ' MET . 1.5 m-30 -65.11 165.68 10.82 Favored 'General case' 0 C--N 1.342 0.256 0 N-CA-C 116.908 2.188 . . . . 10.0 116.908 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 63.3 mt-30 -136.06 125.01 24.18 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 106.208 -1.775 . . . . 10.0 106.208 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.458 ' HA ' ' CG1' ' A' ' 86' ' ' VAL . 0.9 OUTLIER -69.41 134.9 29.38 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 CA-C-O 123.092 1.425 . . . . 10.0 112.291 -179.644 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.58 -16.33 41.16 Favored Glycine 0 N--CA 1.439 -1.135 0 O-C-N 120.002 -1.686 . . . . 10.0 114.307 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 4.1 mttp -91.42 132.33 36.29 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 122.433 1.111 . . . . 10.0 111.815 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -74.55 125.26 28.24 Favored 'General case' 0 CA--C 1.53 0.179 0 O-C-N 120.977 -1.077 . . . . 10.0 109.689 -179.877 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -121.0 -167.11 1.43 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.187 -0.46 . . . . 10.0 110.83 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -156.75 116.41 3.49 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-O 121.877 0.846 . . . . 10.0 109.408 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.409 ' HG2' ' CE ' ' A' ' 62' ' ' MET . 32.8 mt-10 -79.01 108.37 12.45 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 118.146 -1.421 . . . . 10.0 114.446 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -61.37 -29.7 70.07 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 124.889 1.368 . . . . 10.0 111.404 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 68.43 -78.38 0.04 OUTLIER 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 116.022 1.86 . . . . 10.0 116.022 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 1.7 m 15.68 82.65 0.01 OUTLIER 'General case' 0 C--N 1.313 -0.993 1 O-C-N 129.704 4.377 . . . . 10.0 111.601 -179.649 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 179.78 -57.38 0.08 OUTLIER Glycine 0 N--CA 1.438 -1.204 0 CA-C-O 117.122 -1.932 . . . . 10.0 110.37 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.1 mt -118.34 106.4 19.61 Favored 'Isoleucine or valine' 0 C--O 1.242 0.683 0 N-CA-C 104.135 -2.543 . . . . 10.0 104.135 -179.819 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.47 ' HB2' HG23 ' A' ' 25' ' ' VAL . 0.0 OUTLIER 82.33 -51.08 0.21 Allowed 'General case' 0 CA--C 1.54 0.573 0 O-C-N 125.734 1.896 . . . . 10.0 112.293 179.881 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 74.55 102.43 0.07 Allowed 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 116.09 1.885 . . . . 10.0 116.09 179.857 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 18.0 ttp85 -163.64 121.93 1.92 Allowed 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 122.159 0.98 . . . . 10.0 109.818 179.739 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.16 152.39 30.75 Favored 'General case' 0 CA--C 1.508 -0.665 0 N-CA-C 103.424 -2.806 . . . . 10.0 103.424 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 2.8 m -143.17 -168.55 2.83 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 124.145 0.978 . . . . 10.0 108.593 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 9.1 mmm -133.14 97.56 4.03 Favored 'General case' 0 C--N 1.315 -0.9 1 N-CA-C 98.333 -4.691 . . . . 10.0 98.333 179.674 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.2 m -108.93 131.71 54.77 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 116.937 2.199 . . . . 10.0 116.937 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 3.2 m -123.85 131.49 53.59 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 104.76 -2.311 . . . . 10.0 104.76 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.507 HG22 HD11 ' A' ' 93' ' ' LEU . 0.3 OUTLIER -98.86 150.35 5.03 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.999 0 N-CA-C 101.379 -3.563 . . . . 10.0 101.379 179.778 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.411 ' O ' HD22 ' A' ' 93' ' ' LEU . 3.3 m -157.4 160.23 38.18 Favored 'General case' 0 C--N 1.319 -0.75 0 O-C-N 125.564 1.79 . . . . 10.0 114.798 -179.82 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 7.6 p90 -118.3 136.23 53.82 Favored 'General case' 0 N--CA 1.465 0.311 0 O-C-N 124.083 0.864 . . . . 10.0 109.097 -179.69 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -101.33 -57.9 1.99 Allowed 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 103.075 -2.935 . . . . 10.0 103.075 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -155.3 -120.84 0.72 Allowed Glycine 0 N--CA 1.434 -1.441 0 N-CA-C 105.18 -3.168 . . . . 10.0 105.18 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -70.42 -18.37 63.01 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 118.971 1.386 . . . . 10.0 110.565 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.404 ' HB2' ' HE3' ' A' ' 92' ' ' LYS . 9.0 mtmt -88.41 -174.36 4.57 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 106.796 -1.557 . . . . 10.0 106.796 -179.802 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.507 HD11 HG22 ' A' ' 86' ' ' VAL . 1.2 tm? -151.18 124.83 9.03 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 104.698 -2.334 . . . . 10.0 104.698 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' GLN . . . . . 0.427 ' N ' HD13 ' A' ' 93' ' ' LEU . 8.9 mm-40 -111.52 160.68 16.93 Favored 'General case' 0 CA--C 1.502 -0.872 0 CA-C-N 113.51 -1.677 . . . . 10.0 113.914 -179.797 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 4.2 t -140.78 135.45 31.5 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 118.29 -0.862 . . . . 10.0 109.453 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 44.3 t -119.92 91.34 1.8 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.74 0 O-C-N 126.941 2.651 . . . . 10.0 106.919 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -91.94 72.24 5.61 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 123.901 1.81 . . . . 10.0 112.306 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 31.1 tttp -71.82 90.96 1.12 Allowed 'General case' 0 C--O 1.225 -0.23 0 O-C-N 120.194 -1.566 . . . . 10.0 109.409 179.588 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -139.83 82.17 0.25 Allowed Glycine 0 C--O 1.226 -0.396 0 N-CA-C 108.258 -1.937 . . . . 10.0 108.258 -179.703 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 59.12 178.36 0.08 Allowed 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 114.791 1.404 . . . . 10.0 114.791 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 37.5 mttt 55.26 175.24 0.03 OUTLIER 'General case' 0 C--O 1.24 0.563 0 N-CA-C 116.241 1.941 . . . . 10.0 116.241 179.813 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -107.12 116.65 32.29 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 126.383 1.873 . . . . 10.0 108.493 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 90.32 66.48 1.2 Allowed Glycine 0 C--O 1.224 -0.495 0 N-CA-C 116.22 1.248 . . . . 10.0 116.22 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.512 ' NH2' HD21 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -130.78 136.43 48.71 Favored 'General case' 0 N--CA 1.444 -0.749 0 O-C-N 124.356 0.68 . . . . 10.0 111.489 -179.895 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 143.66 163.31 9.8 Favored Glycine 0 N--CA 1.441 -0.972 0 O-C-N 126.411 2.32 . . . . 10.0 108.636 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 32.0 m0 -119.81 174.37 6.48 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 119.053 1.426 . . . . 10.0 112.43 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' THR . . . . . 0.498 ' O ' HD12 ' A' ' 117' ' ' LEU . 16.0 m -151.64 128.33 10.84 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 109.561 -0.533 . . . . 10.0 109.561 179.894 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.551 ' NE2' HD13 ' A' ' 117' ' ' LEU . 59.8 mm-40 -106.44 156.6 18.37 Favored 'General case' 0 C--N 1.319 -0.729 0 O-C-N 125.95 2.031 . . . . 10.0 111.346 -179.897 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 1.5 t90 -171.98 119.3 0.42 Allowed 'General case' 0 N--CA 1.478 0.953 0 CA-C-O 123.297 1.523 . . . . 10.0 106.978 -179.875 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 60.6 mt -98.7 152.06 4.43 Favored 'Isoleucine or valine' 0 C--O 1.241 0.647 0 N-CA-C 117.367 2.358 . . . . 10.0 117.367 -179.752 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -130.15 -168.67 2.0 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 103.391 -2.818 . . . . 10.0 103.391 -179.78 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -68.0 -59.15 6.67 Favored Glycine 0 N--CA 1.469 0.856 0 O-C-N 120.678 -1.264 . . . . 10.0 110.035 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 113' ' ' ASP . . . . . 0.429 ' HA ' ' HG2' ' A' ' 132' ' ' LYS . 0.1 OUTLIER -117.8 9.63 13.01 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 119.655 1.727 . . . . 10.0 113.292 179.719 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -128.53 -159.75 0.97 Allowed 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 115.618 1.71 . . . . 10.0 115.618 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.589 ' CD1' ' CD2' ' A' ' 8' ' ' TRP . 0.4 OUTLIER -171.86 134.53 0.79 Allowed 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 106.451 -1.685 . . . . 10.0 106.451 179.904 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -117.38 86.64 2.55 Favored 'General case' 0 C--O 1.236 0.372 0 O-C-N 125.044 1.465 . . . . 10.0 109.41 -179.913 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.551 HD13 ' NE2' ' A' ' 108' ' ' GLN . 1.5 tp -95.26 148.0 22.87 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.059 -1.089 . . . . 10.0 108.059 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -127.12 157.22 40.27 Favored 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 106.924 -1.51 . . . . 10.0 106.924 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 18.9 mtm -142.68 114.42 8.07 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 123.715 1.721 . . . . 10.0 108.694 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 5.9 ttp180 -104.64 129.8 52.74 Favored 'General case' 0 CA--C 1.506 -0.734 0 CA-C-O 122.37 1.081 . . . . 10.0 112.9 179.405 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -148.39 118.87 7.4 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 114.423 -1.262 . . . . 10.0 107.799 -179.709 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 37.68 47.45 0.82 Allowed 'General case' 0 C--O 1.243 0.76 0 O-C-N 126.626 2.454 . . . . 10.0 117.344 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 91.06 -4.26 81.15 Favored Glycine 0 C--N 1.337 0.585 0 C-N-CA 119.022 -1.561 . . . . 10.0 114.011 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.575 HG11 ' HA ' ' A' ' 19' ' ' TYR . 0.3 OUTLIER -96.95 151.62 4.11 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.514 0 N-CA-C 107.624 -1.25 . . . . 10.0 107.624 179.695 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 2.9 m -134.66 102.54 5.32 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 113.954 -1.475 . . . . 10.0 111.875 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -115.1 134.41 55.19 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 105.844 -1.91 . . . . 10.0 105.844 179.892 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 14.0 mtmm -127.3 125.13 40.31 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 115.444 1.646 . . . . 10.0 115.444 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 1.2 mm100 -99.21 113.52 25.83 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-N 114.389 -1.278 . . . . 10.0 109.697 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 8.0 t -96.74 127.25 49.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 N-CA-C 104.666 -2.346 . . . . 10.0 104.666 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 130' ' ' PHE . . . . . 0.518 ' CE2' ' HB2' ' A' ' 40' ' ' LYS . 8.1 m-30 -110.25 144.67 38.59 Favored 'General case' 0 N--CA 1.441 -0.891 0 C-N-CA 124.188 0.995 . . . . 10.0 112.678 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.574 ' HB2' HD12 ' A' ' 11' ' ' LEU . 6.3 tptm -127.72 92.4 3.48 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 105.765 -1.939 . . . . 10.0 105.765 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 132' ' ' LYS . . . . . 0.429 ' HG2' ' HA ' ' A' ' 113' ' ' ASP . 11.0 ptpt -53.38 129.85 33.33 Favored 'General case' 0 CA--C 1.503 -0.83 0 CA-C-O 125.736 2.684 . . . . 10.0 111.259 -179.714 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 133' ' ' VAL . . . . . 0.413 ' O ' HG13 ' A' ' 133' ' ' VAL . 0.3 OUTLIER -83.7 -3.0 7.27 Favored 'Isoleucine or valine' 0 C--O 1.236 0.342 0 O-C-N 120.041 -1.662 . . . . 10.0 111.69 -179.92 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 . . . . . 0 C--N 1.314 -0.937 0 O-C-N 125.47 1.731 . . . . 10.0 110.684 179.928 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 43.1 p-10 . . . . . 0 N--CA 1.47 0.551 0 CA-C-O 124.26 1.981 . . . . 10.0 109.286 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 41.9 m-85 -54.05 -13.51 0.82 Allowed 'General case' 0 C--O 1.242 0.662 0 CA-C-O 116.616 -1.659 . . . . 10.0 114.568 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -53.92 131.32 39.92 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-O 124.34 2.019 . . . . 10.0 113.793 179.623 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 155.14 165.0 13.58 Favored Glycine 0 CA--C 1.528 0.902 0 O-C-N 119.778 -1.826 . . . . 10.0 114.002 179.809 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.505 ' HA ' ' HA ' ' A' ' 41' ' ' GLU . 1.9 m-30 -104.73 121.78 44.31 Favored 'General case' 0 C--O 1.243 0.755 0 CA-C-O 116.565 -1.683 . . . . 10.0 106.756 179.61 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.769 ' CE2' ' HB2' ' A' ' 40' ' ' LYS . 1.1 p-90 -113.59 145.88 40.58 Favored 'General case' 0 N--CA 1.44 -0.955 0 CA-C-O 123.37 1.557 . . . . 10.0 115.042 179.601 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.5 ptpp? -121.85 120.0 33.24 Favored 'General case' 0 N--CA 1.437 -1.097 0 N-CA-C 105.16 -2.163 . . . . 10.0 105.16 -179.422 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.517 ' HB3' ' CZ3' ' A' ' 8' ' ' TRP . 6.7 ptm -68.66 142.14 55.16 Favored 'General case' 0 CA--C 1.506 -0.727 0 O-C-N 118.834 -2.416 . . . . 10.0 115.697 -179.596 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 12.1 tp -97.75 -33.88 11.11 Favored 'General case' 0 CA--C 1.508 -0.652 0 O-C-N 120.303 -1.498 . . . . 10.0 109.609 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -152.57 152.08 31.42 Favored 'General case' 0 CA--C 1.515 -0.399 0 N-CA-C 115.388 1.625 . . . . 10.0 115.388 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -134.9 132.6 38.7 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 106.807 -1.553 . . . . 10.0 106.807 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -132.29 162.59 30.63 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 119.249 0.931 . . . . 10.0 113.023 179.693 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 2.7 m120 37.65 25.81 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.472 0 O-C-N 126.918 2.636 . . . . 10.0 116.851 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -65.35 -31.99 73.4 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 118.862 -2.399 . . . . 10.0 114.218 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -65.77 -41.82 91.59 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 115.437 1.643 . . . . 10.0 115.437 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -79.82 -22.08 43.46 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 107.007 -1.479 . . . . 10.0 107.007 179.666 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.561 ' CZ ' HD11 ' A' ' 23' ' ' LEU . 2.9 t80 -66.84 -36.94 83.49 Favored 'General case' 0 CA--C 1.55 0.958 0 O-C-N 121.023 -1.048 . . . . 10.0 111.137 -179.582 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 20.5 mt -71.69 -39.18 70.38 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 125.356 1.462 . . . . 10.0 111.015 179.82 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 22.4 ttp180 -71.84 -28.18 63.38 Favored 'General case' 0 C--O 1.244 0.806 0 O-C-N 124.859 1.349 . . . . 10.0 110.704 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.36 -42.97 95.94 Favored 'General case' 0 C--O 1.212 -0.873 0 C-N-CA 124.266 1.026 . . . . 10.0 113.652 -179.814 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.561 HD11 ' CZ ' ' A' ' 19' ' ' TYR . 0.3 OUTLIER -91.84 -22.97 19.83 Favored 'General case' 0 C--N 1.345 0.374 0 CA-C-O 122.216 1.008 . . . . 10.0 113.461 -179.966 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.6 t0 66.29 70.55 0.41 Allowed 'General case' 0 N--CA 1.481 1.078 0 O-C-N 119.644 -1.91 . . . . 10.0 112.173 179.423 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.502 HG21 HD22 ' A' ' 29' ' ' LEU . 0.2 OUTLIER -93.34 -51.35 11.31 Favored 'Isoleucine or valine' 0 C--O 1.242 0.675 0 N-CA-C 106.337 -1.727 . . . . 10.0 106.337 -179.822 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 177.92 152.26 0.27 Allowed 'General case' 0 C--O 1.243 0.749 0 N-CA-C 116.788 2.144 . . . . 10.0 116.788 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.41 ' CG1' ' N ' ' A' ' 28' ' ' ALA . 0.3 OUTLIER -74.53 -37.76 44.62 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 C-N-CA 125.464 1.505 . . . . 10.0 113.75 -179.601 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.41 ' N ' ' CG1' ' A' ' 27' ' ' VAL . . . -76.4 -31.79 58.16 Favored 'General case' 0 C--N 1.319 -0.729 0 O-C-N 126.147 2.154 . . . . 10.0 112.959 179.896 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.502 HD22 HG21 ' A' ' 25' ' ' VAL . 2.1 tp -68.28 -29.57 68.39 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.9 0.704 . . . . 10.0 112.9 179.794 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.41 -30.5 70.28 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 113.307 0.855 . . . . 10.0 113.307 -179.803 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.62 -37.89 41.12 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 113.242 -1.799 . . . . 10.0 110.289 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.543 HD13 ' CZ ' ' A' ' 57' ' ' PHE . 48.1 mt -77.37 -48.38 24.63 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 O-C-N 119.746 -1.846 . . . . 10.0 112.821 -179.387 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -55.8 -33.91 64.84 Favored 'General case' 0 C--O 1.216 -0.692 0 CA-C-O 117.699 -1.143 . . . . 10.0 113.799 179.8 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 22.3 m-20 -69.39 -9.57 54.11 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 115.078 1.51 . . . . 10.0 115.078 179.892 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.5 mt -104.57 14.17 30.39 Favored 'General case' 0 C--N 1.315 -0.907 0 O-C-N 124.973 1.421 . . . . 10.0 111.188 179.825 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -128.85 147.76 50.84 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.095 0.958 . . . . 10.0 110.572 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 4.6 mttt -129.88 73.35 81.51 Favored Pre-proline 0 C--O 1.218 -0.562 0 N-CA-C 106.27 -1.752 . . . . 10.0 106.27 -179.816 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 9.0 Cg_endo -52.93 128.52 29.15 Favored 'Trans proline' 0 N--CA 1.451 -1.004 0 O-C-N 125.418 2.272 . . . . 10.0 116.104 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -106.48 142.53 35.99 Favored 'General case' 0 C--N 1.316 -0.854 0 O-C-N 128.458 3.599 . . . . 10.0 104.724 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.769 ' HB2' ' CE2' ' A' ' 8' ' ' TRP . 1.4 ttmt -112.6 177.79 4.51 Favored 'General case' 0 C--O 1.21 -0.991 0 O-C-N 124.796 1.31 . . . . 10.0 112.262 -179.601 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.505 ' HA ' ' HA ' ' A' ' 7' ' ' TYR . 2.2 tt0 -158.26 120.7 3.71 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 104.887 -2.264 . . . . 10.0 104.887 -179.479 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 19.0 mm -103.14 152.6 5.89 Favored 'Isoleucine or valine' 0 C--O 1.242 0.69 0 O-C-N 125.555 1.785 . . . . 10.0 112.622 179.648 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 62.4 t -154.25 98.72 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 CA-C-N 113.369 -1.741 . . . . 10.0 108.538 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -98.61 118.61 35.7 Favored 'General case' 0 C--N 1.311 -1.068 0 C-N-CA 125.056 1.342 . . . . 10.0 107.532 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -93.58 18.76 9.46 Favored 'General case' 0 C--O 1.24 0.587 0 CA-C-O 117.429 -1.272 . . . . 10.0 108.032 -179.82 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 113.77 -100.28 1.04 Allowed Glycine 0 CA--C 1.523 0.536 0 N-CA-C 107.634 -2.187 . . . . 10.0 107.634 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.423 ' HA ' HG12 ' A' ' 66' ' ' VAL . 0.0 OUTLIER -86.1 -29.04 23.65 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 121.493 -1.004 . . . . 10.0 109.322 179.854 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -95.78 121.79 37.88 Favored 'General case' 0 CA--C 1.509 -0.609 0 N-CA-C 107.777 -1.194 . . . . 10.0 107.777 179.834 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 9.0 ttt -114.64 124.2 51.22 Favored 'General case' 0 CA--C 1.504 -0.827 0 CA-C-O 123.102 1.43 . . . . 10.0 112.285 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.484 ' C ' HD13 ' A' ' 51' ' ' ILE . 30.7 mm -108.81 122.05 62.83 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.29 0 N-CA-C 107.393 -1.336 . . . . 10.0 107.393 -179.764 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.53 ' N ' HD13 ' A' ' 51' ' ' ILE . 1.5 mm -107.87 135.97 44.78 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 N-CA-C 105.253 -2.129 . . . . 10.0 105.253 179.881 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 12.7 mtm-85 -133.7 122.58 23.6 Favored 'General case' 0 CA--C 1.51 -0.582 0 C-N-CA 119.978 -0.689 . . . . 10.0 112.361 -179.833 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 58.3 m -98.42 129.38 45.05 Favored 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 102.492 -3.151 . . . . 10.0 102.492 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 8.8 mt -117.71 54.24 0.91 Allowed 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 119.398 3.111 . . . . 10.0 119.398 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 60.6 p -73.54 -172.75 1.27 Allowed 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 103.864 -2.643 . . . . 10.0 103.864 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 8.0 p -120.56 -13.42 8.78 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-O 118.667 -0.682 . . . . 10.0 111.973 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.543 ' CZ ' HD13 ' A' ' 32' ' ' ILE . 19.5 t80 -81.16 -46.38 14.97 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.36 -0.978 . . . . 10.0 108.36 -179.928 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.37 143.21 16.25 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-O 123.906 1.813 . . . . 10.0 112.879 -179.856 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -87.82 142.84 27.49 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 114.067 -1.424 . . . . 10.0 107.964 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.404 ' C ' HD13 ' A' ' 61' ' ' ILE . 1.9 t80 -149.87 118.48 6.54 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 126.689 2.493 . . . . 10.0 105.206 -179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.445 HG22 ' H ' ' A' ' 62' ' ' MET . 0.0 OUTLIER -109.44 -175.13 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.313 -1.006 0 O-C-N 124.943 1.402 . . . . 10.0 112.598 179.92 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 62' ' ' MET . . . . . 0.445 ' H ' HG22 ' A' ' 61' ' ' ILE . 2.3 mtm -143.21 -179.58 6.48 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 106.931 -1.507 . . . . 10.0 106.931 -179.772 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 64.7 t0 -162.12 80.92 0.55 Allowed 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 102.889 -3.004 . . . . 10.0 102.889 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 2.0 m-30 -88.67 166.15 14.29 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 125.2 1.562 . . . . 10.0 112.207 179.865 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.409 ' O ' HG13 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -144.25 126.0 15.17 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 103.8 -2.667 . . . . 10.0 103.8 179.988 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.423 HG12 ' HA ' ' A' ' 47' ' ' ASP . 2.0 p -89.88 133.8 30.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 O-C-N 124.658 1.224 . . . . 10.0 108.453 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 91.1 -12.3 69.56 Favored Glycine 0 C--O 1.219 -0.811 0 C-N-CA 120.168 -1.015 . . . . 10.0 115.251 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.2 mttm -109.3 -173.19 2.21 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 117.44 0.62 . . . . 10.0 112.359 179.844 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -131.32 139.93 49.65 Favored 'General case' 0 C--N 1.314 -0.94 0 O-C-N 125.223 1.577 . . . . 10.0 107.533 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 10.5 p90 -154.5 135.33 13.68 Favored 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 118.597 -1.241 . . . . 10.0 110.173 179.877 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.13 155.86 22.4 Favored 'General case' 0 C--O 1.222 -0.393 0 N-CA-C 106.316 -1.735 . . . . 10.0 106.316 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -156.24 116.76 3.71 Favored 'General case' 0 N--CA 1.438 -1.071 0 N-CA-C 117.614 2.45 . . . . 10.0 117.614 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 -83.29 91.65 7.34 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 105.236 -2.135 . . . . 10.0 105.236 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 13.0 mt -62.15 3.43 0.17 Allowed 'General case' 0 N--CA 1.438 -1.068 0 N-CA-C 117.88 2.548 . . . . 10.0 117.88 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.408 HG23 ' H ' ' A' ' 75' ' ' THR . 50.8 p -41.97 109.65 0.14 Allowed 'General case' 0 C--O 1.24 0.575 0 O-C-N 125.76 1.913 . . . . 10.0 108.98 179.699 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' GLY . . . . . 0.728 ' C ' HD13 ' A' ' 77' ' ' ILE . . . 134.9 -30.25 2.86 Favored Glycine 0 CA--C 1.525 0.706 0 CA-C-N 113.21 -1.813 . . . . 10.0 109.8 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.728 HD13 ' C ' ' A' ' 76' ' ' GLY . 2.5 mm -128.3 -17.1 2.36 Favored 'Isoleucine or valine' 0 C--O 1.247 0.938 0 CA-C-N 117.774 0.787 . . . . 10.0 111.43 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -144.44 -40.49 0.27 Allowed 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 117.641 -1.171 . . . . 10.0 113.195 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 93.53 -23.22 0.06 Allowed 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 126.987 2.115 . . . . 10.0 113.651 -179.824 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -94.7 166.71 11.87 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 117.367 -1.301 . . . . 10.0 112.932 -179.758 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.86 168.57 12.59 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 103.143 -2.91 . . . . 10.0 103.143 -179.919 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -153.06 -170.83 3.74 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 113.914 -1.494 . . . . 10.0 110.282 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.6 mmt -119.98 49.36 1.41 Allowed 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 101.387 -3.56 . . . . 10.0 101.387 179.772 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 42.3 m -44.93 104.23 0.04 OUTLIER 'General case' 0 N--CA 1.439 -1.003 0 N-CA-C 119.243 3.053 . . . . 10.0 119.243 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 22.7 m -102.34 133.99 46.37 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 105.359 -2.089 . . . . 10.0 105.359 -179.92 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.409 HG13 ' O ' ' A' ' 65' ' ' GLN . 0.2 OUTLIER -117.57 109.87 28.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 102.956 -2.979 . . . . 10.0 102.956 -179.828 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 17.3 m -104.05 166.42 10.42 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 115.888 -0.596 . . . . 10.0 111.484 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 11.5 p-90 -126.61 55.09 1.55 Allowed 'General case' 0 CA--C 1.511 -0.544 0 CA-C-O 125.027 2.346 . . . . 10.0 109.991 -179.744 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -66.4 109.25 2.65 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 101.343 -3.577 . . . . 10.0 101.343 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 81.93 -154.4 33.78 Favored Glycine 0 N--CA 1.446 -0.696 0 N-CA-C 108.273 -1.931 . . . . 10.0 108.273 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -103.46 42.42 1.17 Allowed 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 123.073 1.416 . . . . 10.0 109.846 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 7.2 mtmt -122.27 -166.16 1.37 Allowed 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 113.195 -1.821 . . . . 10.0 108.228 179.82 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 5.2 tt -141.33 102.57 4.25 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 105.573 -2.01 . . . . 10.0 105.573 -179.835 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -113.77 118.99 35.83 Favored 'General case' 0 CA--C 1.507 -0.674 0 O-C-N 120.81 -1.181 . . . . 10.0 112.84 179.9 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 19.9 p -127.51 148.41 50.32 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 112.828 0.677 . . . . 10.0 112.828 179.901 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 88.9 t -126.33 125.75 68.09 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.75 0 N-CA-C 106.399 -1.704 . . . . 10.0 106.399 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 59.3 mt-30 -107.84 57.96 0.62 Allowed 'General case' 0 C--N 1.317 -0.822 0 O-C-N 126.654 2.471 . . . . 10.0 110.997 -179.833 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 1.5 mmmm -9.41 -92.23 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.602 0 O-C-N 128.032 3.333 . . . . 10.0 115.754 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 43.73 38.06 4.16 Favored Glycine 0 N--CA 1.44 -1.044 0 CA-C-O 118.025 -1.431 . . . . 10.0 113.054 179.551 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 68.03 -141.01 0.11 Allowed 'General case' 0 C--N 1.32 -0.698 0 O-C-N 125.723 1.484 . . . . 10.0 111.09 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 2.1 mmmm 57.32 174.1 0.05 OUTLIER 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 117.293 2.331 . . . . 10.0 117.293 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 45.8 mm-40 -82.06 -44.26 16.82 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 126.589 1.956 . . . . 10.0 109.423 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -113.26 -102.33 2.55 Favored Glycine 0 N--CA 1.444 -0.812 0 CA-C-O 122.641 1.134 . . . . 10.0 115.776 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 2.4 mtt180 63.19 91.83 0.07 Allowed 'General case' 0 CA--C 1.535 0.383 0 O-C-N 120.765 -1.432 . . . . 10.0 114.166 179.815 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 166.3 155.68 9.01 Favored Glycine 0 N--CA 1.447 -0.631 0 O-C-N 126.284 2.24 . . . . 10.0 108.163 -179.796 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 1.6 m0 -114.43 169.29 9.15 Favored 'General case' 0 CA--C 1.505 -0.75 0 O-C-N 125.314 1.244 . . . . 10.0 109.969 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 2.2 m -149.65 118.38 6.6 Favored 'General case' 0 CA--C 1.506 -0.728 0 N-CA-C 107.577 -1.268 . . . . 10.0 107.577 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -112.55 117.07 31.31 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.986 -179.719 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 1.5 p90 -137.07 140.59 42.1 Favored 'General case' 0 C--O 1.217 -0.607 0 N-CA-C 107.201 -1.407 . . . . 10.0 107.201 179.864 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 60.7 mt -96.18 159.76 2.92 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.004 0 N-CA-C 114.506 1.299 . . . . 10.0 114.506 179.609 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -166.97 113.32 0.79 Allowed 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 116.939 -1.505 . . . . 10.0 107.208 -179.73 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 53.51 40.78 62.9 Favored Glycine 0 N--CA 1.464 0.544 0 N-CA-C 106.447 -2.661 . . . . 10.0 106.447 179.889 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 64.0 9.41 4.59 Favored 'General case' 0 CA--C 1.552 1.054 0 CA-C-O 117.396 -1.287 . . . . 10.0 111.035 179.792 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -100.27 90.61 4.4 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 124.06 0.85 . . . . 10.0 110.184 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.417 ' HB3' ' HB2' ' A' ' 130' ' ' PHE . 12.1 tp -57.83 118.96 5.87 Favored 'General case' 0 N--CA 1.444 -0.764 0 N-CA-C 106.887 -1.523 . . . . 10.0 106.887 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 116' ' ' HIS . . . . . 0.421 ' CD2' HG12 ' A' ' 129' ' ' VAL . 25.2 m170 -112.83 103.22 11.21 Favored 'General case' 0 CA--C 1.5 -0.968 0 O-C-N 125.772 1.92 . . . . 10.0 107.401 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 42.4 tp -93.55 143.9 25.87 Favored 'General case' 0 C--O 1.241 0.615 0 O-C-N 119.282 -2.136 . . . . 10.0 113.385 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 66.6 tt0 -130.32 123.57 30.29 Favored 'General case' 0 C--O 1.217 -0.607 0 CA-C-O 117.636 -1.173 . . . . 10.0 109.661 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 6.5 mtt -116.63 153.45 32.26 Favored 'General case' 0 C--O 1.239 0.546 0 O-C-N 124.295 0.997 . . . . 10.0 110.599 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 1.1 mmm-85 -147.6 139.99 24.52 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 117.935 -1.031 . . . . 10.0 110.644 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -153.98 117.09 4.52 Favored 'General case' 0 N--CA 1.443 -0.805 0 O-C-N 124.527 1.142 . . . . 10.0 111.342 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 56.28 39.88 30.05 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 116.953 2.205 . . . . 10.0 116.953 179.789 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 87.79 -6.43 83.47 Favored Glycine 0 CA--C 1.539 1.546 0 CA-C-O 118.663 -1.076 . . . . 10.0 112.272 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 2.0 t -98.9 131.92 45.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 125.213 1.405 . . . . 10.0 108.206 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 94.3 m -111.67 140.2 46.5 Favored 'General case' 0 N--CA 1.446 -0.642 0 O-C-N 125.724 1.89 . . . . 10.0 110.822 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -129.16 145.46 51.31 Favored 'General case' 0 C--O 1.221 -0.417 0 N-CA-C 106.043 -1.836 . . . . 10.0 106.043 -179.911 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 2.2 mtmm -137.44 141.83 41.61 Favored 'General case' 0 C--N 1.328 -0.343 0 O-C-N 120.431 -1.418 . . . . 10.0 114.141 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -132.99 130.46 39.52 Favored 'General case' 0 CA--C 1.503 -0.854 0 O-C-N 125.209 1.568 . . . . 10.0 109.815 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.421 HG12 ' CD2' ' A' ' 116' ' ' HIS . 0.0 OUTLIER -106.15 96.33 4.52 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.379 0 C-N-CA 124.005 0.922 . . . . 10.0 110.543 179.92 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 130' ' ' PHE . . . . . 0.488 ' CZ ' ' CZ2' ' A' ' 8' ' ' TRP . 5.5 m-85 -83.86 175.98 9.23 Favored 'General case' 0 C--N 1.321 -0.631 0 O-C-N 126.637 2.461 . . . . 10.0 109.054 -179.766 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 23.4 tptp -148.27 98.39 2.91 Favored 'General case' 0 N--CA 1.44 -0.935 0 N-CA-C 106.852 -1.536 . . . . 10.0 106.852 179.754 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 7.7 ttpt -63.5 122.9 17.41 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 125.636 1.835 . . . . 10.0 108.795 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 24.6 t -102.45 -57.3 4.57 Favored 'Isoleucine or valine' 0 C--O 1.244 0.809 0 N-CA-C 113.911 1.078 . . . . 10.0 113.911 179.665 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 3.3 t-80 . . . . . 0 C--O 1.244 0.8 0 C-N-CA 118.086 -1.446 . . . . 10.0 113.828 179.824 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 . . . . . 0 N--CA 1.472 0.672 0 N-CA-C 108.654 -0.869 . . . . 10.0 108.654 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 2.8 m-30 -72.41 -28.18 62.82 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 115.999 1.851 . . . . 10.0 115.999 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.4 p30 -68.13 139.32 56.16 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-N 120.921 1.691 . . . . 10.0 114.389 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -156.5 -93.12 0.09 OUTLIER Glycine 0 C--O 1.216 -1.006 0 N-CA-C 119.114 2.406 . . . . 10.0 119.114 -179.744 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.499 ' HA ' ' CE3' ' A' ' 8' ' ' TRP . 0.8 OUTLIER 172.7 170.91 0.12 Allowed 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 103.501 -2.778 . . . . 10.0 103.501 179.362 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.733 ' HA ' ' HB3' ' A' ' 132' ' ' LYS 0.331 32.0 p90 -152.05 159.25 43.75 Favored 'General case' 0 N--CA 1.441 -0.899 0 N-CA-C 115.459 1.651 . . . . 10.0 115.459 -178.116 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.519 ' HD3' ' CG ' ' A' ' 132' ' ' LYS . 2.3 pttp -167.28 88.38 0.3 Allowed 'General case' 0 C--O 1.216 -0.709 0 O-C-N 127.879 3.237 . . . . 10.0 108.313 175.844 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.538 ' HE1' ' HD2' ' A' ' 38' ' ' PRO . 2.1 ttp -54.49 140.12 35.44 Favored 'General case' 0 CA--C 1.509 -0.616 0 N-CA-C 116.521 2.045 . . . . 10.0 116.521 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.8 tp -101.73 -42.95 6.0 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 114.448 -1.251 . . . . 10.0 108.07 179.85 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -162.0 161.71 28.62 Favored 'General case' 0 C--O 1.244 0.792 0 O-C-N 125.377 1.673 . . . . 10.0 115.446 179.663 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -135.43 173.25 11.93 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 105.247 -2.131 . . . . 10.0 105.247 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -162.19 151.84 16.17 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 119.889 -1.757 . . . . 10.0 115.497 179.616 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 57.51 27.46 14.07 Favored 'General case' 0 C--N 1.324 -0.541 0 O-C-N 127.084 2.74 . . . . 10.0 115.582 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.4 ' CD1' ' N ' ' A' ' 16' ' ' PHE . 0.0 OUTLIER -56.55 -29.56 62.09 Favored 'General case' 0 C--O 1.244 0.784 0 C-N-CA 126.045 1.738 . . . . 10.0 114.932 179.931 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -78.66 -43.43 26.15 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 120.414 1.461 . . . . 10.0 109.169 179.186 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.08 -21.95 63.1 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-O 117.834 -1.079 . . . . 10.0 110.884 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -72.76 -36.04 67.59 Favored 'General case' 0 CA--C 1.552 1.052 0 O-C-N 124.79 1.306 . . . . 10.0 109.783 -179.911 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.625 HD22 HG11 ' A' ' 25' ' ' VAL . 75.0 mt -74.17 -27.96 61.07 Favored 'General case' 0 C--O 1.22 -0.454 0 CA-C-N 114.022 -1.444 . . . . 10.0 111.207 -179.83 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.5 ttt180 -73.47 -23.48 60.08 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 114.099 -1.409 . . . . 10.0 110.057 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.24 -24.62 62.22 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 122.258 1.028 . . . . 10.0 112.205 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.5 mt -109.71 -1.28 18.1 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 114.222 -1.354 . . . . 10.0 114.444 -179.784 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 55.68 72.06 0.51 Allowed 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 118.884 0.766 . . . . 10.0 111.415 179.717 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.625 HG11 HD22 ' A' ' 20' ' ' LEU . 2.2 p -94.58 -109.94 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.24 0.563 0 CA-C-O 117.084 -1.436 . . . . 10.0 107.416 179.965 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.58 ' N ' HG22 ' A' ' 25' ' ' VAL . 0.9 OUTLIER -148.37 161.99 40.46 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-N 120.437 1.471 . . . . 10.0 113.582 179.761 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -77.25 -20.0 14.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 O-C-N 125.876 1.985 . . . . 10.0 114.017 -179.6 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -77.32 -34.18 55.39 Favored 'General case' 0 C--O 1.242 0.677 0 O-C-N 125.274 1.609 . . . . 10.0 109.326 179.784 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.492 HD23 HG21 ' A' ' 25' ' ' VAL . 44.8 tp -77.91 -40.01 41.14 Favored 'General case' 0 C--O 1.222 -0.392 0 C-N-CA 118.393 -1.323 . . . . 10.0 113.487 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 8.8 mtm-85 -59.09 -23.26 61.92 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 125.65 1.58 . . . . 10.0 114.163 179.714 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.7 ttpp -76.53 -43.25 40.07 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 117.844 -1.074 . . . . 10.0 109.971 179.784 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.404 HD12 ' CE1' ' A' ' 57' ' ' PHE . 0.8 OUTLIER -79.52 -40.94 21.91 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 O-C-N 125.709 1.881 . . . . 10.0 109.807 -179.835 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -55.4 -58.6 7.06 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-O 121.83 0.824 . . . . 10.0 112.094 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -64.89 82.28 0.04 OUTLIER 'General case' 0 C--N 1.342 0.265 0 CA-C-N 113.775 -1.557 . . . . 10.0 110.247 179.746 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 162.77 -32.59 0.0 OUTLIER 'General case' 0 N--CA 1.444 -0.77 0 O-C-N 126.112 2.132 . . . . 10.0 111.144 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.5 mt -88.98 155.38 19.53 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 124.372 1.045 . . . . 10.0 111.096 179.562 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.1 pttt -138.35 105.64 7.82 Favored Pre-proline 0 C--N 1.319 -0.723 0 N-CA-C 103.911 -2.625 . . . . 10.0 103.911 179.638 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.538 ' HD2' ' HE1' ' A' ' 10' ' ' MET . 95.8 Cg_exo -51.15 -166.68 0.0 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.327 0 C-N-CA 125.04 3.827 . . . . 10.0 119.123 179.785 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.601 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 4.7 p30 -153.22 167.79 28.13 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 112.724 -2.035 . . . . 10.0 106.522 -179.555 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.45 ' HB2' ' CZ ' ' A' ' 130' ' ' PHE . 0.3 OUTLIER -149.97 121.07 7.74 Favored 'General case' 0 CA--C 1.497 -1.085 0 C-N-CA 116.994 -1.882 . . . . 10.0 112.819 -179.433 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.626 ' HA ' ' CE3' ' A' ' 8' ' ' TRP . 2.4 tt0 -110.36 103.12 11.73 Favored 'General case' 0 CA--C 1.509 -0.611 0 O-C-N 119.95 -1.719 . . . . 10.0 106.91 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 67.6 mt -93.44 130.13 42.89 Favored 'Isoleucine or valine' 0 C--O 1.243 0.737 0 CA-C-N 115.115 -0.948 . . . . 10.0 108.906 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -119.13 122.65 69.76 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.934 0 N-CA-C 107.04 -1.467 . . . . 10.0 107.04 -179.885 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -143.78 107.05 4.54 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 105.921 -1.881 . . . . 10.0 105.921 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -81.03 -51.44 8.5 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 123.281 1.515 . . . . 10.0 107.822 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -155.15 -83.93 0.04 OUTLIER Glycine 0 C--N 1.345 1.06 0 N-CA-C 108.916 -1.674 . . . . 10.0 108.916 -179.84 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -111.27 -1.61 16.01 Favored 'General case' 0 N--CA 1.443 -0.817 0 O-C-N 121.124 -1.221 . . . . 10.0 109.658 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 65.9 m170 -107.5 102.87 12.1 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 109.085 -0.709 . . . . 10.0 109.085 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 2.5 ttt -95.15 151.13 19.47 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 116.495 2.035 . . . . 10.0 116.495 -179.843 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 19.4 mt -145.64 127.42 8.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 105.939 -1.874 . . . . 10.0 105.939 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.4 mp -112.2 123.66 68.15 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 CA-C-N 114.664 -1.153 . . . . 10.0 108.328 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 4.9 tpt180 -114.34 86.6 2.46 Favored 'General case' 0 C--N 1.319 -0.744 0 C-N-CA 124.714 1.206 . . . . 10.0 111.581 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 93.7 m -87.63 131.47 34.42 Favored 'General case' 0 N--CA 1.444 -0.728 0 N-CA-C 103.033 -2.951 . . . . 10.0 103.033 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 3.9 mt -105.51 66.56 0.74 Allowed 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 120.497 3.517 . . . . 10.0 120.497 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 43.8 m -76.84 116.57 17.62 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 102.706 -3.072 . . . . 10.0 102.706 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -57.58 -17.87 16.6 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 108.043 -1.095 . . . . 10.0 108.043 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.404 ' CE1' HD12 ' A' ' 32' ' ' ILE . 0.3 OUTLIER -117.93 105.7 12.18 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 106.86 -1.533 . . . . 10.0 106.86 179.914 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 6.0 mmt-85 61.52 92.14 0.05 Allowed 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 114.385 -1.279 . . . . 10.0 112.816 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -40.85 150.21 0.07 Allowed 'General case' 0 CA--C 1.532 0.277 0 O-C-N 126.707 2.504 . . . . 10.0 113.067 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -132.33 98.0 4.27 Favored 'General case' 0 C--N 1.311 -1.072 0 N-CA-C 103.012 -2.958 . . . . 10.0 103.012 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.4 ' CG2' ' N ' ' A' ' 62' ' ' MET . 1.7 mp -135.18 146.84 29.61 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.055 0 N-CA-C 115.164 1.542 . . . . 10.0 115.164 179.785 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' MET . . . . . 0.4 ' N ' ' CG2' ' A' ' 61' ' ' ILE . 0.0 OUTLIER -147.09 -171.49 3.79 Favored 'General case' 0 C--O 1.216 -0.689 0 N-CA-C 106.318 -1.734 . . . . 10.0 106.318 179.905 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -167.64 123.79 1.09 Allowed 'General case' 0 C--O 1.223 -0.312 0 N-CA-C 100.923 -3.732 . . . . 10.0 100.923 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.449 ' CE1' ' CE1' ' A' ' 70' ' ' PHE . 12.7 m-85 -123.42 -175.0 3.09 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 115.144 1.535 . . . . 10.0 115.144 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -133.71 95.3 3.44 Favored 'General case' 0 N--CA 1.443 -0.782 0 N-CA-C 103.729 -2.693 . . . . 10.0 103.729 179.798 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 9.4 t -53.27 137.68 13.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 O-C-N 124.971 1.419 . . . . 10.0 109.046 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 76.64 15.44 81.56 Favored Glycine 0 N--CA 1.443 -0.877 0 CA-C-O 117.462 -1.744 . . . . 10.0 113.113 -179.78 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 3.8 tppt? -139.41 132.32 29.33 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 125.308 1.443 . . . . 10.0 112.116 -179.693 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -69.83 148.95 48.42 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 118.153 -0.927 . . . . 10.0 109.474 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.449 ' CE1' ' CE1' ' A' ' 64' ' ' PHE . 3.6 p90 -155.17 161.59 41.18 Favored 'General case' 0 C--O 1.245 0.841 0 O-C-N 124.894 1.372 . . . . 10.0 107.813 -179.787 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -100.6 123.32 44.65 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.518 -0.919 . . . . 10.0 108.518 179.868 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -75.01 78.03 2.2 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 114.696 -1.138 . . . . 10.0 113.639 -179.829 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -60.92 133.56 56.22 Favored 'General case' 0 C--N 1.316 -0.891 0 C-N-CA 119.126 -1.03 . . . . 10.0 108.247 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.0 tp -147.58 99.57 3.13 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 117.67 -1.157 . . . . 10.0 113.071 179.875 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.499 HG23 ' O ' ' A' ' 75' ' ' THR . 3.4 t -127.5 78.78 1.84 Allowed 'General case' 0 N--CA 1.443 -0.797 0 O-C-N 124.723 1.265 . . . . 10.0 108.837 -179.888 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 153.25 110.94 0.43 Allowed Glycine 0 C--O 1.244 0.775 0 C-N-CA 120.006 -1.092 . . . . 10.0 110.671 179.852 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.6 mt 69.71 106.22 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 N-CA-C 107.527 -1.286 . . . . 10.0 107.527 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 87.64 -33.95 0.03 OUTLIER 'General case' 0 C--O 1.242 0.662 0 O-C-N 127.492 2.995 . . . . 10.0 114.319 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.2 p30 35.04 97.62 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.808 0 C-N-CA 126.956 2.103 . . . . 10.0 116.286 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.479 ' HD2' ' CZ ' ' A' ' 104' ' ' ARG . 13.6 ttp180 -124.8 -65.62 1.02 Allowed 'General case' 0 CA--C 1.512 -0.493 0 O-C-N 119.629 -1.919 . . . . 10.0 115.196 -179.902 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 76.02 120.95 0.05 OUTLIER 'General case' 0 N--CA 1.439 -1.017 0 N-CA-C 103.882 -2.636 . . . . 10.0 103.882 179.658 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -155.63 -174.46 4.98 Favored 'General case' 0 CA--C 1.512 -0.486 0 N-CA-C 108.953 -0.758 . . . . 10.0 108.953 179.898 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 4.0 ptm -121.76 148.33 44.79 Favored 'General case' 0 N--CA 1.438 -1.028 0 N-CA-C 100.237 -3.986 . . . . 10.0 100.237 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.437 HG21 ' NE2' ' A' ' 97' ' ' GLN . 1.2 m -155.68 150.29 26.12 Favored 'General case' 0 CA--C 1.501 -0.914 0 N-CA-C 114.611 1.337 . . . . 10.0 114.611 179.95 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 16.4 m -133.69 106.71 7.51 Favored 'General case' 0 N--CA 1.438 -1.052 0 O-C-N 120.965 -1.085 . . . . 10.0 109.059 -179.779 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.8 m -90.01 147.06 5.46 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.61 0 N-CA-C 103.205 -2.887 . . . . 10.0 103.205 179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -163.83 169.51 18.16 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 126.479 2.362 . . . . 10.0 114.207 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 2.6 m-90 -97.83 122.86 41.44 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 124.096 0.958 . . . . 10.0 110.467 179.693 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -99.49 -63.21 1.15 Allowed 'General case' 0 C--O 1.247 0.944 0 N-CA-C 101.93 -3.359 . . . . 10.0 101.93 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -160.53 92.92 0.12 Allowed Glycine 0 CA--C 1.498 -1.011 0 N-CA-C 108.34 -1.904 . . . . 10.0 108.34 179.769 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 57.53 30.69 19.12 Favored 'General case' 0 C--N 1.318 -0.773 0 O-C-N 124.951 1.03 . . . . 10.0 113.054 -179.683 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.4 mtpt -148.42 166.15 28.99 Favored 'General case' 0 C--O 1.238 0.49 0 N-CA-C 109.282 -0.636 . . . . 10.0 109.282 -179.963 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.2 tt -117.57 116.65 27.52 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 105.032 -2.211 . . . . 10.0 105.032 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 25.0 mm100 -106.9 156.86 18.24 Favored 'General case' 0 N--CA 1.445 -0.724 0 O-C-N 118.411 -2.681 . . . . 10.0 111.429 179.759 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -148.02 142.48 26.39 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 118.946 -1.101 . . . . 10.0 112.126 -179.676 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 57.6 t -131.68 106.92 12.42 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 CA-C-N 114.128 -1.397 . . . . 10.0 109.133 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.437 ' NE2' HG21 ' A' ' 84' ' ' THR . 3.2 mp0 -91.72 114.92 27.59 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 106.144 -1.799 . . . . 10.0 106.144 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.01 -85.37 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 116.651 -1.642 . . . . 10.0 113.734 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 40.66 -142.92 0.69 Allowed Glycine 0 CA--C 1.528 0.887 0 O-C-N 125.284 1.615 . . . . 10.0 112.475 -179.683 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.47 ' H ' ' NH1' ' A' ' 104' ' ' ARG . 3.1 mm-40 -105.19 -159.27 0.7 Allowed 'General case' 0 C--N 1.315 -0.929 0 O-C-N 126.785 2.109 . . . . 10.0 110.461 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 68.22 -166.22 0.19 Allowed 'General case' 0 C--N 1.316 -0.855 0 O-C-N 126.333 2.271 . . . . 10.0 113.636 179.875 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -135.18 12.33 3.56 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 125.249 1.419 . . . . 10.0 114.445 -179.854 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -149.76 41.7 0.81 Allowed Glycine 0 N--CA 1.467 0.701 0 N-CA-C 116.151 1.22 . . . . 10.0 116.151 179.749 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.479 ' CZ ' ' HD2' ' A' ' 80' ' ' ARG . 70.2 mtt180 -91.73 129.4 37.71 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 113.829 1.048 . . . . 10.0 113.829 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 148.41 159.72 8.64 Favored Glycine 0 N--CA 1.462 0.379 0 C-N-CA 117.369 -2.348 . . . . 10.0 110.668 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 16.2 m0 -123.41 171.19 9.63 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 124.818 1.247 . . . . 10.0 109.75 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 3.4 m -153.35 112.98 3.85 Favored 'General case' 0 C--O 1.212 -0.91 0 N-CA-C 106.466 -1.679 . . . . 10.0 106.466 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -93.81 170.64 9.41 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 122.252 1.025 . . . . 10.0 112.567 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 2.0 t90 -176.37 108.56 0.08 Allowed 'General case' 0 C--O 1.219 -0.525 0 N-CA-C 106.935 -1.506 . . . . 10.0 106.935 179.936 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 54.1 mt -92.6 129.63 42.9 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 CA-C-O 124.275 1.988 . . . . 10.0 111.294 -179.827 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -110.48 -164.26 0.91 Allowed 'General case' 0 C--O 1.242 0.659 0 N-CA-C 106.803 -1.554 . . . . 10.0 106.803 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -96.78 108.06 3.61 Favored Glycine 0 CA--C 1.522 0.506 0 N-CA-C 107.541 -2.224 . . . . 10.0 107.541 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 78.25 12.29 1.7 Allowed 'General case' 0 C--O 1.214 -0.774 0 N-CA-C 108.461 -0.94 . . . . 10.0 108.461 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -149.79 149.88 31.18 Favored 'General case' 0 CA--C 1.509 -0.632 0 CA-C-O 123.195 1.474 . . . . 10.0 110.849 179.747 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.529 ' HB3' ' HB2' ' A' ' 130' ' ' PHE . 11.9 tp -116.83 121.27 41.03 Favored 'General case' 0 C--O 1.241 0.611 0 N-CA-C 104.3 -2.481 . . . . 10.0 104.3 -179.744 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 59.7 t-80 -114.13 117.14 30.38 Favored 'General case' 0 C--O 1.213 -0.849 0 N-CA-C 106.881 -1.526 . . . . 10.0 106.881 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.526 HD21 ' HG3' ' A' ' 119' ' ' MET . 0.6 OUTLIER -128.62 154.26 46.41 Favored 'General case' 0 CA--C 1.51 -0.567 0 O-C-N 126.0 2.063 . . . . 10.0 110.704 -179.987 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -143.36 126.48 16.46 Favored 'General case' 0 CA--C 1.495 -1.161 0 N-CA-C 106.747 -1.575 . . . . 10.0 106.747 179.647 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.526 ' HG3' HD21 ' A' ' 117' ' ' LEU . 28.7 mtp -107.97 126.75 53.08 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 113.68 -1.6 . . . . 10.0 113.006 179.929 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.611 ' HG3' HG23 ' A' ' 125' ' ' THR . 0.0 OUTLIER -125.82 142.38 51.54 Favored 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 118.725 -1.19 . . . . 10.0 110.17 -179.931 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -158.49 127.55 5.58 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.42 -0.956 . . . . 10.0 108.42 179.898 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 34.86 56.84 0.75 Allowed 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 117.881 2.548 . . . . 10.0 117.881 179.903 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 77.09 11.32 85.67 Favored Glycine 0 C--N 1.317 -0.482 0 N-CA-C 116.763 1.465 . . . . 10.0 116.763 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 22.5 t -124.26 130.81 73.55 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.335 0 N-CA-C 108.124 -1.065 . . . . 10.0 108.124 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 125' ' ' THR . . . . . 0.611 HG23 ' HG3' ' A' ' 120' ' ' ARG . 1.6 m -119.23 108.53 14.76 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 126.553 2.408 . . . . 10.0 114.152 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.51 144.59 25.45 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 106.331 -1.729 . . . . 10.0 106.331 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -144.55 179.49 7.25 Favored 'General case' 0 C--O 1.22 -0.454 0 O-C-N 125.414 1.696 . . . . 10.0 112.477 -179.947 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -169.76 145.25 3.0 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-N 114.45 -1.25 . . . . 10.0 108.402 -179.718 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -111.96 98.59 7.24 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 O-C-N 124.687 1.242 . . . . 10.0 108.007 179.769 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 130' ' ' PHE . . . . . 0.529 ' HB2' ' HB3' ' A' ' 115' ' ' LEU . 5.6 m-85 -74.0 169.67 17.01 Favored 'General case' 0 C--O 1.214 -0.767 0 O-C-N 125.734 1.896 . . . . 10.0 107.435 179.894 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.491 ' HD2' ' C ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -145.15 57.72 1.27 Allowed 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 122.999 1.38 . . . . 10.0 111.068 -179.76 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 132' ' ' LYS . . . . . 0.733 ' HB3' ' HA ' ' A' ' 8' ' ' TRP . 0.9 OUTLIER -162.14 -144.86 0.1 Allowed 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 104.728 -2.323 . . . . 10.0 104.728 179.588 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 133' ' ' VAL . . . . . 0.553 ' O ' HG13 ' A' ' 133' ' ' VAL . 0.4 OUTLIER 97.01 30.12 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.308 -1.201 0 O-C-N 127.708 3.13 . . . . 10.0 109.284 -179.911 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 51.1 t-80 . . . . . 0 N--CA 1.441 -0.879 0 CA-C-N 112.446 -2.161 . . . . 10.0 109.831 179.666 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 CA--C 1.538 0.518 0 N-CA-C 108.885 -0.784 . . . . 10.0 108.885 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.517 ' CZ ' HD12 ' A' ' 110' ' ' ILE . 3.4 m-30 -89.99 -16.9 28.89 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 117.211 2.3 . . . . 10.0 117.211 -179.905 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -39.28 146.27 0.09 Allowed 'General case' 0 C--O 1.244 0.787 0 O-C-N 126.358 2.287 . . . . 10.0 113.433 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -179.53 -138.02 3.17 Favored Glycine 0 C--O 1.227 -0.323 0 N-CA-C 118.573 2.189 . . . . 10.0 118.573 -179.902 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.433 ' CB ' HG12 ' A' ' 133' ' ' VAL . 50.0 m-85 -144.9 -175.88 4.85 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 119.604 -2.116 . . . . 10.0 106.616 -179.655 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.64 ' CE3' ' HB3' ' A' ' 39' ' ' ASP 0.287 11.5 p-90 -158.97 -177.32 6.42 Favored 'General case' 0 C--O 1.214 -0.766 0 N-CA-C 113.883 1.068 . . . . 10.0 113.883 -179.262 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.484 ' HD3' ' HB ' ' A' ' 133' ' ' VAL . 11.5 ptmt 157.3 97.67 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.557 0 O-C-N 127.663 3.102 . . . . 10.0 107.167 178.454 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.448 ' CE ' ' HB2' ' A' ' 13' ' ' ASN . 3.8 ppp? -61.01 139.32 58.08 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-O 117.711 -1.138 . . . . 10.0 112.29 -179.536 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.405 ' O ' HD23 ' A' ' 11' ' ' LEU . 1.1 tt -96.97 -38.27 9.86 Favored 'General case' 0 C--N 1.32 -0.68 0 O-C-N 125.876 1.985 . . . . 10.0 108.289 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -163.27 136.05 5.45 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 116.724 2.12 . . . . 10.0 116.724 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ASN . . . . . 0.448 ' HB2' ' CE ' ' A' ' 10' ' ' MET . 29.6 t30 -134.03 152.42 51.84 Favored 'General case' 0 C--O 1.239 0.538 0 O-C-N 125.888 1.992 . . . . 10.0 107.712 -179.795 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -173.76 170.66 3.93 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 118.612 -0.709 . . . . 10.0 112.372 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.463 ' HB2' ' HA ' ' A' ' 126' ' ' CYS . 6.0 m-20 66.95 20.6 10.48 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 127.644 2.377 . . . . 10.0 113.725 179.347 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -67.04 -30.72 70.88 Favored 'General case' 0 CA--C 1.548 0.876 0 CA-C-N 114.62 -1.173 . . . . 10.0 112.418 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -71.24 -42.46 68.82 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-O 122.395 1.093 . . . . 10.0 111.891 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -75.17 -25.14 58.08 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 114.108 -1.406 . . . . 10.0 107.262 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 10.2 t80 -75.5 -43.39 49.36 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 118.335 -0.84 . . . . 10.0 111.016 -179.669 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.475 HD22 HG21 ' A' ' 25' ' ' VAL . 50.6 mt -72.2 -21.84 61.36 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 113.02 0.748 . . . . 10.0 113.02 -179.621 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.4 ttm-85 -74.4 -24.68 59.15 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 114.49 -1.232 . . . . 10.0 108.833 179.809 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.16 -32.53 69.04 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 122.587 1.184 . . . . 10.0 110.607 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 51.5 mt -100.5 -7.92 23.67 Favored 'General case' 0 C--O 1.236 0.379 0 O-C-N 119.669 -1.894 . . . . 10.0 110.668 179.785 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.403 ' OD1' ' N ' ' A' ' 24' ' ' ASP . 0.3 OUTLIER 51.35 62.85 2.5 Favored 'General case' 0 C--O 1.245 0.864 0 O-C-N 124.085 0.865 . . . . 10.0 111.935 179.854 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.527 HG12 ' HB2' ' A' ' 78' ' ' ASP . 20.8 m -94.29 39.71 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 N-CA-C 104.054 -2.572 . . . . 10.0 104.054 179.959 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 65.55 154.63 0.08 Allowed 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 115.719 1.748 . . . . 10.0 115.719 -179.814 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 15.5 m -72.11 -22.07 20.91 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.656 0 N-CA-C 114.886 1.439 . . . . 10.0 114.886 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -73.65 -27.08 61.06 Favored 'General case' 0 C--O 1.234 0.28 0 O-C-N 124.838 1.336 . . . . 10.0 111.468 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.458 HD22 ' CG2' ' A' ' 25' ' ' VAL . 0.2 OUTLIER -76.27 -30.56 57.87 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 119.556 -0.858 . . . . 10.0 112.96 179.833 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.72 -22.89 61.56 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-O 124.189 1.947 . . . . 10.0 110.214 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.33 -41.51 33.42 Favored 'General case' 0 N--CA 1.444 -0.728 0 N-CA-C 107.384 -1.339 . . . . 10.0 107.384 -179.733 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.2 mp -72.58 -35.5 51.0 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.512 0 O-C-N 127.315 2.884 . . . . 10.0 110.499 -179.742 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.32 -31.05 43.09 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 113.18 -1.827 . . . . 10.0 113.22 179.804 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -56.97 -30.57 64.2 Favored 'General case' 0 C--N 1.318 -0.765 0 O-C-N 119.753 -1.842 . . . . 10.0 115.213 179.672 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -110.81 40.59 1.98 Allowed 'General case' 0 C--N 1.322 -0.596 0 O-C-N 124.563 1.164 . . . . 10.0 109.511 179.877 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -117.08 131.56 56.89 Favored 'General case' 0 CA--C 1.515 -0.396 0 C-N-CA 124.386 1.074 . . . . 10.0 109.686 179.952 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -143.97 100.79 4.96 Favored Pre-proline 0 N--CA 1.47 0.546 0 N-CA-C 106.776 -1.564 . . . . 10.0 106.776 179.821 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -98.94 168.47 0.56 Allowed 'Trans proline' 0 N--CA 1.447 -1.247 0 C-N-CA 124.606 3.537 . . . . 10.0 116.458 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.64 ' HB3' ' CE3' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -121.87 -174.29 2.84 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 105.723 -1.955 . . . . 10.0 105.723 -179.725 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.449 ' HB2' ' CE2' ' A' ' 130' ' ' PHE . 2.5 mttt -156.48 105.56 2.27 Favored 'General case' 0 CA--C 1.501 -0.923 0 C-N-CA 118.475 -1.29 . . . . 10.0 112.833 -179.944 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -97.64 107.86 20.45 Favored 'General case' 0 C--N 1.341 0.234 0 N-CA-C 102.682 -3.081 . . . . 10.0 102.682 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.522 HG23 HD12 ' A' ' 51' ' ' ILE . 86.0 mt -89.27 141.68 13.95 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.022 0 CA-C-O 118.845 -0.598 . . . . 10.0 110.511 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -134.8 158.97 41.79 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 O-C-N 124.727 1.267 . . . . 10.0 107.677 -179.883 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.445 ' HG3' ' CB ' ' A' ' 48' ' ' HIS . 0.0 OUTLIER -129.41 136.93 50.57 Favored 'General case' 0 C--N 1.323 -0.584 0 O-C-N 125.961 2.038 . . . . 10.0 111.566 -179.653 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -133.8 -143.94 0.22 Allowed 'General case' 0 C--O 1.243 0.739 0 CA-C-O 114.776 -2.535 . . . . 10.0 107.791 -179.723 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -42.1 138.28 2.59 Favored Glycine 0 CA--C 1.534 1.237 0 N-CA-C 104.587 -3.405 . . . . 10.0 104.587 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.54 ' CB ' ' HB3' ' A' ' 65' ' ' GLN . 11.3 m-20 59.19 -115.2 0.76 Allowed 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 102.595 -3.113 . . . . 10.0 102.595 -176.82 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' HIS . . . . . 0.529 ' CE1' ' HB ' ' A' ' 66' ' ' VAL . 0.0 OUTLIER 164.27 85.04 0.0 OUTLIER 'General case' 0 CA--C 1.5 -0.97 0 O-C-N 126.487 2.367 . . . . 10.0 112.611 175.31 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.7 ' HE2' HD21 ' A' ' 93' ' ' LEU . 36.4 ttm -169.38 83.07 0.13 Allowed 'General case' 0 N--CA 1.435 -1.22 0 N-CA-C 115.771 1.767 . . . . 10.0 115.771 175.416 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.566 HD12 ' C ' ' A' ' 49' ' ' MET . 1.3 mp -117.46 107.22 21.64 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.172 0 N-CA-C 102.208 -3.256 . . . . 10.0 102.208 179.533 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.522 HD12 HG23 ' A' ' 42' ' ' ILE . 0.2 OUTLIER -106.3 108.12 24.35 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.952 0 N-CA-C 109.243 -0.651 . . . . 10.0 109.243 -179.999 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.461 ' HG3' HD13 ' A' ' 61' ' ' ILE . 19.9 ttp180 -101.55 110.24 22.2 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.694 -1.139 . . . . 10.0 113.519 -179.94 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 20.7 m -97.77 122.93 41.45 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 102.24 -3.244 . . . . 10.0 102.24 -179.819 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -125.83 61.62 1.25 Allowed 'General case' 0 C--N 1.324 -0.51 1 N-CA-C 121.917 4.043 . . . . 10.0 121.917 -179.795 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.0 m -65.5 -175.94 0.3 Allowed 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 125.908 1.683 . . . . 10.0 107.976 -179.755 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 58.7 p -105.15 -20.93 13.36 Favored 'General case' 0 C--O 1.242 0.69 0 CA-C-O 117.388 -1.291 . . . . 10.0 109.927 179.698 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -73.48 -56.64 4.78 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 122.892 1.329 . . . . 10.0 108.609 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.42 -165.06 1.9 Allowed 'General case' 0 C--O 1.244 0.814 0 CA-C-N 114.183 -1.371 . . . . 10.0 110.089 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -156.84 133.28 9.94 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-O 123.965 1.841 . . . . 10.0 111.849 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -109.9 125.48 52.85 Favored 'General case' 0 CA--C 1.501 -0.929 0 N-CA-C 102.398 -3.186 . . . . 10.0 102.398 179.751 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.461 HD13 ' HG3' ' A' ' 52' ' ' ARG . 1.1 mt -132.73 158.46 43.28 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.706 0 O-C-N 118.237 -2.789 . . . . 10.0 116.102 -179.663 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -141.23 155.23 46.05 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 104.406 -2.442 . . . . 10.0 104.406 -179.911 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -131.67 69.61 1.47 Allowed 'General case' 0 C--N 1.311 -1.066 1 N-CA-C 99.436 -4.283 . . . . 10.0 99.436 179.884 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.467 ' HB3' ' HB3' ' A' ' 49' ' ' MET . 2.2 m-85 -69.78 -172.91 0.55 Allowed 'General case' 0 C--O 1.241 0.657 0 CA-C-N 113.383 -1.735 . . . . 10.0 113.546 179.772 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.54 ' HB3' ' CB ' ' A' ' 47' ' ' ASP . 7.8 mt-30 -171.58 121.32 0.5 Allowed 'General case' 0 C--N 1.317 -0.838 0 C-N-CA 128.001 2.52 . . . . 10.0 107.092 -179.404 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.529 ' HB ' ' CE1' ' A' ' 48' ' ' HIS . 24.8 t -58.89 156.32 2.29 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 C-N-CA 125.961 1.704 . . . . 10.0 113.231 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.453 ' N ' ' CG1' ' A' ' 66' ' ' VAL . . . 63.58 11.26 41.02 Favored Glycine 0 C--O 1.218 -0.889 0 N-CA-C 118.38 2.112 . . . . 10.0 118.38 179.791 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 9.0 tttp -124.26 148.63 47.23 Favored 'General case' 0 C--O 1.22 -0.459 0 CA-C-N 118.105 0.953 . . . . 10.0 112.241 179.901 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 53.4 tt0 -91.12 136.58 32.99 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 125.402 1.688 . . . . 10.0 109.076 -179.807 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -122.53 179.02 4.74 Favored 'General case' 0 C--N 1.318 -0.797 0 C-N-CA 124.566 1.146 . . . . 10.0 108.358 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -154.03 67.98 0.75 Allowed 'General case' 0 C--N 1.317 -0.811 0 O-C-N 127.205 2.815 . . . . 10.0 111.198 -179.754 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -51.71 126.7 18.52 Favored 'General case' 0 N--CA 1.442 -0.847 0 N-CA-C 112.355 0.502 . . . . 10.0 112.355 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.41 ' OD2' HD12 ' A' ' 74' ' ' LEU . 5.3 p-10 -70.68 -20.02 62.73 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.785 0.802 . . . . 10.0 110.227 179.959 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.74 HD13 ' O ' ' A' ' 74' ' ' LEU . 0.0 OUTLIER -156.75 127.46 6.69 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 116.395 1.998 . . . . 10.0 116.395 -179.959 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.592 ' N ' ' HA ' ' A' ' 79' ' ' ASP . 18.3 m -96.43 123.59 40.14 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-O 124.116 1.913 . . . . 10.0 111.194 -179.591 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 52.48 -133.22 39.05 Favored Glycine 0 N--CA 1.441 -0.994 0 N-CA-C 107.172 -2.371 . . . . 10.0 107.172 179.797 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.803 ' O ' HD12 ' A' ' 77' ' ' ILE . 0.9 OUTLIER -107.38 -11.85 10.48 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 N-CA-C 106.843 -1.54 . . . . 10.0 106.843 179.374 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.527 ' HB2' HG12 ' A' ' 25' ' ' VAL . 0.2 OUTLIER -82.17 -4.97 58.09 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-N 113.67 -1.604 . . . . 10.0 109.262 179.848 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.592 ' HA ' ' N ' ' A' ' 75' ' ' THR . 4.0 m-20 39.68 -128.15 0.35 Allowed 'General case' 0 C--N 1.316 -0.88 0 C-N-CA 128.314 2.646 . . . . 10.0 115.953 -179.596 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 16.9 ttt85 84.8 114.37 0.05 Allowed 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 120.481 1.491 . . . . 10.0 107.231 -179.432 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 5.4 mmtp -57.19 141.84 44.96 Favored 'General case' 0 C--N 1.316 -0.873 0 O-C-N 127.156 2.785 . . . . 10.0 105.583 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 72.8 m -152.12 149.66 29.04 Favored 'General case' 0 C--O 1.213 -0.86 0 O-C-N 125.412 1.695 . . . . 10.0 109.601 -179.866 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.6 mtm -100.69 114.54 28.36 Favored 'General case' 0 C--O 1.241 0.617 1 N-CA-C 100.163 -4.014 . . . . 10.0 100.163 179.869 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 98.8 m -112.12 135.53 52.66 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 115.844 1.794 . . . . 10.0 115.844 179.734 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -131.3 145.22 51.79 Favored 'General case' 0 C--N 1.343 0.287 0 N-CA-C 108.134 -1.061 . . . . 10.0 108.134 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.489 HG11 ' HE3' ' A' ' 49' ' ' MET . 1.2 t -113.23 172.88 3.1 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.986 0 N-CA-C 104.02 -2.585 . . . . 10.0 104.02 179.887 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -169.49 169.11 9.05 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 120.526 1.512 . . . . 10.0 113.96 179.783 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -106.81 122.62 46.76 Favored 'General case' 0 C--O 1.224 -0.24 0 O-C-N 125.844 1.965 . . . . 10.0 106.905 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.424 ' HB3' ' HB2' ' A' ' 92' ' ' LYS . 24.5 t0 -107.69 3.89 25.15 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 101.381 -3.563 . . . . 10.0 101.381 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 111.47 -96.46 0.88 Allowed Glycine 0 C--O 1.24 0.51 0 N-CA-C 104.066 -3.614 . . . . 10.0 104.066 -179.719 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 8.9 p30 -84.83 -35.78 22.06 Favored 'General case' 0 C--O 1.222 -0.373 0 C-N-CA 119.641 -0.824 . . . . 10.0 109.657 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.424 ' HB2' ' HB3' ' A' ' 89' ' ' ASP . 1.6 mtmm -82.17 142.6 32.07 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 124.009 0.924 . . . . 10.0 111.843 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.7 HD21 ' HE2' ' A' ' 49' ' ' MET . 9.8 tp -119.22 100.72 7.5 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 104.254 -2.499 . . . . 10.0 104.254 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 94' ' ' GLN . . . . . 0.444 ' HB3' HG23 ' A' ' 107' ' ' THR . 10.6 pt20 -123.92 168.07 13.28 Favored 'General case' 0 CA--C 1.497 -1.073 0 N-CA-C 114.985 1.476 . . . . 10.0 114.985 179.836 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 19.9 p -131.67 -173.03 3.01 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-N 113.547 -1.66 . . . . 10.0 110.026 179.692 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.4 HG12 ' N ' ' A' ' 97' ' ' GLN . 7.0 t -134.76 -74.08 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.744 0 C-N-CA 125.062 1.345 . . . . 10.0 109.475 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.4 ' N ' HG12 ' A' ' 96' ' ' VAL . 21.7 mt-30 87.78 118.45 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.569 0 O-C-N 127.273 2.858 . . . . 10.0 110.423 179.908 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.8 mmtt -88.96 114.2 25.32 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 125.386 1.474 . . . . 10.0 114.247 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' GLY . . . . . 0.505 ' N ' HH22 ' A' ' 104' ' ' ARG . . . -153.32 -160.05 9.47 Favored Glycine 0 CA--C 1.523 0.573 0 N-CA-C 108.753 -1.739 . . . . 10.0 108.753 -179.911 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 14.4 tm-20 -86.63 -14.51 42.5 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 116.645 2.091 . . . . 10.0 116.645 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 15.3 mmtt -81.78 178.44 8.32 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 113.273 0.842 . . . . 10.0 113.273 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 3.7 pm0 -121.71 28.89 7.42 Favored 'General case' 0 CA--C 1.509 -0.6 0 C-N-CA 125.933 1.693 . . . . 10.0 110.517 179.92 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -159.19 -18.4 0.03 OUTLIER Glycine 0 N--CA 1.462 0.383 0 CA-C-O 116.554 -2.248 . . . . 10.0 118.481 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.505 HH22 ' N ' ' A' ' 99' ' ' GLY . 24.0 mtm-85 -47.4 144.82 2.75 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 120.209 2.004 . . . . 10.0 109.017 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 129.65 152.11 7.47 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 107.592 -2.203 . . . . 10.0 107.592 -179.786 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -124.95 -170.97 2.26 Favored 'General case' 0 C--O 1.239 0.531 0 C-N-CA 125.223 1.409 . . . . 10.0 109.916 179.713 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 107' ' ' THR . . . . . 0.444 HG23 ' HB3' ' A' ' 94' ' ' GLN . 3.1 m -161.39 117.75 2.18 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-O 117.307 -1.33 . . . . 10.0 109.55 179.724 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 -93.45 128.17 39.42 Favored 'General case' 0 C--N 1.318 -0.772 0 O-C-N 126.796 2.56 . . . . 10.0 107.287 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 4.5 t90 -139.55 101.47 4.23 Favored 'General case' 0 CA--C 1.511 -0.521 0 O-C-N 120.505 -1.372 . . . . 10.0 112.271 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.517 HD12 ' CZ ' ' A' ' 4' ' ' PHE . 72.2 mt -85.64 119.4 34.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 O-C-N 126.405 2.316 . . . . 10.0 114.069 179.689 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -132.25 148.09 52.44 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 104.301 -2.481 . . . . 10.0 104.301 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 26.73 -103.16 0.01 OUTLIER Glycine 0 N--CA 1.445 -0.737 0 O-C-N 128.161 3.413 . . . . 10.0 111.926 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -116.05 24.77 11.19 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 125.766 1.509 . . . . 10.0 112.251 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.485 ' C ' HD23 ' A' ' 115' ' ' LEU . 0.1 OUTLIER -139.99 163.19 33.33 Favored 'General case' 0 CA--C 1.501 -0.912 0 CA-C-O 123.502 1.62 . . . . 10.0 114.13 -179.995 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.485 HD23 ' C ' ' A' ' 114' ' ' GLU . 4.5 mt -124.6 108.78 12.42 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 104.781 -2.303 . . . . 10.0 104.781 -179.959 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -94.85 73.95 3.57 Favored 'General case' 0 C--N 1.313 -1.006 0 C-N-CA 119.332 -0.947 . . . . 10.0 109.33 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.525 HD22 ' HB2' ' A' ' 128' ' ' GLN . 8.9 tt -66.89 153.68 42.88 Favored 'General case' 0 N--CA 1.45 -0.456 0 O-C-N 126.355 2.285 . . . . 10.0 112.71 179.79 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -141.51 138.49 32.81 Favored 'General case' 0 C--O 1.214 -0.807 0 O-C-N 125.037 1.461 . . . . 10.0 109.986 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -136.21 121.44 19.12 Favored 'General case' 0 C--N 1.322 -0.596 0 O-C-N 124.738 1.274 . . . . 10.0 111.013 179.781 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -123.19 152.99 40.69 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 114.842 -1.072 . . . . 10.0 111.161 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -165.07 130.38 2.62 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 104.829 -2.286 . . . . 10.0 104.829 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 47.22 30.27 1.4 Allowed 'General case' 0 C--N 1.321 -0.672 0 O-C-N 125.345 1.653 . . . . 10.0 111.977 -179.884 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 86.58 -8.41 75.21 Favored Glycine 0 CA--C 1.535 1.335 0 C-N-CA 119.604 -1.284 . . . . 10.0 114.497 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 22.1 t -86.08 124.24 40.12 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 CA-C-N 118.723 1.262 . . . . 10.0 108.517 -179.787 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 5.4 m -103.42 120.6 41.14 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-O 123.943 1.83 . . . . 10.0 114.39 -179.813 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 126' ' ' CYS . . . . . 0.463 ' HA ' ' HB2' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -124.92 129.4 50.29 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 112.443 -2.162 . . . . 10.0 105.272 179.996 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -115.46 173.77 6.35 Favored 'General case' 0 C--O 1.24 0.597 0 N-CA-C 115.319 1.6 . . . . 10.0 115.319 179.784 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 128' ' ' GLN . . . . . 0.525 ' HB2' HD22 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -151.87 88.71 1.41 Allowed 'General case' 0 CA--C 1.512 -0.519 0 CA-C-N 113.012 -1.904 . . . . 10.0 110.3 179.832 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 38.5 t -70.17 119.13 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 N-CA-C 104.874 -2.269 . . . . 10.0 104.874 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 130' ' ' PHE . . . . . 0.449 ' CE2' ' HB2' ' A' ' 40' ' ' LYS . 0.3 OUTLIER -101.03 174.86 5.81 Favored 'General case' 0 C--O 1.218 -0.562 0 CA-C-O 123.687 1.708 . . . . 10.0 108.94 179.758 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 2.3 tptm -143.22 88.88 2.05 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 113.578 -1.646 . . . . 10.0 106.616 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 22.9 ttpt -65.08 98.0 0.28 Allowed 'General case' 0 CA--C 1.504 -0.796 0 C-N-CA 118.008 -1.477 . . . . 10.0 107.709 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 133' ' ' VAL . . . . . 0.495 HG13 ' N ' ' A' ' 134' ' ' HIS . 7.1 p -53.66 -37.25 31.0 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.353 0 CA-C-N 114.417 -1.265 . . . . 10.0 110.209 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 134' ' ' HIS . . . . . 0.495 ' N ' HG13 ' A' ' 133' ' ' VAL . 1.9 t-160 . . . . . 0 N--CA 1.438 -1.064 0 O-C-N 126.049 2.093 . . . . 10.0 111.511 -179.981 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.217 -0.611 0 CA-C-O 118.0 -1.0 . . . . 10.0 111.751 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.412 ' CE2' ' CD1' ' A' ' 93' ' ' LEU . 19.8 m-30 -90.11 -9.67 47.49 Favored 'General case' 0 C--N 1.319 -0.74 0 O-C-N 127.881 3.238 . . . . 10.0 116.326 -179.906 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 71.8 m-20 -43.57 143.8 0.9 Allowed 'General case' 0 N--CA 1.471 0.619 0 O-C-N 127.253 2.845 . . . . 10.0 111.905 179.97 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 6' ' ' GLY . . . . . 0.429 ' HA2' ' HA ' ' A' ' 134' ' ' HIS . . . -146.58 -177.49 21.23 Favored Glycine 0 C--N 1.346 1.12 0 N-CA-C 119.669 2.628 . . . . 10.0 119.669 -179.569 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -151.48 46.44 0.8 Allowed 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 103.839 -2.652 . . . . 10.0 103.839 -179.582 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.618 ' CZ3' ' CB ' ' A' ' 39' ' ' ASP 0.397 30.2 p-90 -37.61 169.61 0.0 OUTLIER 'General case' 0 C--O 1.211 -0.931 0 C-N-CA 127.19 2.196 . . . . 10.0 115.272 179.331 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.509 ' HE3' ' HB2' ' A' ' 132' ' ' LYS . 0.0 OUTLIER -157.55 150.49 23.26 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 111.633 -2.531 . . . . 10.0 104.473 174.976 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.3 ppp? -106.4 168.37 9.2 Favored 'General case' 0 C--O 1.24 0.561 0 O-C-N 119.834 -1.791 . . . . 10.0 112.67 -179.777 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -137.3 -59.9 0.68 Allowed 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 105.719 -1.956 . . . . 10.0 105.719 -179.902 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 61.8 p -161.85 173.68 14.21 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 124.689 2.185 . . . . 10.0 112.623 179.771 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 13' ' ' ASN . . . . . 0.42 ' OD1' ' N ' ' A' ' 13' ' ' ASN . 3.1 p-10 -126.16 161.35 27.87 Favored 'General case' 0 CA--C 1.513 -0.481 0 CA-C-N 112.67 -2.059 . . . . 10.0 108.088 -179.597 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 35.9 tp10 -149.0 134.8 18.86 Favored 'General case' 0 C--O 1.215 -0.722 0 O-C-N 119.539 -1.975 . . . . 10.0 113.519 179.676 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 61.25 27.84 17.49 Favored 'General case' 0 C--O 1.244 0.78 0 C-N-CA 125.015 1.326 . . . . 10.0 111.846 -179.958 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.497 ' CD2' HD11 ' A' ' 20' ' ' LEU . 40.2 t80 -69.16 -27.62 65.69 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 114.797 1.406 . . . . 10.0 114.797 -179.399 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -76.61 -29.07 56.37 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 120.205 -1.559 . . . . 10.0 112.778 179.916 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -79.37 -28.18 41.94 Favored 'General case' 0 C--O 1.219 -0.505 0 CA-C-N 114.512 -1.222 . . . . 10.0 109.445 -179.948 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.6 ' CE1' HD11 ' A' ' 23' ' ' LEU . 0.2 OUTLIER -65.9 -43.67 87.55 Favored 'General case' 0 CA--C 1.555 1.172 0 O-C-N 125.489 1.743 . . . . 10.0 108.978 -179.998 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.503 ' CD1' ' HG3' ' A' ' 30' ' ' ARG . 0.7 OUTLIER -76.82 -23.22 52.8 Favored 'General case' 0 C--O 1.22 -0.462 0 O-C-N 126.146 2.154 . . . . 10.0 112.609 179.707 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.89 -26.01 40.39 Favored 'General case' 0 C--N 1.321 -0.662 0 O-C-N 126.224 2.202 . . . . 10.0 108.816 179.531 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.403 ' HB1' ' HB3' ' A' ' 122' ' ' GLU . . . -69.89 -27.64 64.97 Favored 'General case' 0 C--O 1.218 -0.57 0 C-N-CA 125.976 1.711 . . . . 10.0 112.984 179.781 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.6 HD11 ' CE1' ' A' ' 19' ' ' TYR . 0.0 OUTLIER -113.27 9.64 18.37 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 114.197 -1.365 . . . . 10.0 109.886 179.567 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 38.41 72.19 0.14 Allowed 'General case' 0 C--N 1.322 -0.6 0 O-C-N 126.697 2.498 . . . . 10.0 114.957 179.466 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 3.8 m -88.78 170.05 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-O 117.027 -1.463 . . . . 10.0 108.841 -179.661 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 9.0 m120 -53.98 152.63 5.58 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 117.913 -1.042 . . . . 10.0 111.502 179.48 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 2.5 p -71.6 -23.1 22.29 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.855 0 N-CA-C 117.284 2.327 . . . . 10.0 117.284 -179.632 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -79.82 -32.04 40.67 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 114.43 -1.259 . . . . 10.0 109.919 -179.806 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 54.3 tp -70.75 -44.72 66.18 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 114.64 1.348 . . . . 10.0 114.64 -179.732 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.503 ' HG3' ' CD1' ' A' ' 20' ' ' LEU . 18.4 ttp180 -56.86 -36.72 70.37 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 126.254 1.822 . . . . 10.0 114.377 179.813 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.87 -32.66 61.93 Favored 'General case' 0 C--O 1.218 -0.585 0 O-C-N 126.274 2.234 . . . . 10.0 110.588 179.806 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 20.7 mm -77.41 -41.04 29.52 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.453 0 O-C-N 125.489 1.743 . . . . 10.0 109.261 -179.739 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -80.35 -6.25 57.69 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.785 -0.643 . . . . 10.0 112.399 179.828 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -93.46 -30.42 15.06 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 115.294 1.59 . . . . 10.0 115.294 -179.785 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -92.33 -14.06 29.32 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 120.017 1.281 . . . . 10.0 110.456 179.893 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.4 HD11 ' HB3' ' A' ' 57' ' ' PHE . 0.0 OUTLIER -80.42 118.26 21.89 Favored 'General case' 0 CA--C 1.514 -0.423 0 C-N-CA 125.677 1.591 . . . . 10.0 109.468 -179.735 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.7 135.75 19.7 Favored Pre-proline 0 C--N 1.318 -0.783 0 N-CA-C 106.495 -1.668 . . . . 10.0 106.495 -179.975 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_exo -90.7 179.18 1.83 Allowed 'Trans proline' 0 N--CA 1.447 -1.258 0 C-N-CA 124.268 3.312 . . . . 10.0 119.545 -179.443 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.618 ' CB ' ' CZ3' ' A' ' 8' ' ' TRP . 0.3 OUTLIER -149.39 143.84 26.0 Favored 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 127.636 2.375 . . . . 10.0 104.724 179.72 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.573 ' C ' ' CD1' ' A' ' 8' ' ' TRP . 1.2 tptt -97.56 -143.22 0.3 Allowed 'General case' 0 C--N 1.305 -1.335 0 CA-C-O 114.672 -2.585 . . . . 10.0 106.905 -179.42 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.544 ' HA ' ' CD1' ' A' ' 8' ' ' TRP . 0.2 OUTLIER 152.92 117.32 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.938 0 O-C-N 127.728 3.143 . . . . 10.0 102.77 178.586 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 6.3 mm -121.86 145.76 28.01 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.981 0 O-C-N 124.701 1.251 . . . . 10.0 113.602 179.451 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 67.0 t -147.48 100.36 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 O-C-N 125.911 2.007 . . . . 10.0 106.35 179.898 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -112.01 116.91 31.33 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 124.668 1.187 . . . . 10.0 108.665 179.862 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -118.86 125.73 50.18 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 104.799 -2.297 . . . . 10.0 104.799 -179.942 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 61.32 -115.29 7.68 Favored Glycine 0 C--O 1.223 -0.532 0 N-CA-C 108.951 -1.66 . . . . 10.0 108.951 -179.723 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -112.58 -20.84 11.57 Favored 'General case' 0 C--N 1.321 -0.652 0 O-C-N 121.693 -0.887 . . . . 10.0 110.609 -179.854 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 46.1 m170 -82.45 119.08 23.74 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 107.802 -1.184 . . . . 10.0 107.802 -179.954 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 17.5 ttp -104.21 155.18 18.95 Favored 'General case' 0 C--N 1.32 -0.684 0 O-C-N 126.664 2.478 . . . . 10.0 114.454 179.961 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 4.8 mt -145.7 122.8 4.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 106.419 -1.697 . . . . 10.0 106.419 -179.937 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.5 mp -119.23 131.41 72.0 Favored 'Isoleucine or valine' 0 C--O 1.242 0.699 0 N-CA-C 104.683 -2.34 . . . . 10.0 104.683 179.823 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.84 98.66 6.01 Favored 'General case' 0 N--CA 1.442 -0.872 0 CA-C-N 114.971 -1.013 . . . . 10.0 111.571 -179.76 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 89.2 m -72.33 139.88 48.2 Favored 'General case' 0 C--O 1.219 -0.538 0 N-CA-C 101.784 -3.413 . . . . 10.0 101.784 179.983 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.2 mt -113.11 54.74 0.72 Allowed 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 119.902 3.297 . . . . 10.0 119.902 -179.886 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 64.8 m -93.38 131.01 38.95 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 104.04 -2.578 . . . . 10.0 104.04 -179.757 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -69.51 -13.34 62.29 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 123.236 1.493 . . . . 10.0 107.727 -179.848 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.4 ' HB3' HD11 ' A' ' 36' ' ' LEU . 28.5 t80 -95.22 84.17 4.02 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 106.799 -1.556 . . . . 10.0 106.799 179.954 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.42 ' CZ ' ' HB3' ' A' ' 58' ' ' ARG . 0.0 OUTLIER 50.95 80.11 0.08 Allowed 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 114.471 1.286 . . . . 10.0 114.471 -179.822 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 59' ' ' ASN . . . . . 0.401 ' OD1' ' N ' ' A' ' 59' ' ' ASN . 4.8 p-10 -71.94 90.62 1.15 Allowed 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 113.747 -1.57 . . . . 10.0 112.206 179.787 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 25.6 p90 -75.32 130.1 38.5 Favored 'General case' 0 C--N 1.321 -0.648 0 O-C-N 126.638 2.461 . . . . 10.0 105.483 -179.854 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.471 HG22 ' N ' ' A' ' 62' ' ' MET . 6.2 mm -104.34 164.28 3.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 O-C-N 121.409 -0.807 . . . . 10.0 111.277 -179.716 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 62' ' ' MET . . . . . 0.471 ' N ' HG22 ' A' ' 61' ' ' ILE . 27.7 mmm -144.78 150.98 38.13 Favored 'General case' 0 N--CA 1.442 -0.827 0 N-CA-C 107.291 -1.374 . . . . 10.0 107.291 179.992 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -133.52 88.5 2.49 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 103.684 -2.71 . . . . 10.0 103.684 179.953 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -76.34 178.47 6.49 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 119.619 -1.926 . . . . 10.0 114.474 179.961 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 10.5 mt-30 -147.35 113.98 6.03 Favored 'General case' 0 C--N 1.315 -0.893 0 O-C-N 128.764 3.79 . . . . 10.0 103.187 -179.86 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -62.05 137.52 23.88 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 O-C-N 124.38 1.05 . . . . 10.0 113.721 -179.846 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.99 -25.16 0.67 Allowed Glycine 0 C--O 1.218 -0.869 0 CA-C-O 117.025 -1.986 . . . . 10.0 116.281 179.804 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 15.2 mttp -91.78 160.33 15.38 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 120.492 2.146 . . . . 10.0 116.7 -179.777 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -69.05 158.74 34.2 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 107.947 -1.131 . . . . 10.0 107.947 -179.955 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 45.9 t80 -165.95 113.11 0.91 Allowed 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 113.994 -1.457 . . . . 10.0 113.24 -179.583 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -79.73 145.84 32.7 Favored 'General case' 0 C--N 1.314 -0.955 0 O-C-N 125.181 1.551 . . . . 10.0 107.525 -179.79 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.646 ' OE2' HD23 ' A' ' 74' ' ' LEU . 13.8 tt0 -107.1 -42.24 4.93 Favored 'General case' 0 C--O 1.24 0.591 0 N-CA-C 117.193 2.294 . . . . 10.0 117.193 -179.922 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.434 ' HA ' ' HA ' ' A' ' 81' ' ' LYS . 6.3 t70 53.08 35.95 20.97 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.467 0.651 . . . . 10.0 110.695 179.777 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.646 HD23 ' OE2' ' A' ' 72' ' ' GLU . 0.3 OUTLIER -46.28 117.54 1.61 Allowed 'General case' 0 C--N 1.32 -0.708 0 O-C-N 120.555 -1.341 . . . . 10.0 114.167 179.894 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -129.32 8.24 5.48 Favored 'General case' 0 CA--C 1.514 -0.418 0 O-C-N 121.61 -0.681 . . . . 10.0 109.909 179.956 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 76' ' ' GLY . . . . . 0.439 ' H ' HD13 ' A' ' 74' ' ' LEU . . . -78.94 -43.54 10.95 Favored Glycine 0 CA--C 1.5 -0.902 0 CA-C-O 117.505 -1.719 . . . . 10.0 110.453 -179.749 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.7 pp -142.44 142.2 27.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 CA-C-N 118.775 1.287 . . . . 10.0 107.917 179.848 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 75.34 -59.02 0.55 Allowed 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.639 0.733 . . . . 10.0 111.632 179.709 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 87.06 82.77 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 115.44 1.645 . . . . 10.0 115.44 179.926 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 3.4 ptt85 -155.32 143.29 19.99 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 113.985 -1.462 . . . . 10.0 111.026 179.767 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.434 ' HA ' ' HA ' ' A' ' 73' ' ' ASP . 4.3 ptpp? -95.21 175.81 6.46 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 103.731 -2.692 . . . . 10.0 103.731 179.894 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 6.0 p -177.84 158.72 1.32 Allowed 'General case' 0 C--O 1.213 -0.82 0 N-CA-C 106.344 -1.725 . . . . 10.0 106.344 179.824 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.6 ttm -105.57 117.83 35.01 Favored 'General case' 0 C--N 1.329 -0.323 1 N-CA-C 98.683 -4.562 . . . . 10.0 98.683 179.998 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 43.0 m -121.24 124.09 43.81 Favored 'General case' 0 C--O 1.215 -0.745 0 CA-C-N 112.068 -2.333 . . . . 10.0 117.113 -179.743 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.53 121.52 36.73 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 114.397 -1.274 . . . . 10.0 108.065 179.919 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 13.8 t -98.01 104.89 16.49 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.875 0 N-CA-C 105.488 -2.041 . . . . 10.0 105.488 -179.819 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -110.59 -178.65 3.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 122.238 1.018 . . . . 10.0 113.358 179.956 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 19.0 m0 -111.91 134.24 53.6 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 112.883 -1.962 . . . . 10.0 107.446 179.75 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -102.95 -58.94 1.79 Allowed 'General case' 0 C--O 1.246 0.892 0 N-CA-C 102.879 -3.008 . . . . 10.0 102.879 179.954 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 157.73 90.01 0.07 OUTLIER Glycine 0 CA--C 1.504 -0.614 0 N-CA-C 105.96 -2.856 . . . . 10.0 105.96 179.819 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 65.9 47.0 2.12 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 108.084 -1.08 . . . . 10.0 108.084 -179.904 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 25.6 mtmt -169.37 124.63 0.85 Allowed 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 125.51 1.524 . . . . 10.0 108.724 -179.991 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.412 ' CD1' ' CE2' ' A' ' 4' ' ' PHE . 0.3 OUTLIER -82.71 77.56 9.45 Favored 'General case' 0 CA--C 1.515 -0.394 0 O-C-N 126.451 2.344 . . . . 10.0 107.576 179.934 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.59 105.88 7.91 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 114.561 -1.199 . . . . 10.0 112.487 -179.982 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -108.45 138.48 44.68 Favored 'General case' 0 C--N 1.341 0.23 0 O-C-N 125.129 1.518 . . . . 10.0 112.598 -179.912 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 40.9 t -125.57 131.93 71.52 Favored 'Isoleucine or valine' 0 C--O 1.242 0.67 0 CA-C-O 124.457 2.075 . . . . 10.0 109.367 179.711 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.438 ' CG ' ' HA2' ' A' ' 105' ' ' GLY . 0.0 OUTLIER -134.95 141.2 46.21 Favored 'General case' 0 C--O 1.242 0.678 0 O-C-N 120.231 -1.543 . . . . 10.0 107.159 179.876 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 9.9 pttp -149.33 110.89 4.49 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 122.586 1.184 . . . . 10.0 111.08 179.988 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -163.37 74.49 0.18 Allowed Glycine 0 C--O 1.221 -0.691 0 O-C-N 119.653 -1.904 . . . . 10.0 112.135 -179.958 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 94.6 23.33 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.579 0 O-C-N 127.458 2.505 . . . . 10.0 115.024 179.791 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.427 ' CE ' ' HA ' ' A' ' 101' ' ' LYS . 0.0 OUTLIER -139.33 -155.49 0.6 Allowed 'General case' 0 N--CA 1.471 0.585 0 O-C-N 126.379 2.3 . . . . 10.0 110.982 -179.948 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -136.77 -57.24 0.73 Allowed 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 125.309 1.443 . . . . 10.0 113.564 -179.979 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -109.31 42.5 1.94 Allowed Glycine 0 N--CA 1.449 -0.436 0 N-CA-C 119.333 2.493 . . . . 10.0 119.333 -179.808 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 3.1 mtm180 -88.18 168.02 13.11 Favored 'General case' 0 C--O 1.244 0.805 0 O-C-N 120.71 -1.465 . . . . 10.0 110.805 -179.961 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 105' ' ' GLY . . . . . 0.438 ' HA2' ' CG ' ' A' ' 97' ' ' GLN . . . 120.96 139.02 5.63 Favored Glycine 0 N--CA 1.45 -0.426 0 N-CA-C 108.638 -1.785 . . . . 10.0 108.638 -179.819 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 106' ' ' TRP . . . . . 0.48 ' CD1' ' CG ' ' A' ' 119' ' ' MET . 3.1 m0 -104.93 176.5 5.14 Favored 'General case' 0 C--N 1.316 -0.87 0 O-C-N 119.959 -1.906 . . . . 10.0 109.096 -179.754 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 4.5 m -140.62 120.31 13.38 Favored 'General case' 0 C--O 1.222 -0.347 0 O-C-N 126.69 2.493 . . . . 10.0 107.074 179.915 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -108.65 133.31 52.93 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 114.342 -1.299 . . . . 10.0 109.676 -179.979 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 2.0 t90 -138.8 113.27 8.9 Favored 'General case' 0 CA--C 1.502 -0.882 0 O-C-N 125.783 1.927 . . . . 10.0 109.19 179.645 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -82.97 128.51 38.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 121.994 0.902 . . . . 10.0 111.651 -179.981 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -127.05 88.16 2.77 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 122.883 1.325 . . . . 10.0 108.044 179.991 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 53.27 -103.6 0.15 Allowed Glycine 0 C--N 1.346 1.134 0 O-C-N 119.21 -2.181 . . . . 10.0 111.16 -179.79 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 113' ' ' ASP . . . . . 0.407 ' N ' ' OD1' ' A' ' 113' ' ' ASP . 0.5 OUTLIER -102.17 28.88 5.47 Favored 'General case' 0 N--CA 1.463 0.199 0 C-N-CA 124.378 1.071 . . . . 10.0 113.692 -179.967 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -146.12 145.21 30.43 Favored 'General case' 0 C--N 1.321 -0.669 0 O-C-N 119.73 -1.856 . . . . 10.0 109.68 179.989 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 1.068 ' HG ' HG11 ' A' ' 133' ' ' VAL . 0.1 OUTLIER -107.75 133.96 51.39 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 104.593 -2.373 . . . . 10.0 104.593 -179.559 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -120.72 95.78 4.85 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 106.022 -1.844 . . . . 10.0 106.022 -179.969 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 5.0 tp -101.29 134.0 45.01 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 113.811 -1.54 . . . . 10.0 108.907 179.929 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -133.61 100.83 4.91 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 105.059 -2.2 . . . . 10.0 105.059 179.685 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.48 ' CG ' ' CD1' ' A' ' 106' ' ' TRP . 2.2 ttm -96.39 139.4 32.57 Favored 'General case' 0 CA--C 1.504 -0.821 0 O-C-N 126.449 2.343 . . . . 10.0 113.435 -179.907 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.409 ' O ' ' HB2' ' A' ' 121' ' ' ALA . 3.2 ptt180 -131.27 177.92 7.1 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 114.004 1.113 . . . . 10.0 114.004 -179.998 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 121' ' ' ALA . . . . . 0.409 ' HB2' ' O ' ' A' ' 120' ' ' ARG . . . 174.19 132.07 0.03 OUTLIER 'General case' 0 C--N 1.319 -0.755 0 O-C-N 124.526 1.142 . . . . 10.0 108.908 179.647 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 122' ' ' GLU . . . . . 0.403 ' HB3' ' HB1' ' A' ' 22' ' ' ALA . 2.6 tm-20 44.97 51.82 8.52 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 116.272 1.953 . . . . 10.0 116.272 -179.918 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 66.19 24.12 71.79 Favored Glycine 0 CA--C 1.534 1.243 0 CA-C-N 114.316 -1.311 . . . . 10.0 114.854 -179.77 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 1.6 t -136.86 118.85 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 CA-C-O 123.796 1.76 . . . . 10.0 107.326 179.962 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 125' ' ' THR . . . . . 0.441 HG22 ' N ' ' A' ' 126' ' ' CYS . 18.7 m -94.55 159.05 15.26 Favored 'General case' 0 C--N 1.314 -0.937 0 C-N-CA 125.507 1.523 . . . . 10.0 110.575 -179.977 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 126' ' ' CYS . . . . . 0.441 ' N ' HG22 ' A' ' 125' ' ' THR . 0.0 OUTLIER -149.52 153.64 37.52 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 127.829 3.206 . . . . 10.0 105.218 -179.816 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 25.3 mttp -151.5 123.44 8.1 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 113.719 1.007 . . . . 10.0 113.719 179.728 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -109.89 118.72 37.23 Favored 'General case' 0 C--N 1.319 -0.747 0 O-C-N 126.658 2.474 . . . . 10.0 109.432 -179.866 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 90.7 t -83.3 118.75 31.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 119.218 -0.993 . . . . 10.0 110.635 -179.741 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 130' ' ' PHE . . . . . 0.448 ' HB3' ' HB2' ' A' ' 115' ' ' LEU . 0.4 OUTLIER -103.3 133.3 48.59 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 114.147 -1.388 . . . . 10.0 109.095 -179.915 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.463 ' HB3' ' HG2' ' A' ' 9' ' ' LYS . 0.0 OUTLIER -110.15 130.68 55.5 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 105.076 -2.194 . . . . 10.0 105.076 179.577 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 132' ' ' LYS . . . . . 0.509 ' HB2' ' HE3' ' A' ' 9' ' ' LYS . 25.7 tptt 74.84 161.18 0.24 Allowed 'General case' 0 C--O 1.211 -0.923 0 CA-C-O 116.743 -1.599 . . . . 10.0 107.03 -178.766 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 133' ' ' VAL . . . . . 1.068 HG11 ' HG ' ' A' ' 115' ' ' LEU . 7.6 p 146.25 57.77 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.31 -1.113 1 O-C-N 130.125 4.641 . . . . 10.0 109.298 -179.529 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 134' ' ' HIS . . . . . 0.429 ' HA ' ' HA2' ' A' ' 6' ' ' GLY . 18.8 t-80 . . . . . 0 C--N 1.314 -0.966 1 O-C-N 129.245 4.091 . . . . 10.0 108.989 179.825 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.2 t0 . . . . . 0 C--O 1.218 -0.556 0 CA-C-O 123.432 1.586 . . . . 10.0 111.765 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.404 ' CE2' HD12 ' A' ' 110' ' ' ILE . 55.7 m-85 -78.22 -43.57 28.04 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 116.428 2.01 . . . . 10.0 116.428 -179.952 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 10.1 m-20 -43.23 125.18 3.63 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-O 116.954 -1.498 . . . . 10.0 114.796 179.798 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 160.58 -99.25 0.18 Allowed Glycine 0 CA--C 1.531 1.083 0 O-C-N 125.5 1.75 . . . . 10.0 116.899 179.96 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -175.04 128.69 0.29 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 101.579 -3.489 . . . . 10.0 101.579 -179.823 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.615 ' CD2' HD12 ' A' ' 115' ' ' LEU . 82.0 m95 -127.16 114.1 17.25 Favored 'General case' 0 C--N 1.322 -0.608 0 O-C-N 126.78 2.55 . . . . 10.0 111.824 179.727 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.1 175.33 7.78 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 107.306 -1.368 . . . . 10.0 107.306 179.81 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -114.9 149.34 37.35 Favored 'General case' 0 C--O 1.241 0.606 0 N-CA-C 116.306 1.965 . . . . 10.0 116.306 -179.893 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.1 tt -114.84 -0.74 13.39 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 114.212 -1.358 . . . . 10.0 109.582 -179.88 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.1 t 173.83 156.32 0.12 Allowed 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 117.287 2.329 . . . . 10.0 117.287 -179.389 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -146.78 122.31 10.41 Favored 'General case' 0 C--N 1.322 -0.624 0 O-C-N 126.158 2.161 . . . . 10.0 105.289 -179.883 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.2 tt0 -135.81 144.01 45.48 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 115.991 1.849 . . . . 10.0 115.991 179.489 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 62.0 29.36 17.69 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 125.036 1.46 . . . . 10.0 111.799 179.832 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.451 ' CE1' ' HG3' ' A' ' 17' ' ' GLU . 1.7 p90 -76.18 -26.26 56.01 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-O 118.527 -0.749 . . . . 10.0 112.281 179.892 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.451 ' HG3' ' CE1' ' A' ' 16' ' ' PHE . 5.0 mt-10 -71.25 -32.14 68.39 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 122.848 1.308 . . . . 10.0 111.968 179.932 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -78.91 -29.18 44.09 Favored 'General case' 0 C--O 1.215 -0.74 0 CA-C-N 113.37 -1.741 . . . . 10.0 108.103 -179.832 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.43 ' CE1' HD23 ' A' ' 20' ' ' LEU . 0.1 OUTLIER -65.92 -35.81 81.65 Favored 'General case' 0 C--O 1.247 0.956 0 O-C-N 124.213 0.946 . . . . 10.0 110.12 -179.934 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.43 HD23 ' CE1' ' A' ' 19' ' ' TYR . 4.2 mt -77.02 -33.47 57.44 Favored 'General case' 0 C--O 1.22 -0.48 0 CA-C-O 121.692 0.758 . . . . 10.0 109.598 -179.858 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.31 -23.93 60.33 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 107.672 -1.233 . . . . 10.0 107.672 -179.877 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.14 -34.69 66.23 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 126.016 2.073 . . . . 10.0 111.968 -179.699 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -119.28 7.81 11.33 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 119.23 0.923 . . . . 10.0 113.439 179.883 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 t0 55.53 78.16 0.2 Allowed 'General case' 0 N--CA 1.475 0.808 0 O-C-N 124.92 1.387 . . . . 10.0 112.34 -179.831 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.556 HG22 ' O ' ' A' ' 25' ' ' VAL . 2.9 p -118.74 54.29 0.25 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.506 0 CA-C-O 124.057 1.884 . . . . 10.0 107.464 179.737 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 60.14 146.08 0.01 OUTLIER 'General case' 0 C--O 1.225 -0.185 0 N-CA-C 118.655 2.835 . . . . 10.0 118.655 179.328 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 33.7 m -76.04 -30.77 20.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 113.417 -1.719 . . . . 10.0 113.237 179.892 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.27 -28.64 67.38 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 119.885 -1.759 . . . . 10.0 111.576 179.861 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.552 HD22 HG22 ' A' ' 25' ' ' VAL . 7.8 tp -77.87 -32.74 52.13 Favored 'General case' 0 N--CA 1.447 -0.595 0 O-C-N 123.847 0.717 . . . . 10.0 112.486 179.83 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 15.8 ttp85 -64.54 -32.87 74.7 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 124.446 2.07 . . . . 10.0 113.065 179.825 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -74.16 -41.16 61.96 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 113.794 -1.548 . . . . 10.0 111.058 -179.829 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.669 HG21 ' CE2' ' A' ' 57' ' ' PHE . 4.8 mm -74.89 -49.27 29.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 C-N-CA 125.136 1.375 . . . . 10.0 111.488 179.709 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -58.18 -40.51 81.68 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 117.643 -1.17 . . . . 10.0 112.746 -179.906 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.433 ' HA ' ' CZ ' ' A' ' 16' ' ' PHE . 0.1 OUTLIER -52.37 -29.88 26.1 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 120.41 1.459 . . . . 10.0 111.993 -179.486 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -109.0 23.99 13.76 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 119.481 1.037 . . . . 10.0 109.703 -179.777 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 2.3 tt -123.76 132.66 53.85 Favored 'General case' 0 CA--C 1.522 -0.122 0 O-C-N 125.21 1.568 . . . . 10.0 108.925 179.93 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 4.4 mmtp -119.66 106.02 42.62 Favored Pre-proline 0 N--CA 1.477 0.895 0 N-CA-C 104.644 -2.354 . . . . 10.0 104.644 179.66 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -66.6 -145.84 0.02 OUTLIER 'Trans proline' 0 C--N 1.356 0.95 0 C-N-CA 123.962 3.108 . . . . 10.0 117.522 -179.84 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 179.68 113.27 0.04 OUTLIER 'General case' 0 C--O 1.238 0.455 0 N-CA-C 106.236 -1.765 . . . . 10.0 106.236 -179.797 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.6 mmtp -80.08 168.56 18.99 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 117.401 -1.285 . . . . 10.0 111.825 -179.879 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -164.63 149.94 9.98 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 104.796 -2.298 . . . . 10.0 104.796 179.912 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 3.6 mm -133.69 154.58 38.79 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.632 0 N-CA-C 113.343 0.868 . . . . 10.0 113.343 -179.684 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.447 ' CG2' ' HD3' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -148.02 129.66 6.15 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 N-CA-C 105.7 -1.963 . . . . 10.0 105.7 179.576 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.472 ' HG2' ' HA ' ' A' ' 48' ' ' HIS . 0.8 OUTLIER -109.71 122.85 48.42 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-O 122.863 1.316 . . . . 10.0 111.029 -179.93 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -166.04 146.68 6.56 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 116.055 -1.926 . . . . 10.0 108.493 -179.941 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 74.19 -109.54 2.82 Favored Glycine 0 CA--C 1.537 1.417 0 O-C-N 126.119 2.137 . . . . 10.0 109.7 179.946 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.542 ' CB ' ' HB3' ' A' ' 65' ' ' GLN 0.256 2.8 m-20 -96.79 26.03 4.84 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 113.853 -1.174 . . . . 10.0 108.843 179.228 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 48' ' ' HIS . . . . . 0.472 ' HA ' ' HG2' ' A' ' 44' ' ' GLN . 8.3 m-70 77.01 -163.46 0.04 OUTLIER 'General case' 0 N--CA 1.434 -1.24 0 C-N-CA 126.695 1.998 . . . . 10.0 111.409 176.465 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.498 ' HG2' ' CD1' ' A' ' 51' ' ' ILE . 4.9 ttm 10.01 123.06 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.057 0 O-C-N 129.046 3.966 . . . . 10.0 119.261 -177.879 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 11.8 mt -144.53 106.46 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.865 0 N-CA-C 102.408 -3.182 . . . . 10.0 102.408 179.104 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.498 ' CD1' ' HG2' ' A' ' 49' ' ' MET . 1.2 mp -96.08 131.85 41.82 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.054 0 CA-C-O 124.846 2.26 . . . . 10.0 112.123 -178.795 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.606 HH21 HD11 ' A' ' 54' ' ' LEU . 0.0 OUTLIER -120.14 139.86 51.98 Favored 'General case' 0 N--CA 1.43 -1.466 0 CA-C-N 112.392 -2.186 . . . . 10.0 110.139 179.264 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 92.2 m -120.35 145.7 46.88 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 102.501 -3.148 . . . . 10.0 102.501 -179.86 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.606 HD11 HH21 ' A' ' 52' ' ' ARG . 97.0 mt -139.22 150.45 45.55 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 121.256 3.799 . . . . 10.0 121.256 179.909 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 78.4 p -179.27 174.84 0.99 Allowed 'General case' 0 C--O 1.24 0.577 0 CA-C-N 112.714 -2.039 . . . . 10.0 106.128 179.996 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 16.5 p -71.8 -22.02 61.63 Favored 'General case' 0 C--O 1.241 0.615 0 O-C-N 124.414 1.071 . . . . 10.0 109.892 179.308 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.669 ' CE2' HG21 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -86.11 173.96 9.49 Favored 'General case' 0 C--O 1.245 0.865 0 C-N-CA 125.795 1.638 . . . . 10.0 109.908 -179.919 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -47.35 127.14 10.54 Favored 'General case' 0 C--O 1.241 0.653 0 O-C-N 125.9 2.0 . . . . 10.0 114.159 -179.948 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 10.9 p-10 -100.04 177.31 5.13 Favored 'General case' 0 C--O 1.237 0.421 0 O-C-N 125.683 1.864 . . . . 10.0 108.857 179.794 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.466 ' C ' HD13 ' A' ' 61' ' ' ILE . 9.8 p90 -159.24 143.08 14.99 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 103.269 -2.863 . . . . 10.0 103.269 179.732 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.466 HD13 ' C ' ' A' ' 60' ' ' TYR . 0.1 OUTLIER -115.83 153.43 17.42 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.797 0 CA-C-O 123.679 1.704 . . . . 10.0 110.307 -179.87 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -136.09 -178.63 5.23 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 104.195 -2.521 . . . . 10.0 104.195 179.964 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 34.1 t0 -150.33 122.24 8.17 Favored 'General case' 0 N--CA 1.437 -1.125 0 CA-C-N 113.003 -1.908 . . . . 10.0 106.508 179.888 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.873 ' CD2' HG11 ' A' ' 86' ' ' VAL . 4.8 m-85 -93.67 -96.09 0.15 Allowed 'General case' 0 N--CA 1.44 -0.947 0 C-N-CA 125.629 1.572 . . . . 10.0 114.607 179.429 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.542 ' HB3' ' CB ' ' A' ' 47' ' ' ASP . 27.3 mt-30 84.33 114.01 0.05 Allowed 'General case' 0 C--N 1.298 -1.634 1 O-C-N 131.622 5.576 . . . . 10.0 108.393 -179.679 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 3.2 t -53.56 135.13 15.86 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.726 0 CA-C-N 113.023 -1.899 . . . . 10.0 107.369 179.573 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 63.04 70.5 1.03 Allowed Glycine 0 CA--C 1.53 1.014 0 CA-C-O 117.724 -1.598 . . . . 10.0 116.677 -179.756 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 5.6 tttp -179.43 148.45 0.35 Allowed 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 123.724 1.726 . . . . 10.0 113.715 179.617 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -97.18 133.37 41.91 Favored 'General case' 0 C--O 1.24 0.555 0 CA-C-N 113.129 -1.85 . . . . 10.0 109.662 -179.882 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.476 ' CD1' ' N ' ' A' ' 70' ' ' PHE . 1.0 OUTLIER -146.27 103.29 3.69 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 119.205 0.911 . . . . 10.0 111.345 -179.5 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.12 126.09 26.17 Favored 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 106.325 -1.731 . . . . 10.0 106.325 -179.77 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.426 ' OE1' HD12 ' A' ' 74' ' ' LEU . 2.2 mm-40 -109.72 96.07 6.02 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 112.407 0.521 . . . . 10.0 112.407 179.93 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -76.65 81.07 3.3 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 105.48 -2.044 . . . . 10.0 105.48 179.992 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.426 HD12 ' OE1' ' A' ' 72' ' ' GLU . 1.5 mp -67.43 120.94 14.74 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-N 112.479 -2.146 . . . . 10.0 113.248 179.946 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.452 HG23 ' O ' ' A' ' 75' ' ' THR . 1.2 t -159.83 100.18 1.42 Allowed 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 105.619 -1.993 . . . . 10.0 105.619 -179.924 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -167.69 -46.26 0.03 OUTLIER Glycine 0 N--CA 1.443 -0.884 0 O-C-N 127.277 2.86 . . . . 10.0 111.384 179.932 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 16.0 mt -137.97 -71.53 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 N-CA-C 107.517 -1.29 . . . . 10.0 107.517 -179.994 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -76.41 -22.14 55.09 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 125.585 1.803 . . . . 10.0 113.063 -179.981 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 60.16 -162.63 0.26 Allowed 'General case' 0 N--CA 1.478 0.937 0 CA-C-O 116.903 -1.522 . . . . 10.0 112.136 179.984 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 12.4 ttm105 74.89 137.07 0.06 Allowed 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 121.023 1.738 . . . . 10.0 109.394 -179.678 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.51 164.22 12.35 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 107.874 -1.158 . . . . 10.0 107.874 -179.874 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -162.33 159.47 25.48 Favored 'General case' 0 C--O 1.218 -0.581 0 N-CA-C 105.561 -2.014 . . . . 10.0 105.561 -179.984 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 2.6 ttp -122.24 124.92 44.92 Favored 'General case' 0 N--CA 1.448 -0.554 1 N-CA-C 99.066 -4.42 . . . . 10.0 99.066 -179.838 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.459 HG22 ' CZ ' ' A' ' 70' ' ' PHE . 1.1 m -124.77 137.66 54.31 Favored 'General case' 0 C--O 1.214 -0.77 0 N-CA-C 118.828 2.899 . . . . 10.0 118.828 -179.411 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -124.47 143.63 50.54 Favored 'General case' 0 CA--C 1.502 -0.9 0 N-CA-C 104.793 -2.299 . . . . 10.0 104.793 -179.754 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.873 HG11 ' CD2' ' A' ' 64' ' ' PHE . 3.0 m -123.55 146.62 28.66 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 N-CA-C 102.279 -3.23 . . . . 10.0 102.279 179.932 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 6.0 p -143.91 104.24 4.13 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 113.942 -1.481 . . . . 10.0 111.01 179.965 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 13.8 p-90 -61.74 137.75 58.27 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 104.987 -2.227 . . . . 10.0 104.987 -179.876 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -102.63 -54.91 2.55 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 102.624 -3.102 . . . . 10.0 102.624 179.794 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -168.94 -86.2 0.06 OUTLIER Glycine 0 CA--C 1.501 -0.836 0 N-CA-C 107.023 -2.431 . . . . 10.0 107.023 -179.912 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -102.49 14.0 33.08 Favored 'General case' 0 N--CA 1.446 -0.634 0 O-C-N 124.748 0.911 . . . . 10.0 112.566 -179.884 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -136.65 174.29 10.78 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 123.627 1.679 . . . . 10.0 108.633 -179.86 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -144.85 136.75 25.77 Favored 'General case' 0 C--O 1.216 -0.658 0 CA-C-N 114.549 -1.205 . . . . 10.0 107.949 179.847 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -126.18 149.23 49.15 Favored 'General case' 0 C--O 1.212 -0.906 0 CA-C-N 115.446 -0.797 . . . . 10.0 113.101 179.993 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -139.2 122.83 17.43 Favored 'General case' 0 C--N 1.321 -0.658 0 O-C-N 125.594 1.809 . . . . 10.0 113.219 179.85 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 14.1 t -111.68 113.93 45.6 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 N-CA-C 106.212 -1.773 . . . . 10.0 106.212 179.727 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -90.81 79.96 5.91 Favored 'General case' 0 C--O 1.245 0.826 0 O-C-N 125.118 1.511 . . . . 10.0 108.002 -179.949 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 24.5 ttpp -75.94 89.12 2.93 Favored 'General case' 0 CA--C 1.521 -0.159 0 C-N-CA 124.98 1.312 . . . . 10.0 113.352 -179.919 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -119.91 -65.28 0.27 Allowed Glycine 0 N--CA 1.436 -1.304 0 C-N-CA 125.498 1.523 . . . . 10.0 110.881 179.968 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -148.41 -32.18 0.25 Allowed 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 115.693 1.738 . . . . 10.0 115.693 -179.892 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 61.3 mmtt -80.1 -175.82 5.22 Favored 'General case' 0 C--O 1.215 -0.722 0 N-CA-C 115.115 1.524 . . . . 10.0 115.115 -179.856 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -105.88 -29.48 9.97 Favored 'General case' 0 N--CA 1.452 -0.358 0 O-C-N 125.833 1.958 . . . . 10.0 114.628 179.961 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -113.2 -18.62 7.12 Favored Glycine 0 N--CA 1.465 0.63 0 CA-C-O 118.411 -1.216 . . . . 10.0 115.825 -179.911 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -48.16 109.14 0.2 Allowed 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 120.329 2.065 . . . . 10.0 113.216 -179.918 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 177.55 149.13 7.69 Favored Glycine 0 N--CA 1.448 -0.554 0 N-CA-C 109.539 -1.424 . . . . 10.0 109.539 -179.688 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 9.3 m0 -111.21 121.18 44.62 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 118.708 1.254 . . . . 10.0 109.949 -179.987 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 60.2 m -104.59 108.9 20.58 Favored 'General case' 0 CA--C 1.499 -1.005 0 O-C-N 123.924 0.765 . . . . 10.0 109.259 179.586 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 -88.37 156.52 19.1 Favored 'General case' 0 C--O 1.245 0.835 0 C-N-CA 124.909 1.284 . . . . 10.0 108.237 179.719 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 109' ' ' TRP . . . . . 0.428 ' CD1' ' C ' ' A' ' 109' ' ' TRP . 2.4 t90 -175.46 104.65 0.08 Allowed 'General case' 0 C--O 1.215 -0.741 0 O-C-N 121.306 -0.872 . . . . 10.0 109.141 179.771 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.404 HD12 ' CE2' ' A' ' 4' ' ' PHE . 5.1 mt -78.49 146.47 8.08 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 125.799 2.714 . . . . 10.0 114.519 179.79 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -133.68 78.77 1.79 Allowed 'General case' 0 C--O 1.222 -0.366 0 CA-C-N 113.579 -1.646 . . . . 10.0 108.226 -179.779 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 73.62 -101.89 1.23 Allowed Glycine 0 N--CA 1.449 -0.443 0 N-CA-C 108.22 -1.952 . . . . 10.0 108.22 179.889 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -112.88 21.98 14.92 Favored 'General case' 0 C--O 1.214 -0.797 0 O-C-N 124.928 1.016 . . . . 10.0 109.596 179.889 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -127.71 139.92 52.39 Favored 'General case' 0 C--O 1.216 -0.683 0 CA-C-O 122.64 1.209 . . . . 10.0 110.131 -179.829 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.615 HD12 ' CD2' ' A' ' 8' ' ' TRP . 0.2 OUTLIER -105.58 125.18 50.69 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 114.402 -1.272 . . . . 10.0 109.135 -179.988 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 40.1 t-80 -111.44 101.69 10.12 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 106.491 -1.67 . . . . 10.0 106.491 179.684 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.601 ' O ' HD23 ' A' ' 117' ' ' LEU . 2.0 tt -112.7 126.3 55.24 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 122.415 1.102 . . . . 10.0 113.075 179.989 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -112.59 103.75 11.82 Favored 'General case' 0 CA--C 1.505 -0.781 0 O-C-N 119.891 -1.755 . . . . 10.0 108.272 179.951 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 1.4 ttm -94.23 161.29 14.32 Favored 'General case' 0 CA--C 1.509 -0.601 0 N-CA-C 108.184 -1.043 . . . . 10.0 108.184 -179.923 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 49.9 mtm180 -150.13 -177.37 5.89 Favored 'General case' 0 C--N 1.316 -0.874 0 C-N-CA 125.135 1.374 . . . . 10.0 114.348 179.915 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 165.67 129.92 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.493 0 O-C-N 128.141 3.401 . . . . 10.0 107.985 -179.989 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 53.51 36.21 22.7 Favored 'General case' 0 C--O 1.244 0.787 0 N-CA-C 114.813 1.412 . . . . 10.0 114.813 179.853 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 81.3 -6.69 63.01 Favored Glycine 0 CA--C 1.529 0.914 0 CA-C-O 116.052 -2.527 . . . . 10.0 114.671 -179.818 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -82.02 157.08 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 CA-C-N 119.041 1.421 . . . . 10.0 109.573 -179.854 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 3.5 m -127.5 114.17 17.1 Favored 'General case' 0 C--O 1.239 0.522 0 O-C-N 126.367 2.292 . . . . 10.0 113.074 179.781 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -120.57 151.86 38.86 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 105.908 -1.886 . . . . 10.0 105.908 -179.779 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.61 154.87 51.29 Favored 'General case' 0 C--O 1.224 -0.26 0 O-C-N 125.271 1.607 . . . . 10.0 113.114 -179.905 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 128' ' ' GLN . . . . . 0.457 ' HB2' HD22 ' A' ' 117' ' ' LEU . 0.4 OUTLIER -145.63 109.63 4.86 Favored 'General case' 0 C--N 1.323 -0.546 0 O-C-N 126.267 2.229 . . . . 10.0 108.378 179.662 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 16.9 t -91.22 140.37 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 N-CA-C 107.935 -1.135 . . . . 10.0 107.935 -179.613 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -123.84 169.44 11.57 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 119.221 -0.418 . . . . 10.0 111.008 179.721 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -141.48 124.74 16.48 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 105.789 -1.93 . . . . 10.0 105.789 -179.988 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 132' ' ' LYS . . . . . 0.515 ' HB2' ' CZ3' ' A' ' 8' ' ' TRP . 13.7 tttt -78.4 132.0 37.18 Favored 'General case' 0 C--N 1.324 -0.533 0 O-C-N 121.365 -0.834 . . . . 10.0 110.495 -179.893 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 2.2 t -107.31 -54.7 5.78 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 N-CA-C 115.009 1.485 . . . . 10.0 115.009 179.94 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 6.1 t-160 . . . . . 0 C--O 1.252 1.216 0 CA-C-O 117.143 -1.408 . . . . 10.0 113.37 -179.907 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo . . . . . 0 C--O 1.231 0.129 0 CA-C-O 118.308 -0.788 . . . . 10.0 110.952 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 2.1 t -102.37 -14.24 8.26 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.898 0 O-C-N 126.98 2.675 . . . . 10.0 112.406 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 25.62 89.46 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.967 0 O-C-N 128.616 3.698 . . . . 10.0 113.569 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 26.5 m-85 -40.14 -22.56 0.01 OUTLIER 'General case' 0 C--O 1.245 0.819 0 N-CA-C 117.844 2.535 . . . . 10.0 117.844 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -49.05 104.77 0.07 Allowed 'General case' 0 N--CA 1.475 0.775 0 O-C-N 125.738 1.899 . . . . 10.0 111.248 179.925 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -152.21 -163.44 11.57 Favored Glycine 0 N--CA 1.449 -0.458 0 N-CA-C 118.194 2.038 . . . . 10.0 118.194 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -135.31 110.85 9.17 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 100.843 -3.762 . . . . 10.0 100.843 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.604 ' CE2' HD21 ' A' ' 115' ' ' LEU . 46.5 m0 -112.63 116.43 30.17 Favored 'General case' 0 CA--C 1.506 -0.747 0 O-C-N 124.095 0.872 . . . . 10.0 112.373 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.78 148.63 22.42 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 117.658 -1.163 . . . . 10.0 107.946 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 2.6 mtt -86.03 128.66 34.9 Favored 'General case' 0 C--N 1.314 -0.942 0 O-C-N 126.671 2.482 . . . . 10.0 111.411 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.436 HD23 ' HA ' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -104.5 -53.12 2.77 Favored 'General case' 0 C--N 1.317 -0.813 0 O-C-N 124.914 1.384 . . . . 10.0 108.053 179.809 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -118.09 -172.36 2.24 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 113.53 0.937 . . . . 10.0 113.53 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 177.43 104.97 0.02 OUTLIER 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 106.655 -1.609 . . . . 10.0 106.655 179.658 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -107.2 151.13 25.83 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 116.551 2.056 . . . . 10.0 116.551 -179.793 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 34.03 34.33 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 116.647 2.091 . . . . 10.0 116.647 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -71.04 -29.99 66.05 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 115.554 1.687 . . . . 10.0 115.554 -179.751 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -75.38 -36.38 60.91 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 121.197 -0.939 . . . . 10.0 111.641 179.721 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -74.49 -23.45 58.86 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 107.785 -1.191 . . . . 10.0 107.785 -179.693 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.443 ' CZ ' HD11 ' A' ' 23' ' ' LEU . 2.4 t80 -69.36 -34.81 75.13 Favored 'General case' 0 CA--C 1.552 1.054 0 N-CA-C 108.492 -0.929 . . . . 10.0 108.492 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 34.6 mt -79.0 -28.84 43.44 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 108.821 -0.807 . . . . 10.0 108.821 179.313 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.6 ttt180 -73.83 -35.96 64.87 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 114.312 -1.313 . . . . 10.0 108.65 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.29 -33.65 71.81 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 126.695 2.497 . . . . 10.0 110.879 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.443 HD11 ' CZ ' ' A' ' 19' ' ' TYR . 6.7 mt -91.32 5.38 49.46 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 115.179 -0.919 . . . . 10.0 109.124 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 52.72 38.09 25.4 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 116.707 2.114 . . . . 10.0 116.707 -179.751 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 1.4 m -79.79 179.11 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 N-CA-C 106.036 -1.839 . . . . 10.0 106.036 179.561 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -72.35 159.49 33.94 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 117.462 2.393 . . . . 10.0 117.462 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.0 m -72.64 -35.46 50.61 Favored 'Isoleucine or valine' 0 C--O 1.242 0.668 0 C-N-CA 125.735 1.614 . . . . 10.0 112.836 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.72 -28.19 64.55 Favored 'General case' 0 N--CA 1.445 -0.724 0 O-C-N 120.286 -1.509 . . . . 10.0 111.558 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 22.9 tp -69.32 -45.23 70.02 Favored 'General case' 0 C--O 1.216 -0.705 0 CA-C-N 114.477 -1.238 . . . . 10.0 110.392 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.17 -20.44 61.59 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-N 113.107 -1.86 . . . . 10.0 112.333 179.854 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.75 -47.4 47.14 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 118.894 -2.379 . . . . 10.0 109.534 -179.93 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.1 mm -78.95 -44.7 24.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 O-C-N 126.803 2.564 . . . . 10.0 111.21 -179.54 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -55.88 -35.16 66.21 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 116.486 2.032 . . . . 10.0 116.486 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -67.51 -55.4 13.68 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 121.845 2.111 . . . . 10.0 115.668 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -54.57 -21.11 9.35 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-O 117.329 -1.319 . . . . 10.0 112.872 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 25.2 mt -90.55 161.32 15.52 Favored 'General case' 0 CA--C 1.503 -0.861 0 CA-C-O 123.204 1.478 . . . . 10.0 114.841 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.1 mttp -154.29 109.79 2.43 Favored Pre-proline 0 N--CA 1.472 0.646 0 N-CA-C 104.408 -2.441 . . . . 10.0 104.408 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.482 ' HB2' HG22 ' A' ' 53' ' ' THR . 72.5 Cg_endo -81.29 136.92 10.29 Favored 'Trans proline' 0 CA--C 1.535 0.568 0 C-N-CA 123.044 2.496 . . . . 10.0 116.802 179.791 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -91.01 121.79 33.12 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 118.019 -1.472 . . . . 10.0 107.701 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.1 ttpt -84.44 158.78 20.95 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-O 118.654 -0.689 . . . . 10.0 110.399 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -153.87 125.2 7.47 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 105.586 -2.005 . . . . 10.0 105.586 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.496 HD11 ' CZ3' ' A' ' 8' ' ' TRP . 7.9 mt -103.88 143.52 15.6 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.013 0 CA-C-N 120.076 1.307 . . . . 10.0 114.099 -179.761 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 35.7 t -136.97 138.16 46.17 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 N-CA-C 104.672 -2.344 . . . . 10.0 104.672 179.775 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -152.85 117.3 4.97 Favored 'General case' 0 C--N 1.312 -1.052 0 C-N-CA 124.784 1.234 . . . . 10.0 110.13 -179.782 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.58 -41.56 26.89 Favored 'General case' 0 C--N 1.321 -0.661 0 O-C-N 119.691 -1.881 . . . . 10.0 108.199 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -174.66 -92.11 0.08 OUTLIER Glycine 0 C--O 1.24 0.522 0 N-CA-C 106.76 -2.536 . . . . 10.0 106.76 -179.764 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -98.33 17.95 17.56 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 119.299 1.549 . . . . 10.0 109.935 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' HIS . . . . . 0.445 ' CE1' ' CG1' ' A' ' 50' ' ' ILE . 3.5 t60 -129.15 121.73 28.34 Favored 'General case' 0 C--O 1.214 -0.766 0 N-CA-C 105.439 -2.06 . . . . 10.0 105.439 179.721 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 7.2 ttp -121.03 133.44 55.25 Favored 'General case' 0 N--CA 1.443 -0.8 0 O-C-N 126.033 2.083 . . . . 10.0 112.759 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.445 ' CG1' ' CE1' ' A' ' 48' ' ' HIS . 19.3 mt -116.3 120.41 64.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 107.661 -1.237 . . . . 10.0 107.661 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -98.28 109.49 23.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 104.75 -2.315 . . . . 10.0 104.75 179.726 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 4.2 mtt180 -106.54 128.95 54.52 Favored 'General case' 0 N--CA 1.434 -1.265 0 C-N-CA 123.397 0.679 . . . . 10.0 112.112 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.482 HG22 ' HB2' ' A' ' 38' ' ' PRO . 0.2 OUTLIER -125.39 137.91 54.02 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 100.563 -3.865 . . . . 10.0 100.563 179.859 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.3 mp -125.92 92.64 3.63 Favored 'General case' 0 N--CA 1.449 -0.482 1 N-CA-C 123.409 4.596 . . . . 10.0 123.409 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 3.4 p -123.19 144.02 49.64 Favored 'General case' 0 C--N 1.315 -0.931 0 O-C-N 125.958 2.036 . . . . 10.0 105.531 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -69.35 -16.48 63.54 Favored 'General case' 0 C--O 1.22 -0.48 0 CA-C-O 123.209 1.48 . . . . 10.0 107.571 179.742 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -93.36 108.79 20.38 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 107.255 -1.387 . . . . 10.0 107.255 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 15.4 tpp180 36.64 91.87 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 O-C-N 126.074 2.109 . . . . 10.0 114.742 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ASN . . . . . 0.432 ' HB2' HD11 ' A' ' 61' ' ' ILE . 0.6 OUTLIER -48.79 122.12 5.35 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-O 123.64 1.686 . . . . 10.0 110.631 179.986 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -102.01 78.13 1.76 Allowed 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 112.87 -1.968 . . . . 10.0 107.959 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.432 HD11 ' HB2' ' A' ' 59' ' ' ASN . 1.4 mm -106.77 133.5 51.15 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 C-N-CA 120.424 -0.51 . . . . 10.0 109.993 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -129.99 151.46 50.52 Favored 'General case' 0 C--N 1.317 -0.834 0 C-N-CA 125.742 1.617 . . . . 10.0 108.378 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -127.33 152.81 46.97 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 101.363 -3.569 . . . . 10.0 101.363 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 4.9 m-30 -146.39 167.89 22.49 Favored 'General case' 0 C--O 1.246 0.911 0 N-CA-C 116.062 1.875 . . . . 10.0 116.062 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 40.2 mm-40 -137.01 117.14 13.39 Favored 'General case' 0 N--CA 1.437 -1.118 0 N-CA-C 104.412 -2.44 . . . . 10.0 104.412 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 47.1 t -73.73 132.25 33.68 Favored 'Isoleucine or valine' 0 C--O 1.241 0.639 0 CA-C-N 115.133 -0.939 . . . . 10.0 112.021 -179.616 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 77.86 -10.42 25.74 Favored Glycine 0 N--CA 1.437 -1.263 0 C-N-CA 125.299 1.428 . . . . 10.0 116.032 -179.761 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.6 tmtt? -113.25 126.48 55.45 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 114.514 -0.843 . . . . 10.0 112.218 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -41.82 141.15 0.87 Allowed 'General case' 0 C--N 1.32 -0.681 0 O-C-N 127.604 3.065 . . . . 10.0 112.789 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -124.15 151.34 44.1 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 113.912 -1.494 . . . . 10.0 113.248 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -126.49 151.81 47.31 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 105.994 -1.854 . . . . 10.0 105.994 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -143.32 145.5 32.75 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 117.201 2.297 . . . . 10.0 117.201 -179.88 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -129.81 124.05 32.4 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 121.487 0.661 . . . . 10.0 109.372 -179.82 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.492 HD13 HG12 ' A' ' 77' ' ' ILE . 80.5 mt -121.52 139.86 52.95 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 123.906 0.882 . . . . 10.0 111.751 -179.707 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.91 4.46 4.16 Favored 'General case' 0 N--CA 1.443 -0.8 0 O-C-N 120.649 -1.282 . . . . 10.0 109.631 -179.762 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -121.48 -21.23 3.07 Favored Glycine 0 CA--C 1.53 0.986 0 CA-C-O 117.892 -1.504 . . . . 10.0 110.858 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.656 HD13 ' N ' ' A' ' 77' ' ' ILE . 0.0 OUTLIER -124.43 120.17 58.37 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.687 0 CA-C-O 116.4 -1.762 . . . . 10.0 108.011 -179.868 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 3.4 p30 28.5 34.34 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.86 0 O-C-N 126.646 2.466 . . . . 10.0 114.027 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -4.56 81.13 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 127.68 2.392 . . . . 10.0 116.367 -179.592 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.9 158.23 44.91 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 113.095 -1.866 . . . . 10.0 110.265 -179.688 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -120.18 137.59 54.09 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 103.815 -2.661 . . . . 10.0 103.815 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 7.2 p -140.57 166.71 24.0 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.408 -1.269 . . . . 10.0 109.656 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -110.38 116.42 31.4 Favored 'General case' 0 N--CA 1.439 -0.995 1 N-CA-C 99.047 -4.427 . . . . 10.0 99.047 179.878 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 31.9 m -117.49 138.28 51.98 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 123.266 1.508 . . . . 10.0 114.329 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 20.7 m -127.51 123.49 36.01 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 106.238 -1.764 . . . . 10.0 106.238 -179.734 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 2.6 m -104.63 123.36 58.55 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.661 0 N-CA-C 102.647 -3.094 . . . . 10.0 102.647 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -137.97 178.37 7.17 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 122.724 1.25 . . . . 10.0 110.603 -179.834 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 4.0 p-90 -123.45 109.33 13.71 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 104.288 -2.486 . . . . 10.0 104.288 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -72.55 -55.09 7.47 Favored 'General case' 0 C--N 1.314 -0.974 1 N-CA-C 99.014 -4.439 . . . . 10.0 99.014 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -149.13 -117.57 0.89 Allowed Glycine 0 C--O 1.246 0.849 0 N-CA-C 105.505 -3.038 . . . . 10.0 105.505 -179.552 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -97.99 49.77 1.02 Allowed 'General case' 0 N--CA 1.461 0.115 0 C-N-CA 118.447 -1.301 . . . . 10.0 111.374 179.555 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.3 mtmm -147.14 -168.95 3.18 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 124.436 1.094 . . . . 10.0 109.181 -179.712 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -142.58 151.3 41.4 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 105.819 -1.919 . . . . 10.0 105.819 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 17.5 mt-30 -147.23 150.2 34.39 Favored 'General case' 0 C--O 1.215 -0.743 0 C-N-CA 124.595 1.158 . . . . 10.0 112.256 179.462 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -138.85 127.95 23.97 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-N 114.517 -1.22 . . . . 10.0 112.882 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 9.1 p -110.11 97.66 6.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 C-N-CA 123.992 0.917 . . . . 10.0 108.955 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -73.89 81.99 1.67 Allowed 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 105.675 -1.972 . . . . 10.0 105.675 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -71.64 97.45 1.73 Allowed 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 114.3 1.222 . . . . 10.0 114.3 -179.601 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -162.16 -155.26 7.89 Favored Glycine 0 C--N 1.315 -0.604 0 O-C-N 126.104 2.128 . . . . 10.0 110.621 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -64.96 -171.68 0.07 Allowed 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 120.639 0.256 . . . . 10.0 111.657 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 15.2 mmtm 74.97 162.49 0.25 Allowed 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 114.774 1.398 . . . . 10.0 114.774 -179.721 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -93.41 -32.84 14.08 Favored 'General case' 0 C--O 1.213 -0.824 0 CA-C-O 122.95 1.357 . . . . 10.0 112.446 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -130.78 80.86 0.34 Allowed Glycine 0 C--O 1.221 -0.719 0 C-N-CA 125.391 1.472 . . . . 10.0 115.392 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.49 126.11 46.13 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-O 123.571 1.653 . . . . 10.0 108.681 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 145.0 154.97 6.29 Favored Glycine 0 C--N 1.336 0.528 0 CA-C-O 117.834 -1.537 . . . . 10.0 109.709 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' TRP . . . . . 0.492 ' CD1' ' HG2' ' A' ' 119' ' ' MET . 2.9 m0 -115.81 161.19 19.11 Favored 'General case' 0 C--N 1.314 -0.968 0 O-C-N 127.118 2.305 . . . . 10.0 108.952 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 51.1 m -133.54 130.5 38.54 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 104.974 -2.232 . . . . 10.0 104.974 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -118.09 162.48 18.13 Favored 'General case' 0 C--N 1.318 -0.784 0 O-C-N 127.257 2.848 . . . . 10.0 111.6 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' TRP . . . . . 0.46 ' CD1' ' C ' ' A' ' 109' ' ' TRP . 0.0 OUTLIER 176.99 157.53 0.31 Allowed 'General case' 0 CA--C 1.5 -0.947 0 CA-C-N 114.354 -1.294 . . . . 10.0 107.613 -179.995 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 66.8 mt -121.62 130.88 74.21 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 CA-C-N 115.857 -0.61 . . . . 10.0 111.429 -179.782 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -111.12 58.99 0.61 Allowed 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 124.136 1.922 . . . . 10.0 107.93 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 77.22 -94.45 1.13 Allowed Glycine 0 CA--C 1.504 -0.634 0 O-C-N 120.478 -1.389 . . . . 10.0 110.739 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -102.93 4.75 37.89 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 114.271 1.211 . . . . 10.0 114.271 -179.659 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -142.45 139.83 31.73 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 124.013 1.863 . . . . 10.0 115.041 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.604 HD21 ' CE2' ' A' ' 8' ' ' TRP . 4.3 mm? -83.32 144.51 29.64 Favored 'General case' 0 N--CA 1.441 -0.905 0 CA-C-N 112.718 -2.037 . . . . 10.0 109.684 -179.751 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 8.4 m-70 -131.67 67.66 1.51 Allowed 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 113.319 -1.764 . . . . 10.0 107.375 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.93 154.07 20.8 Favored 'General case' 0 C--N 1.317 -0.82 0 O-C-N 125.06 1.475 . . . . 10.0 113.441 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -135.99 135.63 39.67 Favored 'General case' 0 CA--C 1.502 -0.896 0 N-CA-C 107.352 -1.351 . . . . 10.0 107.352 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.492 ' HG2' ' CD1' ' A' ' 106' ' ' TRP . 3.6 mtt -125.61 123.11 38.3 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-O 123.391 1.567 . . . . 10.0 111.784 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.09 158.29 23.4 Favored 'General case' 0 N--CA 1.443 -0.791 0 O-C-N 119.958 -1.714 . . . . 10.0 112.834 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' ALA . . . . . 0.567 ' O ' HG22 ' A' ' 124' ' ' VAL . . . -169.34 103.69 0.36 Allowed 'General case' 0 CA--C 1.515 -0.368 0 O-C-N 120.935 -1.103 . . . . 10.0 108.382 -179.845 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 73.47 13.21 4.57 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.397 1.879 . . . . 10.0 116.029 -179.855 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 107.81 13.75 19.27 Favored Glycine 0 CA--C 1.535 1.301 0 CA-C-O 116.144 -2.476 . . . . 10.0 116.326 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.567 HG22 ' O ' ' A' ' 121' ' ' ALA . 2.7 m -112.91 93.97 2.85 Favored 'Isoleucine or valine' 0 C--O 1.242 0.679 0 CA-C-N 119.869 1.834 . . . . 10.0 113.554 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -78.91 109.94 13.66 Favored 'General case' 0 C--N 1.317 -0.811 0 O-C-N 125.852 1.97 . . . . 10.0 113.809 -179.851 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -106.57 151.52 24.91 Favored 'General case' 0 N--CA 1.463 0.202 0 N-CA-C 105.02 -2.215 . . . . 10.0 105.02 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 9.0 mtpp -132.84 150.44 52.16 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 119.111 -1.035 . . . . 10.0 111.949 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 20.8 mt-30 -138.61 106.66 5.71 Favored 'General case' 0 C--N 1.316 -0.876 0 O-C-N 121.759 -0.588 . . . . 10.0 110.9 -179.735 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.543 HG22 ' O ' ' A' ' 115' ' ' LEU . 1.1 t -89.64 127.54 42.21 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 C-N-CA 118.611 -1.236 . . . . 10.0 109.126 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -108.38 167.06 10.3 Favored 'General case' 0 N--CA 1.445 -0.716 0 C-N-CA 125.309 1.443 . . . . 10.0 110.199 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -127.23 107.56 10.11 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 106.785 -1.561 . . . . 10.0 106.785 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 132' ' ' LYS . . . . . 0.46 ' HG3' ' CD1' ' A' ' 8' ' ' TRP . 21.3 tttt -56.26 109.88 0.67 Allowed 'General case' 0 C--O 1.221 -0.396 0 CA-C-N 119.726 1.148 . . . . 10.0 108.155 179.811 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 16.1 m -103.42 50.58 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.506 -0.724 0 C-N-CA 124.964 1.306 . . . . 10.0 110.94 179.703 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 2.1 t60 . . . . . 0 C--N 1.315 -0.922 0 O-C-N 121.569 -0.707 . . . . 10.0 109.767 179.96 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo . . . . . 0 C--O 1.233 0.232 0 N-CA-C 109.851 -0.865 . . . . 10.0 109.851 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.742 HG12 ' OE1' ' A' ' 44' ' ' GLN . 0.8 OUTLIER -111.08 -156.42 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.281 0 C-N-CA 123.995 0.918 . . . . 10.0 109.634 -179.578 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.696 ' N ' HG13 ' A' ' 2' ' ' VAL . 14.5 m-20 -101.33 -33.73 9.91 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 116.54 -1.695 . . . . 10.0 112.972 -179.89 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.595 ' CE1' HD12 ' A' ' 93' ' ' LEU . 0.7 OUTLIER -20.52 -52.49 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.779 0 O-C-N 126.313 2.258 . . . . 10.0 116.606 179.681 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.419 ' HA ' HG22 ' A' ' 42' ' ' ILE . 3.9 p-10 -53.12 110.56 0.55 Allowed 'General case' 0 N--CA 1.484 1.25 0 O-C-N 125.2 1.562 . . . . 10.0 112.404 179.76 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -152.75 171.08 31.87 Favored Glycine 0 N--CA 1.464 0.503 0 C-N-CA 118.507 -1.806 . . . . 10.0 115.748 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -92.65 87.45 5.91 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 101.355 -3.572 . . . . 10.0 101.355 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.53 ' CH2' HD11 ' A' ' 115' ' ' LEU . 38.7 m0 -89.55 112.63 23.88 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 123.282 1.515 . . . . 10.0 114.24 179.816 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 18.8 pttp -98.05 138.62 35.08 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 103.908 -2.627 . . . . 10.0 103.908 179.855 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.27 150.23 22.71 Favored 'General case' 0 C--N 1.313 -0.981 0 N-CA-C 114.115 1.154 . . . . 10.0 114.115 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.2 tt -113.34 -55.15 2.55 Favored 'General case' 0 C--O 1.242 0.696 0 CA-C-O 118.293 -0.86 . . . . 10.0 109.666 -179.645 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.4 p -167.99 133.09 1.83 Allowed 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 116.33 1.974 . . . . 10.0 116.33 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -90.4 165.89 13.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 111.173 -2.74 . . . . 10.0 105.715 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -124.13 -57.26 1.61 Allowed 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 120.549 1.522 . . . . 10.0 111.293 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -112.4 51.07 0.83 Allowed 'General case' 0 C--N 1.328 -0.342 0 O-C-N 126.592 2.432 . . . . 10.0 113.148 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 6.4 t80 -76.3 -28.57 57.04 Favored 'General case' 0 CA--C 1.546 0.799 0 O-C-N 118.889 -2.382 . . . . 10.0 110.133 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -79.26 -42.4 25.96 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 125.799 1.937 . . . . 10.0 112.0 179.694 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -74.79 -20.56 59.74 Favored 'General case' 0 C--O 1.22 -0.478 0 O-C-N 121.418 -0.801 . . . . 10.0 108.85 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 14.2 t80 -67.1 -39.86 86.81 Favored 'General case' 0 CA--C 1.548 0.88 0 CA-C-O 122.583 1.183 . . . . 10.0 110.074 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 34.9 mt -75.33 -40.33 58.49 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 122.385 1.088 . . . . 10.0 109.643 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.4 ttm180 -68.41 -27.2 65.99 Favored 'General case' 0 C--O 1.241 0.657 0 C-N-CA 125.415 1.486 . . . . 10.0 109.231 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.56 -26.36 59.9 Favored 'General case' 0 C--O 1.221 -0.432 0 O-C-N 124.664 1.228 . . . . 10.0 109.239 -179.57 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 79.0 mt -99.12 -15.26 19.05 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 124.756 1.223 . . . . 10.0 109.514 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 61.67 61.74 1.4 Allowed 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 116.424 2.009 . . . . 10.0 116.424 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.606 HG13 ' HA ' ' A' ' 78' ' ' ASP . 0.2 OUTLIER -88.33 -150.11 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.245 0.838 0 N-CA-C 104.892 -2.262 . . . . 10.0 104.892 -179.7 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.413 ' N ' ' OD1' ' A' ' 26' ' ' ASN . 0.0 OUTLIER -96.27 162.37 13.54 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 120.639 1.563 . . . . 10.0 113.786 -179.908 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.9 t -70.36 -39.33 76.41 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 O-C-N 125.735 1.897 . . . . 10.0 114.261 -179.694 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -71.56 -29.99 65.36 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 113.473 0.916 . . . . 10.0 113.473 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.74 -29.25 58.8 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 124.903 1.281 . . . . 10.0 111.455 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.05 -33.42 67.95 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 113.252 0.834 . . . . 10.0 113.252 179.726 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -72.21 -41.42 66.95 Favored 'General case' 0 N--CA 1.451 -0.423 0 O-C-N 125.813 1.946 . . . . 10.0 109.387 -179.402 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.555 HG21 ' CZ ' ' A' ' 57' ' ' PHE . 46.5 mm -73.58 -60.03 2.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 O-C-N 120.879 -1.138 . . . . 10.0 108.175 -179.556 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -46.32 -26.77 0.88 Allowed 'General case' 0 C--N 1.318 -0.771 0 O-C-N 125.026 1.454 . . . . 10.0 114.79 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -81.96 -16.98 48.6 Favored 'General case' 0 C--N 1.327 -0.37 0 O-C-N 124.448 1.092 . . . . 10.0 111.061 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -87.6 -15.83 36.24 Favored 'General case' 0 N--CA 1.441 -0.877 0 O-C-N 121.064 -1.023 . . . . 10.0 110.744 -179.779 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.67 172.97 8.41 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.518 -0.919 . . . . 10.0 108.518 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.5 ptpt -152.37 135.52 9.43 Favored Pre-proline 0 N--CA 1.474 0.77 0 N-CA-C 106.292 -1.744 . . . . 10.0 106.292 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -74.29 107.28 2.41 Favored 'Trans proline' 0 N--CA 1.448 -1.151 1 C-N-CA 126.532 4.822 . . . . 10.0 119.064 -179.758 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -82.38 149.02 27.92 Favored 'General case' 0 C--O 1.239 0.526 0 N-CA-C 105.778 -1.934 . . . . 10.0 105.778 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 28.6 mttp -121.36 155.91 33.76 Favored 'General case' 0 C--O 1.214 -0.811 0 O-C-N 120.48 -1.388 . . . . 10.0 109.671 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -143.37 105.01 4.32 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 102.907 -2.997 . . . . 10.0 102.907 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.419 HG22 ' HA ' ' A' ' 5' ' ' ASN . 1.3 mt -100.41 149.29 6.13 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.921 0 C-N-CA 117.679 -1.608 . . . . 10.0 111.525 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 45.4 t -138.34 145.42 28.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 113.594 -1.639 . . . . 10.0 107.694 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.742 ' OE1' HG12 ' A' ' 2' ' ' VAL . 1.9 tt0 -139.01 128.08 23.83 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 113.538 -1.664 . . . . 10.0 112.005 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -103.55 -49.8 3.6 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 104.202 -2.518 . . . . 10.0 104.202 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -164.18 -113.15 0.28 Allowed Glycine 0 C--O 1.246 0.893 0 N-CA-C 106.466 -2.653 . . . . 10.0 106.466 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -75.17 -20.22 59.45 Favored 'General case' 0 C--O 1.215 -0.722 0 O-C-N 120.317 -1.696 . . . . 10.0 110.816 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.4 m170 -91.7 130.78 37.43 Favored 'General case' 0 N--CA 1.439 -0.982 0 CA-C-N 114.99 -1.005 . . . . 10.0 110.017 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.477 ' HG2' ' CD1' ' A' ' 51' ' ' ILE . 2.5 ttp -121.42 149.54 42.86 Favored 'General case' 0 N--CA 1.435 -1.181 0 O-C-N 125.761 1.913 . . . . 10.0 111.568 -179.659 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 19.9 mt -130.16 123.64 56.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 105.835 -1.913 . . . . 10.0 105.835 -179.808 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.477 ' CD1' ' HG2' ' A' ' 49' ' ' MET . 1.6 mp -110.05 128.18 66.4 Favored 'Isoleucine or valine' 0 C--O 1.24 0.578 0 N-CA-C 106.07 -1.826 . . . . 10.0 106.07 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.6 mmm180 -116.32 106.56 13.79 Favored 'General case' 0 N--CA 1.435 -1.221 0 CA-C-O 118.533 -0.746 . . . . 10.0 110.59 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.476 ' C ' HD12 ' A' ' 54' ' ' LEU . 65.3 m -91.52 129.87 37.43 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 102.126 -3.287 . . . . 10.0 102.126 -179.707 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.476 HD12 ' C ' ' A' ' 53' ' ' THR . 6.0 mp -127.37 86.5 2.5 Favored 'General case' 0 N--CA 1.441 -0.881 0 N-CA-C 119.353 3.094 . . . . 10.0 119.353 -179.811 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 7.1 m -108.42 132.67 53.53 Favored 'General case' 0 N--CA 1.443 -0.782 0 C-N-CA 125.491 1.517 . . . . 10.0 107.504 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.7 p -56.83 -24.73 53.2 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-O 123.021 1.391 . . . . 10.0 107.753 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.555 ' CZ ' HG21 ' A' ' 32' ' ' ILE . 1.2 t80 -87.0 -135.07 0.08 Allowed 'General case' 0 C--O 1.239 0.545 0 N-CA-C 106.782 -1.562 . . . . 10.0 106.782 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.69 140.21 44.02 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 118.868 -1.133 . . . . 10.0 113.723 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -138.14 144.06 40.62 Favored 'General case' 0 N--CA 1.466 0.367 0 O-C-N 125.851 1.97 . . . . 10.0 111.714 179.719 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 1.5 p90 -129.34 134.57 47.97 Favored 'General case' 0 C--O 1.217 -0.643 0 N-CA-C 105.449 -2.056 . . . . 10.0 105.449 -179.817 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 1.4 mp -97.28 119.5 45.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 124.327 2.013 . . . . 10.0 109.286 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -118.39 144.4 45.95 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-N 112.497 -2.138 . . . . 10.0 106.654 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -132.11 114.3 14.35 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 100.467 -3.901 . . . . 10.0 100.467 -179.834 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -102.55 177.38 4.88 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 117.429 2.381 . . . . 10.0 117.429 -179.738 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 15.9 mm-40 -144.1 105.58 4.27 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 103.095 -2.928 . . . . 10.0 103.095 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 47.8 t -62.81 119.43 6.78 Favored 'Isoleucine or valine' 0 C--O 1.243 0.744 0 CA-C-O 122.738 1.256 . . . . 10.0 113.106 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.12 37.28 63.89 Favored Glycine 0 CA--C 1.533 1.188 0 N-CA-C 117.117 1.607 . . . . 10.0 117.117 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.21 13.84 3.54 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 119.426 -0.91 . . . . 10.0 112.473 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 65.85 150.61 0.05 OUTLIER 'General case' 0 C--N 1.32 -0.706 0 O-C-N 125.656 1.847 . . . . 10.0 112.338 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -149.63 114.92 5.48 Favored 'General case' 0 C--O 1.243 0.714 0 CA-C-O 121.18 0.514 . . . . 10.0 111.665 179.76 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -87.07 89.93 8.18 Favored 'General case' 0 C--O 1.217 -0.612 0 N-CA-C 107.688 -1.227 . . . . 10.0 107.688 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -68.52 170.65 8.71 Favored 'General case' 0 C--N 1.319 -0.723 0 O-C-N 126.328 2.267 . . . . 10.0 115.625 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -150.02 62.66 0.98 Allowed 'General case' 0 N--CA 1.441 -0.91 0 N-CA-C 106.475 -1.676 . . . . 10.0 106.475 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.827 HD12 HG22 ' A' ' 77' ' ' ILE . 3.5 mm? -50.0 145.91 5.24 Favored 'General case' 0 N--CA 1.438 -1.034 0 N-CA-C 113.267 0.84 . . . . 10.0 113.267 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 62.2 m -156.1 92.67 1.36 Allowed 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.368 -0.833 . . . . 10.0 109.08 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 144.54 -43.85 0.94 Allowed Glycine 0 N--CA 1.434 -1.47 0 CA-C-O 117.072 -1.96 . . . . 10.0 112.097 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.827 HG22 HD12 ' A' ' 74' ' ' LEU . 0.3 OUTLIER -99.59 66.74 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.467 0 CA-C-N 118.961 1.38 . . . . 10.0 108.66 179.976 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.606 ' HA ' HG13 ' A' ' 25' ' ' VAL . 9.0 t70 83.24 -11.0 0.96 Allowed 'General case' 0 N--CA 1.443 -0.798 0 O-C-N 125.523 1.764 . . . . 10.0 109.744 -179.731 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 50.45 100.26 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 116.593 2.072 . . . . 10.0 116.593 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.42 124.11 4.01 Favored 'General case' 0 C--N 1.317 -0.818 0 O-C-N 120.688 -1.258 . . . . 10.0 112.178 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 10.3 mttt -63.05 149.21 45.62 Favored 'General case' 0 C--O 1.221 -0.447 0 N-CA-C 105.87 -1.9 . . . . 10.0 105.87 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 1.6 p -158.28 171.06 20.88 Favored 'General case' 0 C--O 1.215 -0.741 0 N-CA-C 105.652 -1.981 . . . . 10.0 105.652 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 30.1 mtp -120.56 96.38 5.11 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 102.664 -3.087 . . . . 10.0 102.664 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 27.7 m -107.24 117.52 34.28 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 116.977 2.214 . . . . 10.0 116.977 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 51.6 m -109.09 118.44 36.78 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 106.004 -1.85 . . . . 10.0 106.004 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.414 HG22 ' HB3' ' A' ' 95' ' ' CYS . 53.4 t -99.77 139.09 22.16 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 N-CA-C 105.714 -1.958 . . . . 10.0 105.714 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -154.41 -174.0 4.8 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 113.867 -1.515 . . . . 10.0 113.188 179.905 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 64.4 p-90 -133.93 130.48 37.79 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 121.787 0.804 . . . . 10.0 108.835 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 14.8 t0 -149.31 119.35 7.18 Favored 'General case' 0 C--O 1.242 0.666 0 N-CA-C 103.444 -2.798 . . . . 10.0 103.444 179.698 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 88.08 13.27 64.44 Favored Glycine 0 CA--C 1.503 -0.702 0 N-CA-C 106.979 -2.449 . . . . 10.0 106.979 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 20.9 t0 72.11 5.39 5.3 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 119.269 1.535 . . . . 10.0 111.859 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.44 168.85 9.48 Favored 'General case' 0 CA--C 1.504 -0.79 0 N-CA-C 106.499 -1.667 . . . . 10.0 106.499 179.782 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.595 HD12 ' CE1' ' A' ' 4' ' ' PHE . 0.5 OUTLIER -112.96 92.22 3.93 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 123.808 1.766 . . . . 10.0 106.425 179.586 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -104.45 155.87 18.42 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 114.72 -1.127 . . . . 10.0 110.446 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' CYS . . . . . 0.414 ' HB3' HG22 ' A' ' 86' ' ' VAL . 0.1 OUTLIER -145.3 170.59 16.01 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 117.601 -1.64 . . . . 10.0 108.461 -179.835 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 81.3 t -145.94 128.07 8.63 Favored 'Isoleucine or valine' 0 C--O 1.241 0.639 0 O-C-N 125.291 1.619 . . . . 10.0 107.574 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -110.89 118.94 37.47 Favored 'General case' 0 C--N 1.32 -0.695 0 O-C-N 125.041 1.463 . . . . 10.0 109.136 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 2.7 mmmt -96.17 80.58 3.26 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 122.655 1.217 . . . . 10.0 110.373 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -143.27 74.96 0.32 Allowed Glycine 0 C--N 1.338 0.652 0 CA-C-N 114.101 -1.409 . . . . 10.0 110.481 179.75 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 58.72 -176.12 0.08 Allowed 'General case' 0 C--O 1.234 0.241 0 N-CA-C 116.125 1.898 . . . . 10.0 116.125 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 24.9 mmtt 60.81 175.58 0.1 Allowed 'General case' 0 CA--C 1.544 0.747 0 O-C-N 125.244 1.59 . . . . 10.0 114.822 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 75.2 mt-10 -123.68 88.3 2.89 Favored 'General case' 0 C--O 1.232 0.134 0 O-C-N 125.568 1.792 . . . . 10.0 113.512 179.786 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 142.46 -23.39 2.36 Favored Glycine 0 C--O 1.217 -0.953 0 CA-C-O 118.258 -1.301 . . . . 10.0 116.263 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 7.0 mtp180 -47.94 130.89 15.45 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.869 0.982 . . . . 10.0 112.347 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 142.99 148.96 5.03 Favored Glycine 0 N--CA 1.439 -1.111 0 O-C-N 125.874 1.984 . . . . 10.0 109.952 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' TRP . . . . . 0.511 ' CE3' HD11 ' A' ' 117' ' ' LEU . 2.6 m0 -112.26 171.54 7.45 Favored 'General case' 0 N--CA 1.455 -0.22 0 O-C-N 121.789 -0.83 . . . . 10.0 109.727 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 4.0 m -153.54 88.98 1.3 Allowed 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 104.106 -2.553 . . . . 10.0 104.106 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 -79.76 98.23 6.94 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 125.156 1.535 . . . . 10.0 112.9 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -105.15 130.71 53.26 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 107.218 -1.401 . . . . 10.0 107.218 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 15.6 mt -93.18 119.64 41.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 116.679 2.103 . . . . 10.0 116.679 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -101.5 71.85 1.37 Allowed 'General case' 0 C--O 1.223 -0.303 0 CA-C-O 123.337 1.541 . . . . 10.0 108.243 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 59.52 -103.6 0.44 Allowed Glycine 0 C--N 1.341 0.826 0 N-CA-C 109.419 -1.473 . . . . 10.0 109.419 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 17.9 p-10 -87.12 16.79 4.74 Favored 'General case' 0 N--CA 1.476 0.842 0 O-C-N 121.392 -1.063 . . . . 10.0 112.54 179.849 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 13.4 mt-10 -138.92 158.33 44.4 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 125.166 2.412 . . . . 10.0 110.304 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.53 HD11 ' CH2' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -118.75 121.1 39.3 Favored 'General case' 0 C--O 1.24 0.582 0 N-CA-C 105.629 -1.989 . . . . 10.0 105.629 -179.931 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 48.0 t-80 -115.18 68.03 0.7 Allowed 'General case' 0 N--CA 1.444 -0.739 0 CA-C-O 123.327 1.537 . . . . 10.0 110.828 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.511 HD11 ' CE3' ' A' ' 106' ' ' TRP . 9.0 tt -69.48 126.28 29.27 Favored 'General case' 0 N--CA 1.441 -0.889 0 CA-C-N 113.206 -1.815 . . . . 10.0 108.796 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -128.38 98.19 4.98 Favored 'General case' 0 CA--C 1.498 -1.047 0 CA-C-O 124.31 2.005 . . . . 10.0 107.494 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 3.1 ptp -95.09 133.64 38.68 Favored 'General case' 0 CA--C 1.515 -0.396 0 O-C-N 120.663 -1.273 . . . . 10.0 112.346 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.97 169.1 9.25 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 117.613 -1.184 . . . . 10.0 112.388 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -177.58 116.6 0.09 Allowed 'General case' 0 C--O 1.237 0.433 0 O-C-N 125.43 1.706 . . . . 10.0 106.604 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 67.91 31.56 5.61 Favored 'General case' 0 C--O 1.245 0.865 0 CA-C-O 123.354 1.55 . . . . 10.0 114.344 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 78.83 -3.81 63.3 Favored Glycine 0 CA--C 1.526 0.747 0 O-C-N 120.049 -1.657 . . . . 10.0 113.178 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 49.1 t -95.85 121.68 46.63 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 N-CA-C 105.924 -1.88 . . . . 10.0 105.924 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 4.9 m -104.4 117.47 34.26 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-O 122.407 1.099 . . . . 10.0 112.164 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 4.2 t -103.4 128.03 50.62 Favored 'General case' 0 C--O 1.214 -0.777 0 C-N-CA 126.039 1.736 . . . . 10.0 107.538 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.42 155.08 47.94 Favored 'General case' 0 C--O 1.218 -0.572 0 C-N-CA 119.098 -1.041 . . . . 10.0 111.457 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -136.22 135.54 39.16 Favored 'General case' 0 N--CA 1.439 -1.02 0 N-CA-C 113.146 0.795 . . . . 10.0 113.146 179.869 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -86.23 103.19 12.58 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 CA-C-N 114.2 -1.364 . . . . 10.0 107.676 179.601 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 130' ' ' PHE . . . . . 0.494 ' CD1' ' HB3' ' A' ' 8' ' ' TRP . 0.7 OUTLIER -93.52 165.58 12.68 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 118.109 -0.948 . . . . 10.0 109.096 -179.86 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 13.5 tptp -133.02 134.87 45.0 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 125.94 2.025 . . . . 10.0 108.543 179.778 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 15.4 tptm -88.49 131.46 34.89 Favored 'General case' 0 CA--C 1.512 -0.493 0 CA-C-N 114.603 -1.181 . . . . 10.0 109.487 -179.677 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 28.3 t -109.8 -48.42 6.94 Favored 'Isoleucine or valine' 0 C--O 1.243 0.75 0 O-C-N 125.876 1.985 . . . . 10.0 109.075 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 6.2 t-80 . . . . . 0 N--CA 1.438 -1.05 0 CA-C-N 112.84 -1.982 . . . . 10.0 114.17 -179.806 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.484 0.938 0 CA-C-O 124.09 1.621 . . . . 10.0 113.289 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 14.4 m -106.21 67.21 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 114.383 -1.28 . . . . 10.0 111.722 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -128.95 51.46 2.04 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 123.512 1.625 . . . . 10.0 109.983 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.414 ' CE1' HD11 ' A' ' 110' ' ' ILE . 10.0 m-85 63.21 -43.32 0.21 Allowed 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 117.11 2.263 . . . . 10.0 117.11 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 42.7 t-20 -40.25 106.39 0.05 Allowed 'General case' 0 C--N 1.319 -0.744 0 C-N-CA 125.455 1.502 . . . . 10.0 114.916 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -165.45 -127.17 0.87 Allowed Glycine 0 N--CA 1.468 0.796 0 N-CA-C 116.61 1.404 . . . . 10.0 116.61 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -167.15 122.98 1.11 Allowed 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 102.664 -3.087 . . . . 10.0 102.664 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 40.9 m0 -106.77 107.69 18.83 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 117.75 -1.119 . . . . 10.0 109.345 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.413 ' HE3' ' HB3' ' A' ' 131' ' ' LYS . 20.0 pttt -97.4 108.34 21.05 Favored 'General case' 0 C--O 1.216 -0.683 0 N-CA-C 105.589 -2.004 . . . . 10.0 105.589 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.17 166.84 0.09 Allowed 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 115.602 1.704 . . . . 10.0 115.602 -179.868 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.3 tt -126.12 -63.88 1.08 Allowed 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 105.18 -2.156 . . . . 10.0 105.18 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 77.4 p -144.64 155.89 43.84 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 124.654 1.182 . . . . 10.0 113.891 179.727 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -129.35 155.7 45.21 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 125.392 1.682 . . . . 10.0 106.647 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.8 pm0 -144.81 146.88 32.31 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 116.821 2.156 . . . . 10.0 116.821 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.1 m120 54.85 16.47 1.45 Allowed 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 114.571 1.323 . . . . 10.0 114.571 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -59.17 -36.79 75.92 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 116.015 1.858 . . . . 10.0 116.015 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.38 -34.77 61.14 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-N 119.419 1.009 . . . . 10.0 111.62 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -73.55 -27.39 61.31 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 107.846 -1.168 . . . . 10.0 107.846 179.789 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.412 ' CD2' HD23 ' A' ' 20' ' ' LEU . 10.1 t80 -65.15 -42.52 93.72 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 124.994 1.317 . . . . 10.0 111.024 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.633 HD12 ' HA ' ' A' ' 30' ' ' ARG . 24.4 mt -75.11 -25.52 58.56 Favored 'General case' 0 N--CA 1.478 0.946 0 O-C-N 121.797 -0.564 . . . . 10.0 109.576 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 57.1 ttt180 -67.79 -27.66 66.93 Favored 'General case' 0 C--O 1.242 0.708 0 C-N-CA 124.582 1.153 . . . . 10.0 110.735 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.51 -42.33 71.43 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.08 1.352 . . . . 10.0 110.096 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 32.6 mt -76.99 -13.47 59.96 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 122.312 1.053 . . . . 10.0 109.741 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 29.7 m-20 45.46 39.67 4.86 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.575 1.15 . . . . 10.0 111.483 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.569 HG12 ' N ' ' A' ' 26' ' ' ASN . 1.2 t -57.15 -63.54 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 O-C-N 127.428 2.955 . . . . 10.0 104.692 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.569 ' N ' HG12 ' A' ' 25' ' ' VAL . 5.4 t-20 -167.75 161.35 13.25 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.303 0.853 . . . . 10.0 113.303 -179.761 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.4 HG13 ' NH2' ' A' ' 30' ' ' ARG . 2.9 t -78.51 -33.14 16.85 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 N-CA-C 114.633 1.345 . . . . 10.0 114.633 -179.822 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -74.67 -32.34 62.19 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.003 -0.999 . . . . 10.0 112.634 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.5 tp -78.84 -21.47 47.57 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 122.021 0.915 . . . . 10.0 113.306 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.633 ' HA ' HD12 ' A' ' 20' ' ' LEU . 15.7 ttm180 -74.46 -31.31 62.19 Favored 'General case' 0 C--O 1.22 -0.491 0 O-C-N 119.605 -1.935 . . . . 10.0 111.311 -179.751 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.2 tttp -77.95 -39.03 43.95 Favored 'General case' 0 C--O 1.225 -0.19 0 CA-C-N 114.137 -1.392 . . . . 10.0 110.209 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 10.7 mm -75.29 -46.41 38.54 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 CA-C-N 114.278 -1.328 . . . . 10.0 109.913 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.54 ' CB ' HD11 ' A' ' 20' ' ' LEU . . . -67.21 -21.07 65.78 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 115.623 1.712 . . . . 10.0 115.623 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -71.1 -45.69 63.19 Favored 'General case' 0 N--CA 1.443 -0.819 0 N-CA-C 114.886 1.439 . . . . 10.0 114.886 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.3 pp -59.04 -21.84 59.74 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 113.627 0.973 . . . . 10.0 113.627 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -69.23 159.03 33.8 Favored 'General case' 0 C--O 1.217 -0.63 0 O-C-N 124.116 0.885 . . . . 10.0 112.348 -179.776 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 7.6 mttp -146.28 107.29 4.16 Favored Pre-proline 0 C--N 1.322 -0.593 0 N-CA-C 103.662 -2.718 . . . . 10.0 103.662 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -89.13 104.35 0.39 Allowed 'Trans proline' 0 C--N 1.354 0.868 0 N-CA-C 118.8 2.577 . . . . 10.0 118.8 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -81.28 136.01 35.76 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 103.536 -2.764 . . . . 10.0 103.536 178.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 12.0 mtpp -118.66 142.51 47.59 Favored 'General case' 0 C--N 1.31 -1.141 0 C-N-CA 118.846 -1.142 . . . . 10.0 112.153 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.424 ' OE1' HG23 ' A' ' 43' ' ' VAL . 0.2 OUTLIER -120.98 116.77 25.72 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 102.706 -3.072 . . . . 10.0 102.706 179.76 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 29.9 mt -110.66 136.26 47.22 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.058 0 CA-C-O 124.653 2.168 . . . . 10.0 111.062 -179.536 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.424 HG23 ' OE1' ' A' ' 41' ' ' GLU . 83.7 t -131.53 124.35 54.29 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.875 0 N-CA-C 105.095 -2.187 . . . . 10.0 105.095 -179.8 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 -108.86 165.13 11.79 Favored 'General case' 0 C--O 1.215 -0.733 0 CA-C-N 114.733 -1.121 . . . . 10.0 109.596 179.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -145.4 -146.81 0.2 Allowed 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 104.525 -2.398 . . . . 10.0 104.525 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -84.81 91.85 1.71 Allowed Glycine 0 CA--C 1.527 0.8 0 N-CA-C 105.993 -2.843 . . . . 10.0 105.993 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 62.02 20.34 11.51 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 124.481 0.754 . . . . 10.0 112.311 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 4.9 t-160 -125.75 103.52 7.85 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 105.413 -2.069 . . . . 10.0 105.413 -179.78 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.53 ' HG2' HD11 ' A' ' 51' ' ' ILE . 2.8 ttp -109.87 107.21 17.07 Favored 'General case' 0 C--O 1.216 -0.686 0 CA-C-N 112.723 -2.035 . . . . 10.0 116.028 -179.795 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.531 ' H ' HD12 ' A' ' 50' ' ' ILE . 3.3 mp -88.97 146.8 5.73 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 C-N-CA 125.824 1.65 . . . . 10.0 107.858 -179.583 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.53 HD11 ' HG2' ' A' ' 49' ' ' MET . 1.8 mp -133.87 133.12 56.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 O-C-N 124.582 1.176 . . . . 10.0 108.065 179.657 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 21.1 mtt-85 -124.14 127.58 48.0 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-O 117.798 -1.096 . . . . 10.0 113.199 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 12.7 m -114.63 94.85 4.96 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 102.814 -3.032 . . . . 10.0 102.814 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 58.0 mt -82.87 100.06 10.12 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 120.554 3.539 . . . . 10.0 120.554 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 48.9 p -122.82 -139.88 0.31 Allowed 'General case' 0 C--N 1.319 -0.759 0 O-C-N 126.168 2.167 . . . . 10.0 108.028 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -139.1 -38.36 0.5 Allowed 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 119.212 0.915 . . . . 10.0 111.86 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -54.76 -81.16 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 123.048 1.404 . . . . 10.0 110.507 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 3.2 mmp_? -110.47 -25.67 9.92 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 116.767 -1.587 . . . . 10.0 113.847 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ASN . . . . . 0.639 ' O ' HD12 ' A' ' 61' ' ' ILE . 5.2 m120 56.83 85.31 0.08 Allowed 'General case' 0 CA--C 1.537 0.477 0 O-C-N 126.41 2.319 . . . . 10.0 108.352 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -56.16 117.83 4.12 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 107.007 -1.479 . . . . 10.0 107.007 -179.548 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.639 HD12 ' O ' ' A' ' 59' ' ' ASN . 3.6 mt -128.1 114.29 34.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 CA-C-N 113.798 -1.546 . . . . 10.0 111.454 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 3.2 mtm -121.27 172.39 8.04 Favored 'General case' 0 C--O 1.214 -0.795 0 N-CA-C 104.716 -2.327 . . . . 10.0 104.716 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.407 ' HA ' ' HA ' ' A' ' 50' ' ' ILE . 0.8 OUTLIER -163.23 128.6 3.11 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 104.904 -2.258 . . . . 10.0 104.904 179.553 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 -135.02 178.63 6.88 Favored 'General case' 0 CA--C 1.515 -0.366 0 N-CA-C 114.142 1.164 . . . . 10.0 114.142 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -129.44 100.51 5.58 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 126.868 2.605 . . . . 10.0 105.457 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.1 t -43.95 146.59 0.32 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.594 0 O-C-N 125.879 1.987 . . . . 10.0 110.419 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 56.42 63.74 5.04 Favored Glycine 0 CA--C 1.526 0.78 0 CA-C-N 114.077 -1.42 . . . . 10.0 113.03 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.12 166.57 2.4 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 125.011 2.338 . . . . 10.0 116.22 -179.758 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -87.5 133.96 33.68 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 113.444 -1.707 . . . . 10.0 110.783 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -145.69 112.51 5.99 Favored 'General case' 0 C--N 1.318 -0.777 0 O-C-N 125.301 1.625 . . . . 10.0 114.1 -179.723 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 17.9 pt-20 -76.6 135.66 39.21 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 105.13 -2.174 . . . . 10.0 105.13 -179.884 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -99.9 -34.92 9.92 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 122.44 1.114 . . . . 10.0 112.511 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 75.83 -60.48 0.49 Allowed 'General case' 0 C--O 1.221 -0.418 0 CA-C-N 114.235 -1.348 . . . . 10.0 108.614 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 61.77 33.57 17.77 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 116.689 2.107 . . . . 10.0 116.689 179.807 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -59.44 125.2 22.67 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-O 123.144 1.45 . . . . 10.0 109.158 -179.863 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 75.33 133.41 0.36 Allowed Glycine 0 C--O 1.223 -0.554 0 CA-C-O 118.336 -1.258 . . . . 10.0 110.413 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.485 HG22 ' O ' ' A' ' 77' ' ' ILE . 2.8 mt 92.02 20.49 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 O-C-N 126.448 1.911 . . . . 10.0 108.711 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.554 ' HA ' HG22 ' A' ' 25' ' ' VAL . 18.4 t70 143.32 -33.84 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.74 0 O-C-N 128.659 3.724 . . . . 10.0 114.098 179.826 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 50.48 52.85 14.0 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 124.121 0.968 . . . . 10.0 112.967 -179.648 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.5 -67.65 0.57 Allowed 'General case' 0 N--CA 1.467 0.407 0 O-C-N 119.49 -2.006 . . . . 10.0 114.094 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 88.56 118.74 0.03 OUTLIER 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 102.876 -3.009 . . . . 10.0 102.876 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 4.6 p -147.4 171.25 15.77 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 123.433 1.587 . . . . 10.0 110.246 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.09 71.75 0.87 Allowed 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 100.287 -3.968 . . . . 10.0 100.287 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 6.3 m -76.77 139.53 40.43 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 118.315 2.709 . . . . 10.0 118.315 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 1.9 m -124.97 129.27 50.01 Favored 'General case' 0 C--O 1.244 0.77 0 O-C-N 125.475 1.734 . . . . 10.0 107.421 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -101.86 159.19 4.24 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.989 0 N-CA-C 104.773 -2.306 . . . . 10.0 104.773 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.4 t -145.99 167.76 22.54 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 122.75 1.262 . . . . 10.0 110.837 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' TRP . . . . . 0.468 ' HA ' HD12 ' A' ' 93' ' ' LEU . 11.1 p90 -124.32 122.61 38.18 Favored 'General case' 0 C--O 1.239 0.534 0 CA-C-N 112.815 -1.993 . . . . 10.0 107.177 179.853 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -88.97 172.52 9.07 Favored 'General case' 0 C--N 1.312 -1.053 1 N-CA-C 98.593 -4.595 . . . . 10.0 98.593 179.985 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -65.87 -27.78 73.07 Favored Glycine 0 CA--C 1.496 -1.156 0 N-CA-C 108.448 -1.861 . . . . 10.0 108.448 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 44.0 p-10 -145.66 25.88 1.3 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 118.89 1.345 . . . . 10.0 111.897 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 2.1 mtmt -153.03 -157.11 0.76 Allowed 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 108.3 -1.0 . . . . 10.0 108.3 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.468 HD12 ' HA ' ' A' ' 88' ' ' TRP . 4.4 tp -165.27 136.48 3.99 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 106.257 -1.757 . . . . 10.0 106.257 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -132.38 156.72 46.15 Favored 'General case' 0 CA--C 1.508 -0.655 0 N-CA-C 114.623 1.342 . . . . 10.0 114.623 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -133.72 145.25 49.7 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 123.129 1.442 . . . . 10.0 111.439 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 3.8 t -138.52 153.57 26.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 114.132 -1.395 . . . . 10.0 108.908 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -148.5 152.76 37.44 Favored 'General case' 0 C--O 1.246 0.878 0 CA-C-O 122.355 1.074 . . . . 10.0 108.365 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 2.8 mttp -117.62 83.54 2.01 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 114.61 -1.177 . . . . 10.0 110.122 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -152.96 87.07 0.13 Allowed Glycine 0 C--N 1.315 -0.604 0 C-N-CA 119.174 -1.489 . . . . 10.0 110.133 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 42.61 -154.81 0.02 OUTLIER 'General case' 0 C--O 1.246 0.888 0 N-CA-C 116.968 2.21 . . . . 10.0 116.968 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.401 ' N ' ' CD ' ' A' ' 101' ' ' LYS . 0.0 OUTLIER 62.66 166.65 0.12 Allowed 'General case' 0 C--O 1.217 -0.642 0 CA-C-O 124.089 1.899 . . . . 10.0 112.552 179.759 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -100.13 4.9 44.8 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-N 112.646 -2.07 . . . . 10.0 114.451 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 170.48 58.13 0.04 OUTLIER Glycine 0 C--N 1.319 -0.373 0 N-CA-C 120.02 2.768 . . . . 10.0 120.02 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.504 ' H ' ' NE ' ' A' ' 104' ' ' ARG . 0.0 OUTLIER -86.59 161.88 18.28 Favored 'General case' 0 N--CA 1.441 -0.88 0 O-C-N 125.034 1.079 . . . . 10.0 109.44 -179.943 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 127.55 154.94 8.62 Favored Glycine 0 N--CA 1.435 -1.402 0 C-N-CA 120.624 -0.798 . . . . 10.0 111.457 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -118.77 154.64 32.48 Favored 'General case' 0 CA--C 1.506 -0.734 0 C-N-CA 124.442 1.097 . . . . 10.0 110.502 -179.776 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.1 m -131.88 139.79 48.89 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-O 123.697 1.713 . . . . 10.0 107.864 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -120.94 125.31 47.1 Favored 'General case' 0 C--O 1.246 0.917 0 CA-C-N 113.249 -1.796 . . . . 10.0 108.608 -179.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 5.5 t-105 -132.27 137.03 47.34 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 106.839 -1.541 . . . . 10.0 106.839 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.414 HD11 ' CE1' ' A' ' 4' ' ' PHE . 2.1 mt -111.26 140.85 28.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 O-C-N 126.352 2.283 . . . . 10.0 117.022 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -123.82 170.56 10.42 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 104.103 -2.554 . . . . 10.0 104.103 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -33.95 -80.0 0.02 OUTLIER Glycine 0 C--O 1.241 0.59 0 O-C-N 128.152 3.407 . . . . 10.0 111.159 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -115.42 15.53 16.77 Favored 'General case' 0 CA--C 1.555 1.143 0 CA-C-N 120.157 1.978 . . . . 10.0 108.776 179.737 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -126.9 154.51 44.35 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 124.547 2.117 . . . . 10.0 112.516 -179.793 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.485 ' HB3' ' HB2' ' A' ' 130' ' ' PHE . 0.2 OUTLIER -113.42 127.55 56.15 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 111.715 -2.493 . . . . 10.0 106.525 179.863 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -110.87 79.64 1.22 Allowed 'General case' 0 C--O 1.217 -0.656 0 CA-C-O 122.305 1.05 . . . . 10.0 111.785 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 1.7 tp -80.27 148.24 30.85 Favored 'General case' 0 C--O 1.218 -0.582 0 CA-C-O 124.417 2.056 . . . . 10.0 113.493 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.412 ' HA ' ' HB3' ' A' ' 127' ' ' LYS . 0.0 OUTLIER -142.89 136.33 28.53 Favored 'General case' 0 C--O 1.219 -0.54 0 O-C-N 119.594 -1.941 . . . . 10.0 107.264 -179.835 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 7.5 mtp -138.48 151.08 47.07 Favored 'General case' 0 CA--C 1.51 -0.589 0 CA-C-O 122.941 1.353 . . . . 10.0 108.111 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.421 ' O ' ' HB2' ' A' ' 121' ' ' ALA . 2.8 mtt-85 -143.58 166.48 24.71 Favored 'General case' 0 CA--C 1.512 -0.512 0 O-C-N 119.852 -1.78 . . . . 10.0 112.338 -179.777 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 121' ' ' ALA . . . . . 0.421 ' HB2' ' O ' ' A' ' 120' ' ' ARG . . . 178.57 122.66 0.05 OUTLIER 'General case' 0 CA--C 1.503 -0.848 0 CA-C-N 114.418 -1.264 . . . . 10.0 109.212 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 50.92 41.19 26.68 Favored 'General case' 0 C--O 1.244 0.791 0 O-C-N 125.96 2.037 . . . . 10.0 115.947 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 84.12 -7.37 71.55 Favored Glycine 0 C--N 1.341 0.811 0 O-C-N 124.646 1.216 . . . . 10.0 115.165 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 12.7 t -91.31 126.85 43.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 CA-C-O 117.642 -1.17 . . . . 10.0 111.409 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 85.6 m -111.86 111.35 22.24 Favored 'General case' 0 N--CA 1.441 -0.904 0 O-C-N 126.725 2.516 . . . . 10.0 115.83 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 1.4 t -110.07 156.39 20.61 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 104.996 -2.224 . . . . 10.0 104.996 -179.909 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' LYS . . . . . 0.412 ' HB3' ' HA ' ' A' ' 118' ' ' GLU . 0.0 OUTLIER -168.07 177.92 5.32 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 123.306 1.527 . . . . 10.0 110.163 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 12.2 mt-30 -149.83 150.42 31.95 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 112.789 -2.005 . . . . 10.0 114.092 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 28.1 t -111.32 115.66 50.45 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.788 0 N-CA-C 105.199 -2.149 . . . . 10.0 105.199 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' PHE . . . . . 0.485 ' HB2' ' HB3' ' A' ' 115' ' ' LEU . 55.1 m-85 -110.39 162.55 14.55 Favored 'General case' 0 CA--C 1.51 -0.573 0 O-C-N 125.584 1.802 . . . . 10.0 111.809 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.413 ' HB3' ' HE3' ' A' ' 9' ' ' LYS . 0.0 OUTLIER -129.45 115.22 17.18 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 105.879 -1.897 . . . . 10.0 105.879 179.866 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 9.9 tttp -76.45 116.78 17.46 Favored 'General case' 0 C--O 1.216 -0.675 0 O-C-N 125.524 1.765 . . . . 10.0 108.506 -179.81 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.63 -37.39 77.55 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.678 0 CA-C-N 114.127 -1.397 . . . . 10.0 112.117 -179.741 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 . . . . . 0 N--CA 1.446 -0.641 0 CA-C-O 117.195 -1.384 . . . . 10.0 107.86 179.849 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo . . . . . 0 CA--C 1.538 0.675 0 CA-C-O 123.116 1.215 . . . . 10.0 112.714 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -109.3 17.14 7.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 C-N-CA 124.297 1.039 . . . . 10.0 110.017 -179.901 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -72.04 145.45 48.26 Favored 'General case' 0 C--O 1.238 0.497 0 CA-C-O 123.167 1.46 . . . . 10.0 111.419 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.447 ' CD1' HD11 ' A' ' 110' ' ' ILE . 57.0 m-85 -96.5 -28.23 14.5 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 116.899 2.185 . . . . 10.0 116.899 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 47.0 p-10 -64.48 139.79 58.8 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 117.985 2.587 . . . . 10.0 117.985 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -174.23 -130.57 1.3 Allowed Glycine 0 N--CA 1.452 -0.267 0 N-CA-C 117.179 1.632 . . . . 10.0 117.179 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -160.84 98.15 1.19 Allowed 'General case' 0 C--O 1.239 0.533 0 N-CA-C 105.709 -1.96 . . . . 10.0 105.709 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.562 ' CZ3' ' HG2' ' A' ' 132' ' ' LYS . 0.8 OUTLIER -90.15 139.64 30.43 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 116.253 -1.832 . . . . 10.0 107.697 179.9 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -123.04 8.88 9.28 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 125.09 1.494 . . . . 10.0 111.481 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 61.77 135.09 0.01 OUTLIER 'General case' 0 C--N 1.309 -1.163 0 O-C-N 126.718 2.511 . . . . 10.0 117.527 179.101 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.5 tp -113.05 -56.08 2.45 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 107.854 -1.165 . . . . 10.0 107.854 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.1 p -154.01 -178.25 6.96 Favored 'General case' 0 C--O 1.242 0.679 0 N-CA-C 115.522 1.675 . . . . 10.0 115.522 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -154.17 164.02 39.18 Favored 'General case' 0 C--O 1.238 0.457 0 N-CA-C 105.002 -2.222 . . . . 10.0 105.002 -179.484 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -156.02 18.6 0.37 Allowed 'General case' 0 C--O 1.234 0.237 0 O-C-N 118.545 -2.597 . . . . 10.0 114.658 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.415 ' CB ' ' HA ' ' A' ' 126' ' ' CYS . 0.3 OUTLIER -163.01 26.52 0.09 Allowed 'General case' 0 C--O 1.241 0.651 0 O-C-N 125.34 1.65 . . . . 10.0 114.332 -179.873 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.634 ' CE2' ' HB1' ' A' ' 33' ' ' ALA . 2.6 t80 -62.75 -52.59 62.61 Favored 'General case' 0 C--O 1.243 0.718 0 C-N-CA 124.627 1.171 . . . . 10.0 113.71 -179.591 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.0 tm-20 -69.01 -34.13 74.77 Favored 'General case' 0 CA--C 1.511 -0.557 0 N-CA-C 115.151 1.537 . . . . 10.0 115.151 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -77.0 -23.3 52.25 Favored 'General case' 0 C--N 1.32 -0.715 0 O-C-N 124.91 1.381 . . . . 10.0 108.034 -179.746 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -78.1 -32.59 50.63 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 107.994 -1.113 . . . . 10.0 107.994 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 81.8 mt -75.9 -30.4 58.77 Favored 'General case' 0 C--O 1.217 -0.656 0 O-C-N 119.926 -1.733 . . . . 10.0 111.876 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.2 ttm180 -68.96 -27.09 65.42 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 124.11 0.964 . . . . 10.0 110.245 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.26 -49.01 54.24 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.189 1.795 . . . . 10.0 109.308 -179.687 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.566 HD13 ' HB3' ' A' ' 78' ' ' ASP . 2.6 mt -74.9 -15.47 60.7 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 125.915 2.009 . . . . 10.0 111.793 179.857 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 69.15 28.94 4.84 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 115.396 1.628 . . . . 10.0 115.396 -179.7 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 6.1 m -62.0 178.12 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 N-CA-C 107.675 -1.231 . . . . 10.0 107.675 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -62.32 152.07 34.83 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 116.327 1.973 . . . . 10.0 116.327 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 14.8 p -70.74 -32.29 48.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 N-CA-C 115.072 1.508 . . . . 10.0 115.072 179.624 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -73.72 -25.04 60.01 Favored 'General case' 0 C--O 1.243 0.725 0 O-C-N 124.989 1.431 . . . . 10.0 109.171 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -73.99 -50.48 19.69 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-N 114.024 -1.444 . . . . 10.0 108.826 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.49 -25.37 68.23 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 125.145 1.378 . . . . 10.0 113.491 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -73.92 -44.84 53.78 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 113.166 -1.833 . . . . 10.0 112.12 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.418 HG22 ' CD2' ' A' ' 36' ' ' LEU . 1.7 mm -69.31 -54.85 17.67 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 O-C-N 120.093 -1.629 . . . . 10.0 110.755 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.634 ' HB1' ' CE2' ' A' ' 16' ' ' PHE . . . -45.57 -28.13 0.89 Allowed 'General case' 0 C--O 1.216 -0.696 0 N-CA-C 115.874 1.805 . . . . 10.0 115.874 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 13.9 t-20 -86.15 -2.47 58.38 Favored 'General case' 0 N--CA 1.44 -0.968 0 O-C-N 119.995 -1.691 . . . . 10.0 113.908 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 15.7 mt -104.43 -20.15 13.81 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 108.942 -0.762 . . . . 10.0 108.942 179.726 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.418 ' CD2' HG22 ' A' ' 32' ' ' ILE . 0.4 OUTLIER -128.29 173.66 9.96 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 113.422 0.897 . . . . 10.0 113.422 -179.953 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 6.5 ptpt -151.32 155.19 34.46 Favored Pre-proline 0 N--CA 1.478 0.949 0 N-CA-C 104.236 -2.505 . . . . 10.0 104.236 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo -101.74 162.56 0.35 Allowed 'Trans proline' 0 N--CA 1.459 -0.547 1 C-N-CA 126.799 4.999 . . . . 10.0 116.672 -179.803 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -110.42 -175.86 2.83 Favored 'General case' 0 C--O 1.239 0.55 0 N-CA-C 104.927 -2.249 . . . . 10.0 104.927 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.76 140.78 11.1 Favored 'General case' 0 C--N 1.309 -1.153 0 O-C-N 120.517 -1.364 . . . . 10.0 111.73 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -132.16 135.84 46.66 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 105.225 -2.139 . . . . 10.0 105.225 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.406 HG13 ' NE1' ' A' ' 8' ' ' TRP . 0.9 OUTLIER -121.52 141.21 42.92 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.026 0 N-CA-C 109.265 -0.642 . . . . 10.0 109.265 -179.926 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.5 t -137.86 135.35 45.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 105.791 -1.929 . . . . 10.0 105.791 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -126.47 113.3 16.65 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 121.482 0.658 . . . . 10.0 109.85 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -82.08 -17.57 46.09 Favored 'General case' 0 C--O 1.219 -0.543 0 N-CA-C 106.757 -1.572 . . . . 10.0 106.757 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 140.44 -110.67 0.69 Allowed Glycine 0 CA--C 1.521 0.451 0 N-CA-C 107.619 -2.192 . . . . 10.0 107.619 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 60.0 m-20 -71.24 -13.54 61.94 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 119.299 -2.294 . . . . 10.0 108.541 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 31.7 m170 -109.78 144.83 37.66 Favored 'General case' 0 N--CA 1.439 -0.997 0 N-CA-C 105.372 -2.084 . . . . 10.0 105.372 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.528 ' C ' HD12 ' A' ' 50' ' ' ILE . 16.5 ttt -133.14 154.95 50.13 Favored 'General case' 0 C--N 1.317 -0.812 0 O-C-N 125.807 1.942 . . . . 10.0 111.592 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.528 HD12 ' C ' ' A' ' 49' ' ' MET . 4.6 mp -142.26 132.11 23.49 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.058 0 N-CA-C 107.161 -1.422 . . . . 10.0 107.161 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -120.24 125.56 74.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 CA-C-O 117.355 -1.307 . . . . 10.0 108.785 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.401 ' HB2' HD21 ' A' ' 54' ' ' LEU . 3.5 ptp180 -115.83 128.59 55.94 Favored 'General case' 0 C--O 1.221 -0.413 0 O-C-N 126.058 2.099 . . . . 10.0 108.27 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.611 ' C ' HD22 ' A' ' 54' ' ' LEU . 76.9 m -123.99 113.07 17.95 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 104.861 -2.274 . . . . 10.0 104.861 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.611 HD22 ' C ' ' A' ' 53' ' ' THR . 2.5 mm? -119.51 140.3 50.71 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 119.52 3.156 . . . . 10.0 119.52 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -165.29 28.16 0.06 Allowed 'General case' 0 N--CA 1.445 -0.704 0 N-CA-C 109.273 -0.64 . . . . 10.0 109.273 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.49 ' O ' HG22 ' A' ' 56' ' ' THR . 9.0 m 44.14 48.21 7.58 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 112.647 0.61 . . . . 10.0 112.647 179.814 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -159.98 -70.89 0.07 Allowed 'General case' 0 C--O 1.247 0.946 0 N-CA-C 105.849 -1.908 . . . . 10.0 105.849 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.408 ' NE ' ' HA ' ' A' ' 58' ' ' ARG . 0.0 OUTLIER -113.11 118.26 34.25 Favored 'General case' 0 C--O 1.245 0.836 0 CA-C-N 113.628 -1.624 . . . . 10.0 109.74 -179.916 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -102.53 102.34 12.6 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.745 0.784 . . . . 10.0 109.914 179.832 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.699 ' OH ' HD11 ' A' ' 74' ' ' LEU . 0.1 OUTLIER -87.34 107.76 18.67 Favored 'General case' 0 C--O 1.212 -0.88 0 N-CA-C 105.33 -2.1 . . . . 10.0 105.33 -179.698 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 5.2 mt -135.84 141.48 41.82 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 CA-C-O 122.463 1.125 . . . . 10.0 111.312 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 28.3 mmt -149.57 178.16 9.09 Favored 'General case' 0 CA--C 1.505 -0.76 0 N-CA-C 104.549 -2.389 . . . . 10.0 104.549 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 58.6 m-20 -142.16 69.46 1.32 Allowed 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 102.638 -3.097 . . . . 10.0 102.638 -179.826 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 6.0 m-30 -70.58 146.12 50.31 Favored 'General case' 0 C--O 1.243 0.732 0 N-CA-C 115.398 1.629 . . . . 10.0 115.398 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -116.93 120.79 39.53 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 107.046 -1.465 . . . . 10.0 107.046 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 43.9 t -65.04 100.95 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.723 0 C-N-CA 123.942 0.897 . . . . 10.0 110.871 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 94.61 68.3 1.04 Allowed Glycine 0 C--O 1.221 -0.695 0 O-C-N 127.868 3.23 . . . . 10.0 112.027 -179.877 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -167.3 136.46 2.73 Favored 'General case' 0 C--O 1.231 0.091 0 O-C-N 119.472 -2.193 . . . . 10.0 114.851 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -84.57 136.06 33.94 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 118.485 -1.286 . . . . 10.0 111.311 179.828 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 44.2 p90 -158.62 128.37 5.79 Favored 'General case' 0 C--N 1.322 -0.617 0 O-C-N 120.612 -1.305 . . . . 10.0 109.268 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -61.9 155.14 24.21 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 123.719 1.723 . . . . 10.0 110.902 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 14.8 tp10 -120.95 67.49 0.86 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 113.139 -1.846 . . . . 10.0 113.564 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -68.97 71.82 0.24 Allowed 'General case' 0 C--N 1.316 -0.85 0 C-N-CA 125.395 1.478 . . . . 10.0 107.107 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.699 HD11 ' OH ' ' A' ' 60' ' ' TYR . 0.4 OUTLIER -76.58 137.16 39.35 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 114.082 -1.417 . . . . 10.0 113.721 -179.807 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 51.0 p -152.78 50.91 0.75 Allowed 'General case' 0 C--O 1.242 0.707 0 N-CA-C 106.165 -1.791 . . . . 10.0 106.165 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -128.91 -59.18 0.11 Allowed Glycine 0 N--CA 1.435 -1.425 0 O-C-N 125.266 1.604 . . . . 10.0 112.417 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.492 HG22 ' N ' ' A' ' 78' ' ' ASP . 46.3 mt -112.46 -87.15 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.539 0 O-C-N 124.667 0.863 . . . . 10.0 109.692 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.566 ' HB3' HD13 ' A' ' 23' ' ' LEU . 1.3 p30 -81.26 3.82 22.61 Favored 'General case' 0 CA--C 1.51 -0.566 0 N-CA-C 115.298 1.592 . . . . 10.0 115.298 -179.725 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.8 p30 44.68 -155.76 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 114.545 1.313 . . . . 10.0 114.545 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 72.84 130.77 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 119.477 1.035 . . . . 10.0 111.841 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 6.3 ttpm? -87.73 122.45 31.41 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 104.783 -2.303 . . . . 10.0 104.783 -179.847 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -121.59 172.4 8.13 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 107.601 -1.259 . . . . 10.0 107.601 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' MET . . . . . 0.404 ' CB ' ' HB2' ' A' ' 98' ' ' LYS . 0.0 OUTLIER -116.48 126.6 53.6 Favored 'General case' 0 CA--C 1.512 -0.498 1 N-CA-C 98.902 -4.481 . . . . 10.0 98.902 -179.954 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 33.9 m -127.1 140.11 52.5 Favored 'General case' 0 C--N 1.311 -1.097 0 O-C-N 121.189 -0.945 . . . . 10.0 113.513 -179.681 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 2.1 m -126.82 101.54 6.64 Favored 'General case' 0 C--N 1.316 -0.872 0 O-C-N 125.052 1.47 . . . . 10.0 109.345 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 1.3 m -81.97 138.13 20.01 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.954 0 N-CA-C 101.332 -3.581 . . . . 10.0 101.332 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 13.7 t -145.89 167.13 24.0 Favored 'General case' 0 C--N 1.317 -0.84 0 C-N-CA 119.364 -0.935 . . . . 10.0 111.037 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 5.7 t90 -97.28 129.23 44.61 Favored 'General case' 0 C--N 1.314 -0.956 0 O-C-N 125.707 1.879 . . . . 10.0 106.554 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -139.85 98.0 3.37 Favored 'General case' 0 CA--C 1.505 -0.771 0 N-CA-C 101.519 -3.512 . . . . 10.0 101.519 -179.773 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 52.19 -130.77 37.43 Favored Glycine 0 N--CA 1.437 -1.29 0 N-CA-C 104.762 -3.335 . . . . 10.0 104.762 179.707 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -89.37 24.23 2.29 Favored 'General case' 0 N--CA 1.446 -0.628 0 O-C-N 124.288 0.64 . . . . 10.0 112.205 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.7 167.42 12.07 Favored 'General case' 0 CA--C 1.508 -0.641 0 CA-C-O 121.601 0.715 . . . . 10.0 110.651 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -125.05 99.64 6.21 Favored 'General case' 0 C--O 1.241 0.635 0 N-CA-C 102.85 -3.018 . . . . 10.0 102.85 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 18.4 mm-40 -85.76 137.0 33.1 Favored 'General case' 0 CA--C 1.503 -0.851 0 O-C-N 124.756 1.285 . . . . 10.0 113.188 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 7.1 t -137.94 123.86 20.11 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 108.33 -0.989 . . . . 10.0 108.33 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 16.1 t -133.93 117.12 25.03 Favored 'Isoleucine or valine' 0 C--O 1.245 0.84 0 CA-C-N 112.939 -1.937 . . . . 10.0 109.256 -179.783 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 17.3 mt-30 -90.54 143.23 26.95 Favored 'General case' 0 C--O 1.243 0.758 0 N-CA-C 107.235 -1.394 . . . . 10.0 107.235 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.404 ' HB2' ' CB ' ' A' ' 83' ' ' MET . 0.6 OUTLIER -85.18 17.07 3.17 Favored 'General case' 0 CA--C 1.508 -0.643 0 O-C-N 124.249 0.968 . . . . 10.0 113.255 179.973 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -77.79 -178.08 48.05 Favored Glycine 0 N--CA 1.435 -1.37 0 C-N-CA 118.231 -1.937 . . . . 10.0 109.816 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -70.76 164.06 25.95 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 113.681 0.993 . . . . 10.0 113.681 -179.779 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 15.0 mttm 82.95 -179.91 0.05 Allowed 'General case' 0 CA--C 1.54 0.575 0 O-C-N 125.773 1.921 . . . . 10.0 112.401 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -108.17 130.76 55.11 Favored 'General case' 0 C--O 1.223 -0.301 0 O-C-N 124.76 1.288 . . . . 10.0 112.306 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 106.09 -20.55 35.47 Favored Glycine 0 C--O 1.215 -1.057 0 N-CA-C 118.338 2.095 . . . . 10.0 118.338 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 10.2 mtt180 -40.98 116.35 0.71 Allowed 'General case' 0 C--N 1.327 -0.407 0 O-C-N 125.956 1.621 . . . . 10.0 110.999 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 125.74 170.95 13.11 Favored Glycine 0 C--O 1.218 -0.898 0 N-CA-C 107.933 -2.067 . . . . 10.0 107.933 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -130.92 174.72 9.71 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 123.036 1.398 . . . . 10.0 110.038 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 48.6 m -130.97 133.69 46.03 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 104.672 -2.344 . . . . 10.0 104.672 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -122.08 125.73 46.86 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 118.254 -0.879 . . . . 10.0 110.699 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' TRP . . . . . 0.496 ' CD1' ' C ' ' A' ' 109' ' ' TRP . 0.0 OUTLIER -138.45 145.14 40.53 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 126.097 2.123 . . . . 10.0 106.74 -179.98 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.447 HD11 ' CD1' ' A' ' 4' ' ' PHE . 4.7 mt -105.36 137.9 32.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 124.184 1.945 . . . . 10.0 115.646 179.718 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -104.45 165.95 10.72 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 104.611 -2.366 . . . . 10.0 104.611 179.463 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -39.55 -73.07 0.19 Allowed Glycine 0 N--CA 1.448 -0.521 0 O-C-N 126.015 2.072 . . . . 10.0 111.414 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -122.46 35.98 4.75 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 121.576 0.703 . . . . 10.0 110.248 -179.823 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -150.45 164.12 36.69 Favored 'General case' 0 C--O 1.241 0.62 0 O-C-N 119.402 -2.061 . . . . 10.0 109.722 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -119.2 120.99 38.68 Favored 'General case' 0 C--N 1.314 -0.965 0 N-CA-C 104.351 -2.463 . . . . 10.0 104.351 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -119.0 91.1 3.47 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 119.348 0.976 . . . . 10.0 108.517 179.85 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.513 HD12 ' H ' ' A' ' 118' ' ' GLU . 30.5 tp -86.98 151.2 23.49 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 124.55 1.156 . . . . 10.0 109.745 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.513 ' H ' HD12 ' A' ' 117' ' ' LEU . 34.6 tt0 -139.46 102.94 4.59 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 114.924 -1.034 . . . . 10.0 109.966 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 4.7 mtp -97.54 154.33 17.58 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 108.437 -0.949 . . . . 10.0 108.437 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -146.89 154.78 41.7 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 114.093 1.146 . . . . 10.0 114.093 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -170.02 118.53 0.59 Allowed 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 105.027 -2.212 . . . . 10.0 105.027 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 63.64 43.31 5.78 Favored 'General case' 0 C--O 1.242 0.7 0 O-C-N 126.664 2.477 . . . . 10.0 113.093 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 64.47 15.92 59.98 Favored Glycine 0 C--O 1.22 -0.763 0 O-C-N 121.236 -0.915 . . . . 10.0 115.37 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 2.6 t -105.16 123.25 59.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 N-CA-C 108.064 -1.087 . . . . 10.0 108.064 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 85.1 m -93.78 117.47 30.14 Favored 'General case' 0 N--CA 1.441 -0.903 0 O-C-N 123.82 0.7 . . . . 10.0 112.484 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 126' ' ' CYS . . . . . 0.415 ' HA ' ' CB ' ' A' ' 15' ' ' ASN . 51.6 t -116.88 104.93 11.8 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 106.487 -1.672 . . . . 10.0 106.487 179.808 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 28.9 mtpt -106.56 152.38 23.78 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 122.396 1.093 . . . . 10.0 111.822 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -135.3 107.91 7.43 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 108.206 -1.035 . . . . 10.0 108.206 -179.579 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 76.8 t -83.14 122.37 37.38 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.73 0 O-C-N 125.555 1.784 . . . . 10.0 107.694 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 59.6 m-85 -112.07 -172.38 2.03 Favored 'General case' 0 N--CA 1.45 -0.457 0 O-C-N 125.173 1.545 . . . . 10.0 108.506 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 24.1 tptp -151.87 122.48 7.4 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 123.542 1.639 . . . . 10.0 107.745 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' LYS . . . . . 0.562 ' HG2' ' CZ3' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -78.27 110.78 13.59 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-N 115.01 -0.995 . . . . 10.0 108.866 -179.832 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 4.2 t -100.87 -1.85 9.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 118.209 -0.901 . . . . 10.0 109.313 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.44 -0.936 0 O-C-N 126.044 2.09 . . . . 10.0 110.866 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_exo . . . . . 0 N--CA 1.491 1.368 0 N-CA-C 110.989 -0.427 . . . . 10.0 110.989 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -139.41 -43.21 0.29 Allowed 'Isoleucine or valine' 0 C--O 1.242 0.709 0 CA-C-N 113.28 -1.782 . . . . 10.0 112.589 -179.703 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 170.16 -66.36 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.561 0 O-C-N 125.465 1.728 . . . . 10.0 112.511 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.434 ' CE1' HD12 ' A' ' 110' ' ' ILE . 84.9 m-85 68.86 -49.22 0.58 Allowed 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 126.168 1.787 . . . . 10.0 114.027 -179.706 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 -47.55 113.17 0.65 Allowed 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 115.105 1.52 . . . . 10.0 115.105 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 169.96 -116.0 0.63 Allowed Glycine 0 CA--C 1.529 0.968 0 O-C-N 125.467 1.729 . . . . 10.0 113.954 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -165.66 144.4 6.15 Favored 'General case' 0 C--O 1.224 -0.243 0 N-CA-C 100.894 -3.743 . . . . 10.0 100.894 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.577 ' CE2' HD12 ' A' ' 115' ' ' LEU . 87.2 m95 -129.92 114.9 16.43 Favored 'General case' 0 C--N 1.315 -0.919 0 O-C-N 124.53 1.144 . . . . 10.0 109.331 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 9.1 tptt -99.01 116.91 32.32 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.231 -1.35 . . . . 10.0 110.698 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.467 ' HA ' ' HA ' ' A' ' 130' ' ' PHE . 0.0 OUTLIER -61.46 135.51 57.7 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-O 122.234 1.016 . . . . 10.0 111.483 179.265 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 15.0 tp -117.02 -45.02 2.77 Favored 'General case' 0 CA--C 1.514 -0.441 0 O-C-N 120.611 -1.306 . . . . 10.0 111.436 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -122.29 156.93 32.82 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 123.977 1.846 . . . . 10.0 113.992 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -148.43 120.04 8.01 Favored 'General case' 0 CA--C 1.508 -0.666 0 CA-C-N 112.098 -2.319 . . . . 10.0 107.51 179.683 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.5 mt-10 -101.49 -71.57 0.71 Allowed 'General case' 0 C--N 1.319 -0.76 0 C-N-CA 122.861 0.465 . . . . 10.0 112.169 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 10.3 m-20 -107.18 56.38 0.64 Allowed 'General case' 0 C--O 1.24 0.586 0 CA-C-O 123.123 1.439 . . . . 10.0 112.893 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -71.26 -49.75 39.87 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 118.16 -2.838 . . . . 10.0 111.088 179.749 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -64.62 -36.63 84.88 Favored 'General case' 0 C--N 1.323 -0.565 0 O-C-N 119.396 -2.065 . . . . 10.0 115.633 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.68 -28.92 64.06 Favored 'General case' 0 C--O 1.216 -0.701 0 CA-C-O 122.95 1.357 . . . . 10.0 111.752 179.508 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.429 ' CE1' HD11 ' A' ' 23' ' ' LEU . 4.5 t80 -67.58 -42.96 81.7 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 113.142 -1.844 . . . . 10.0 111.447 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.518 ' HA ' HD12 ' A' ' 23' ' ' LEU . 46.9 mt -75.73 -22.35 56.65 Favored 'General case' 0 C--O 1.212 -0.902 0 O-C-N 120.989 -1.07 . . . . 10.0 110.817 179.739 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.34 -21.53 56.03 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 112.883 -1.962 . . . . 10.0 106.44 179.682 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.8 -35.71 59.98 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-O 125.194 2.426 . . . . 10.0 111.151 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.518 HD12 ' HA ' ' A' ' 20' ' ' LEU . 0.5 OUTLIER -89.41 -7.74 54.51 Favored 'General case' 0 CA--C 1.546 0.808 0 O-C-N 120.265 -1.522 . . . . 10.0 114.618 179.753 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 64.78 38.34 6.84 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 124.232 1.968 . . . . 10.0 113.606 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.555 ' CG2' HD23 ' A' ' 29' ' ' LEU . 0.3 OUTLIER -68.22 160.47 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.709 0 N-CA-C 105.161 -2.162 . . . . 10.0 105.161 -179.909 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 13.0 p30 -63.0 160.14 15.62 Favored 'General case' 0 C--O 1.242 0.663 0 O-C-N 125.412 1.695 . . . . 10.0 114.557 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -67.95 -35.24 71.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 N-CA-C 115.925 1.824 . . . . 10.0 115.925 -179.365 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.449 ' O ' HD12 ' A' ' 32' ' ' ILE . . . -72.66 -34.72 67.44 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 121.259 -0.9 . . . . 10.0 112.086 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.641 HD21 HG22 ' A' ' 77' ' ' ILE . 32.8 tp -66.18 -31.02 71.61 Favored 'General case' 0 C--N 1.32 -0.679 0 O-C-N 120.153 -1.592 . . . . 10.0 112.093 -179.719 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 7.7 ttp180 -78.04 -29.83 49.55 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 113.757 -1.565 . . . . 10.0 109.563 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -78.86 -41.08 30.82 Favored 'General case' 0 N--CA 1.466 0.328 0 O-C-N 124.431 1.082 . . . . 10.0 111.608 -179.783 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.449 HD12 ' O ' ' A' ' 28' ' ' ALA . 1.2 mp -74.72 -30.47 24.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 CA-C-N 113.698 -1.592 . . . . 10.0 109.449 -179.788 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -76.8 -52.23 9.91 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 115.691 1.737 . . . . 10.0 115.691 179.792 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 16.8 p30 -45.65 -23.96 0.3 Allowed 'General case' 0 C--O 1.217 -0.628 0 N-CA-C 115.409 1.633 . . . . 10.0 115.409 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.0 mt -73.56 -46.95 44.37 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-O 124.198 1.951 . . . . 10.0 111.1 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.6 pp -97.51 -178.91 4.29 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 113.783 -1.553 . . . . 10.0 109.815 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 18.8 mttt -142.43 138.53 16.52 Favored Pre-proline 0 N--CA 1.468 0.438 0 N-CA-C 104.293 -2.484 . . . . 10.0 104.293 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -68.83 108.83 1.98 Allowed 'Trans proline' 0 N--CA 1.45 -1.055 0 C-N-CA 124.782 3.655 . . . . 10.0 119.018 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -88.26 136.32 33.03 Favored 'General case' 0 C--O 1.219 -0.521 0 N-CA-C 105.38 -2.082 . . . . 10.0 105.38 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.9 mttm -119.06 138.81 52.61 Favored 'General case' 0 C--O 1.211 -0.922 0 CA-C-O 123.417 1.579 . . . . 10.0 112.29 179.682 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -134.61 128.36 33.03 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 103.544 -2.761 . . . . 10.0 103.544 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 17.5 mt -118.01 136.84 53.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 O-C-N 125.843 1.964 . . . . 10.0 110.992 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 48.7 t -128.79 103.84 10.28 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.38 0 N-CA-C 105.162 -2.162 . . . . 10.0 105.162 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.26 142.84 27.92 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-O 123.374 1.559 . . . . 10.0 111.804 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -132.45 167.45 19.93 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 102.725 -3.065 . . . . 10.0 102.725 -179.699 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -67.9 118.43 9.65 Favored Glycine 0 C--O 1.246 0.862 0 CA-C-O 117.685 -1.619 . . . . 10.0 109.443 179.813 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 62.74 18.75 10.91 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 119.198 1.499 . . . . 10.0 112.695 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' HIS . . . . . 0.597 ' CD2' HE21 ' A' ' 65' ' ' GLN . 0.0 OUTLIER -156.76 119.98 4.15 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 105.837 -1.912 . . . . 10.0 105.837 179.954 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.62 ' CE ' HD11 ' A' ' 93' ' ' LEU . 5.6 ttp -118.88 159.61 23.45 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 114.794 -1.094 . . . . 10.0 112.226 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.63 ' C ' HD13 ' A' ' 51' ' ' ILE . 35.0 mt -145.41 135.45 18.59 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 N-CA-C 108.095 -1.076 . . . . 10.0 108.095 179.746 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.63 HD13 ' C ' ' A' ' 50' ' ' ILE . 2.3 mm -117.42 129.17 74.33 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 N-CA-C 105.262 -2.125 . . . . 10.0 105.262 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.9 mtp-105 -121.85 106.26 11.11 Favored 'General case' 0 N--CA 1.437 -1.091 0 O-C-N 124.338 1.024 . . . . 10.0 113.588 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.3 m -80.81 128.78 34.05 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 101.17 -3.641 . . . . 10.0 101.17 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 64.2 mt -132.94 76.46 1.68 Allowed 'General case' 0 N--CA 1.448 -0.549 1 N-CA-C 122.559 4.281 . . . . 10.0 122.559 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -110.18 129.33 55.73 Favored 'General case' 0 C--O 1.242 0.66 0 C-N-CA 124.992 1.317 . . . . 10.0 107.942 -179.737 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 22.9 p -61.41 89.11 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.728 0 O-C-N 125.145 1.528 . . . . 10.0 109.465 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 3.0 t80 174.11 -69.52 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 126.796 2.56 . . . . 10.0 109.71 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 40.2 ttm180 -148.21 105.72 3.67 Favored 'General case' 0 C--N 1.344 0.368 0 O-C-N 125.246 1.591 . . . . 10.0 114.758 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -91.04 123.86 34.83 Favored 'General case' 0 C--N 1.319 -0.722 0 O-C-N 125.182 1.551 . . . . 10.0 112.668 -179.746 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.407 ' CD1' ' O ' ' A' ' 60' ' ' TYR . 0.1 OUTLIER -118.09 120.68 38.49 Favored 'General case' 0 C--O 1.211 -0.931 0 N-CA-C 104.041 -2.577 . . . . 10.0 104.041 179.697 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.0 mm -108.56 156.61 9.08 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.476 0 O-C-N 119.049 -2.282 . . . . 10.0 111.895 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.49 ' O ' HG23 ' A' ' 50' ' ' ILE . 0.7 OUTLIER -136.18 -169.07 2.35 Favored 'General case' 0 C--O 1.219 -0.551 0 CA-C-N 112.86 -1.973 . . . . 10.0 107.819 -179.938 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 12.3 t0 -170.62 77.42 0.08 Allowed 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 101.598 -3.482 . . . . 10.0 101.598 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.499 ' CD1' ' CD2' ' A' ' 70' ' ' PHE . 66.4 m-85 -62.96 175.13 0.91 Allowed 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 114.722 1.379 . . . . 10.0 114.722 -179.891 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.597 HE21 ' CD2' ' A' ' 48' ' ' HIS . 1.7 mm-40 -134.75 94.05 3.12 Favored 'General case' 0 C--O 1.217 -0.65 0 N-CA-C 104.451 -2.425 . . . . 10.0 104.451 179.517 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 5.3 t -59.99 120.12 5.29 Favored 'Isoleucine or valine' 0 C--O 1.245 0.862 0 O-C-N 124.268 0.98 . . . . 10.0 112.961 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 105.66 23.35 7.56 Favored Glycine 0 CA--C 1.532 1.149 0 CA-C-N 114.903 -1.044 . . . . 10.0 114.957 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -172.43 143.5 1.4 Allowed 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 116.795 -1.574 . . . . 10.0 114.701 179.78 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.3 118.31 3.72 Favored 'General case' 0 C--N 1.319 -0.747 0 O-C-N 125.333 1.646 . . . . 10.0 108.61 179.757 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.499 ' CD2' ' CD1' ' A' ' 64' ' ' PHE . 81.8 t80 -91.83 -34.29 14.61 Favored 'General case' 0 C--O 1.239 0.525 0 CA-C-N 113.122 -1.854 . . . . 10.0 112.824 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 72.6 161.76 0.25 Allowed 'General case' 0 C--O 1.217 -0.649 0 N-CA-C 105.513 -2.032 . . . . 10.0 105.513 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.492 ' OE1' HD23 ' A' ' 74' ' ' LEU . 32.8 mt-10 -136.85 -46.92 0.59 Allowed 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 114.779 1.4 . . . . 10.0 114.779 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 56.52 28.03 13.19 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 108.405 -0.961 . . . . 10.0 108.405 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.498 HD13 ' H ' ' A' ' 75' ' ' THR . 0.2 OUTLIER -39.57 143.25 0.23 Allowed 'General case' 0 C--N 1.313 -1.009 0 N-CA-C 116.917 2.191 . . . . 10.0 116.917 -179.95 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.498 ' H ' HD13 ' A' ' 74' ' ' LEU . 0.2 OUTLIER -165.84 107.62 0.75 Allowed 'General case' 0 C--O 1.241 0.626 0 N-CA-C 107.314 -1.365 . . . . 10.0 107.314 179.755 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 162.26 -54.88 0.3 Allowed Glycine 0 N--CA 1.438 -1.177 0 N-CA-C 108.988 -1.645 . . . . 10.0 108.988 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.641 HG22 HD21 ' A' ' 29' ' ' LEU . 1.2 pt -121.77 142.94 36.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 N-CA-C 103.441 -2.8 . . . . 10.0 103.441 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.431 ' HA ' HG23 ' A' ' 25' ' ' VAL . 23.5 t0 64.7 -68.5 0.1 Allowed 'General case' 0 N--CA 1.443 -0.804 0 O-C-N 125.712 1.883 . . . . 10.0 113.918 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 81.83 70.52 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.572 0 O-C-N 126.309 2.255 . . . . 10.0 111.46 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 6.3 mtm180 -121.68 -171.96 2.33 Favored 'General case' 0 C--O 1.236 0.358 0 O-C-N 120.506 -1.371 . . . . 10.0 112.733 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 5.4 mtpm? -139.27 135.77 34.2 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 103.439 -2.801 . . . . 10.0 103.439 -179.743 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 27.5 p -172.22 159.08 4.7 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-O 123.014 1.388 . . . . 10.0 108.993 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -107.05 108.45 19.94 Favored 'General case' 0 N--CA 1.441 -0.923 1 N-CA-C 98.381 -4.674 . . . . 10.0 98.381 -179.726 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 17.7 m -105.04 112.79 26.05 Favored 'General case' 0 N--CA 1.445 -0.693 0 O-C-N 126.805 2.566 . . . . 10.0 116.641 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 25.5 m -106.72 115.66 30.57 Favored 'General case' 0 N--CA 1.439 -0.979 0 O-C-N 125.892 1.995 . . . . 10.0 109.284 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 58.1 t -86.76 143.21 11.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 104.625 -2.361 . . . . 10.0 104.625 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 39.1 t -163.73 133.17 4.01 Favored 'General case' 0 C--O 1.243 0.759 0 CA-C-N 113.986 -1.461 . . . . 10.0 111.712 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -82.61 126.22 32.07 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 119.573 -0.851 . . . . 10.0 110.08 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -75.28 -37.95 60.65 Favored 'General case' 0 C--N 1.313 -1.002 1 N-CA-C 98.803 -4.518 . . . . 10.0 98.803 179.868 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 163.04 -73.75 0.19 Allowed Glycine 0 C--N 1.333 0.4 0 N-CA-C 106.015 -2.834 . . . . 10.0 106.015 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -106.57 8.45 31.29 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.092 -0.643 . . . . 10.0 109.669 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.5 121.04 21.59 Favored 'General case' 0 N--CA 1.442 -0.846 0 N-CA-C 109.195 -0.669 . . . . 10.0 109.195 -179.847 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.62 HD11 ' CE ' ' A' ' 49' ' ' MET . 0.3 OUTLIER -84.24 83.32 8.01 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 104.931 -2.248 . . . . 10.0 104.931 -179.998 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -86.05 139.45 31.14 Favored 'General case' 0 C--O 1.212 -0.881 0 CA-C-N 113.051 -1.886 . . . . 10.0 113.663 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -130.86 146.05 52.17 Favored 'General case' 0 C--O 1.241 0.631 0 CA-C-N 113.521 -1.672 . . . . 10.0 109.616 -179.753 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 9.1 p -121.16 142.41 37.43 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 N-CA-C 104.765 -2.309 . . . . 10.0 104.765 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -148.82 94.43 2.26 Favored 'General case' 0 C--N 1.321 -0.656 0 O-C-N 125.106 1.504 . . . . 10.0 109.557 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.87 119.88 8.54 Favored 'General case' 0 C--O 1.213 -0.833 0 O-C-N 121.055 -1.028 . . . . 10.0 112.448 -179.697 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -134.77 -160.37 9.08 Favored Glycine 0 C--N 1.312 -0.782 0 CA-C-O 117.808 -1.551 . . . . 10.0 110.62 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -90.33 4.48 50.67 Favored 'General case' 0 C--N 1.316 -0.873 0 O-C-N 126.7 2.059 . . . . 10.0 115.723 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 11.1 mmtt -107.86 -176.27 3.01 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 115.342 1.608 . . . . 10.0 115.342 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -67.31 -60.89 2.21 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 125.546 1.779 . . . . 10.0 108.659 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -141.91 127.28 3.22 Favored Glycine 0 C--N 1.338 0.681 0 N-CA-C 117.639 1.815 . . . . 10.0 117.639 179.775 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -144.45 127.92 16.96 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-O 117.734 -1.127 . . . . 10.0 109.343 -179.655 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 176.49 160.68 24.11 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 109.21 -1.556 . . . . 10.0 109.21 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 38.6 m0 -116.48 105.29 12.32 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 123.321 0.648 . . . . 10.0 109.726 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.4 m -98.69 77.03 2.24 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 107.518 -1.29 . . . . 10.0 107.518 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.435 ' HG3' HD13 ' A' ' 117' ' ' LEU . 14.5 mp0 -72.02 111.69 7.47 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 122.743 1.259 . . . . 10.0 108.468 -179.754 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 4.4 t90 -113.53 109.31 18.44 Favored 'General case' 0 C--O 1.214 -0.804 0 O-C-N 120.557 -1.34 . . . . 10.0 110.934 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.434 HD12 ' CE1' ' A' ' 4' ' ' PHE . 10.3 mt -76.58 148.09 7.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 116.568 2.062 . . . . 10.0 116.568 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -130.84 58.66 1.69 Allowed 'General case' 0 C--O 1.219 -0.523 0 N-CA-C 105.429 -2.063 . . . . 10.0 105.429 -179.833 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 65.66 -94.24 0.19 Allowed Glycine 0 C--O 1.22 -0.777 0 N-CA-C 109.785 -1.326 . . . . 10.0 109.785 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -89.6 29.1 1.18 Allowed 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 122.838 1.304 . . . . 10.0 111.787 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -152.63 163.9 38.72 Favored 'General case' 0 CA--C 1.503 -0.827 0 O-C-N 120.736 -1.228 . . . . 10.0 114.082 179.709 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.577 HD12 ' CE2' ' A' ' 8' ' ' TRP . 2.4 tt -134.37 108.74 8.35 Favored 'General case' 0 N--CA 1.437 -1.12 0 O-C-N 126.201 2.188 . . . . 10.0 106.375 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -103.83 99.64 9.42 Favored 'General case' 0 C--O 1.212 -0.909 0 N-CA-C 105.53 -2.026 . . . . 10.0 105.53 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.435 HD13 ' HG3' ' A' ' 108' ' ' GLN . 17.2 tp -99.7 123.75 44.28 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 115.413 1.634 . . . . 10.0 115.413 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -99.66 73.7 1.82 Allowed 'General case' 0 N--CA 1.446 -0.665 0 O-C-N 123.479 0.487 . . . . 10.0 110.424 179.846 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 13.9 ttp -57.03 140.7 48.27 Favored 'General case' 0 N--CA 1.449 -0.516 0 O-C-N 124.4 1.063 . . . . 10.0 108.143 -179.703 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -125.64 156.04 39.85 Favored 'General case' 0 C--N 1.322 -0.621 0 O-C-N 125.928 2.018 . . . . 10.0 109.884 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 178.9 117.85 0.04 OUTLIER 'General case' 0 C--O 1.216 -0.662 0 O-C-N 126.545 2.403 . . . . 10.0 109.241 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 50.85 34.64 10.64 Favored 'General case' 0 N--CA 1.445 -0.72 0 O-C-N 125.447 1.717 . . . . 10.0 113.007 -179.899 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 85.02 -3.41 87.27 Favored Glycine 0 C--N 1.339 0.707 0 CA-C-O 122.385 0.992 . . . . 10.0 113.348 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 24.7 t -95.12 111.16 25.2 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 N-CA-C 107.632 -1.247 . . . . 10.0 107.632 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 4.1 m -101.1 106.25 17.5 Favored 'General case' 0 N--CA 1.442 -0.859 0 C-N-CA 125.468 1.507 . . . . 10.0 112.004 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -105.5 147.33 28.45 Favored 'General case' 0 C--O 1.214 -0.769 0 N-CA-C 105.047 -2.205 . . . . 10.0 105.047 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 7.8 mtpt -114.55 149.5 36.39 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 123.317 0.647 . . . . 10.0 110.739 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' GLN . . . . . 0.416 ' NE2' ' CZ ' ' A' ' 130' ' ' PHE . 0.1 OUTLIER -138.52 115.8 11.11 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 118.047 -0.978 . . . . 10.0 109.553 179.942 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 21.3 t -97.26 106.24 18.25 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.28 0 O-C-N 126.659 2.475 . . . . 10.0 110.885 -179.661 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' PHE . . . . . 0.467 ' HA ' ' HA ' ' A' ' 10' ' ' MET . 96.3 m-85 -92.75 172.65 8.21 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 106.58 -1.637 . . . . 10.0 106.58 179.827 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 46.5 tptt -140.88 122.13 14.83 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 107.014 -1.476 . . . . 10.0 107.014 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 18.4 ttpt -68.04 138.84 56.14 Favored 'General case' 0 C--O 1.218 -0.572 0 CA-C-N 120.169 1.35 . . . . 10.0 107.951 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -154.03 54.41 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.241 0.646 0 O-C-N 126.069 2.106 . . . . 10.0 111.139 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.441 -0.884 0 CA-C-O 116.392 -1.766 . . . . 10.0 111.925 -179.831 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_exo . . . . . 0 N--CA 1.481 0.781 0 N-CA-C 109.684 -0.929 . . . . 10.0 109.684 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.416 ' O ' HG13 ' A' ' 2' ' ' VAL . 8.8 p -110.44 61.26 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 CA-C-O 124.07 1.891 . . . . 10.0 111.348 -179.645 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -112.49 130.3 56.04 Favored 'General case' 0 CA--C 1.521 -0.135 0 O-C-N 119.967 -1.708 . . . . 10.0 109.664 179.795 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.406 ' HB3' ' HB ' ' A' ' 42' ' ' ILE . 99.0 m-85 -91.73 -17.39 25.5 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 117.447 2.388 . . . . 10.0 117.447 179.863 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 8.8 m120 -54.19 113.82 1.39 Allowed 'General case' 0 N--CA 1.477 0.89 0 CA-C-O 122.985 1.374 . . . . 10.0 112.858 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -177.61 -110.84 0.28 Allowed Glycine 0 C--N 1.347 1.163 0 N-CA-C 117.704 1.841 . . . . 10.0 117.704 179.75 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.574 ' O ' HG23 ' A' ' 133' ' ' VAL . 0.2 OUTLIER 173.09 93.99 0.01 OUTLIER 'General case' 0 C--O 1.241 0.621 0 N-CA-C 102.767 -3.049 . . . . 10.0 102.767 -179.846 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 10.0 m95 -94.38 105.48 17.45 Favored 'General case' 0 C--O 1.215 -0.724 0 CA-C-N 114.282 -1.326 . . . . 10.0 112.382 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.99 -163.5 0.04 OUTLIER 'General case' 0 C--O 1.239 0.53 0 C-N-CA 118.923 -1.111 . . . . 10.0 109.401 179.789 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -128.7 134.7 48.56 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.406 0.622 . . . . 10.0 112.628 179.813 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -99.73 -63.09 1.16 Allowed 'General case' 0 C--O 1.236 0.352 0 N-CA-C 108.853 -0.795 . . . . 10.0 108.853 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -132.52 173.77 10.97 Favored 'General case' 0 CA--C 1.511 -0.532 0 O-C-N 126.771 2.544 . . . . 10.0 114.59 -179.533 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 23.8 p-10 -150.11 172.48 15.21 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 113.906 -1.497 . . . . 10.0 107.641 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -157.6 132.68 8.79 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 114.673 1.36 . . . . 10.0 114.673 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 52.32 42.95 31.19 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 122.691 1.234 . . . . 10.0 112.425 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -69.36 -44.41 71.62 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 115.004 1.483 . . . . 10.0 115.004 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -71.9 -34.18 68.92 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-O 122.69 1.233 . . . . 10.0 113.758 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 -77.44 -20.35 54.66 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 117.651 -1.166 . . . . 10.0 109.371 179.499 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.751 ' CE1' HD11 ' A' ' 23' ' ' LEU . 0.1 OUTLIER -76.19 -42.81 45.09 Favored 'General case' 0 CA--C 1.552 1.032 0 O-C-N 126.976 2.673 . . . . 10.0 108.537 179.968 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.634 HD12 ' HA ' ' A' ' 30' ' ' ARG . 3.0 mt -72.03 -21.41 61.54 Favored 'General case' 0 C--O 1.211 -0.947 0 O-C-N 120.764 -1.21 . . . . 10.0 113.211 -179.826 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.6 ttm180 -78.52 -25.37 45.54 Favored 'General case' 0 C--O 1.243 0.737 0 N-CA-C 106.252 -1.759 . . . . 10.0 106.252 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.437 ' HB3' ' O ' ' A' ' 19' ' ' TYR . . . -63.81 -47.23 81.7 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.86 1.059 . . . . 10.0 113.86 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.751 HD11 ' CE1' ' A' ' 19' ' ' TYR . 0.4 OUTLIER -87.36 -6.4 58.49 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 119.25 0.932 . . . . 10.0 110.355 -179.705 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 71.48 19.04 5.3 Favored 'General case' 0 C--O 1.224 -0.273 0 O-C-N 123.815 0.697 . . . . 10.0 111.734 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.448 HG23 ' H ' ' A' ' 78' ' ' ASP . 10.0 p -59.04 163.54 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.219 0 N-CA-C 105.621 -1.992 . . . . 10.0 105.621 -179.833 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -41.81 148.31 0.17 Allowed 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 115.38 1.622 . . . . 10.0 115.38 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 2.9 p -73.32 -23.24 19.66 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.66 0 O-C-N 119.441 -2.037 . . . . 10.0 114.021 -179.852 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -73.98 -23.75 59.51 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 109.554 -0.535 . . . . 10.0 109.554 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -71.04 -45.49 63.77 Favored 'General case' 0 C--O 1.218 -0.566 0 O-C-N 126.317 2.261 . . . . 10.0 112.694 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.634 ' HA ' HD12 ' A' ' 20' ' ' LEU . 0.0 OUTLIER -68.15 -30.99 70.25 Favored 'General case' 0 CA--C 1.512 -0.499 0 O-C-N 125.107 1.504 . . . . 10.0 111.47 179.986 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.19 -44.72 59.37 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 108.647 -0.871 . . . . 10.0 108.647 -179.623 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 5.4 mt -76.21 -30.54 20.24 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 N-CA-C 108.109 -1.071 . . . . 10.0 108.109 -179.64 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -49.94 -61.57 2.06 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 127.977 3.298 . . . . 10.0 110.403 179.505 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.661 ' O ' HD12 ' A' ' 35' ' ' LEU . 14.5 t-20 -52.86 154.93 2.57 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 116.134 -1.888 . . . . 10.0 108.632 179.497 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.661 HD12 ' O ' ' A' ' 34' ' ' ASN . 0.4 OUTLIER 77.3 -39.21 0.31 Allowed 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 120.16 1.345 . . . . 10.0 113.167 -179.248 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -100.48 139.68 35.82 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 120.068 1.304 . . . . 10.0 110.948 179.693 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 14.9 mttt -127.13 111.82 21.62 Favored Pre-proline 0 CA--C 1.535 0.404 0 CA-C-O 123.151 1.453 . . . . 10.0 107.677 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -60.04 105.88 0.31 Allowed 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 123.307 2.671 . . . . 10.0 115.954 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.58 -177.98 1.67 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 118.31 0.504 . . . . 10.0 109.687 179.847 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.0 tptt -140.44 153.0 46.12 Favored 'General case' 0 C--N 1.314 -0.966 0 O-C-N 121.043 -1.036 . . . . 10.0 109.526 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.415 ' HB2' HD12 ' A' ' 54' ' ' LEU . 17.0 tt0 -154.6 69.68 0.76 Allowed 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 104.143 -2.54 . . . . 10.0 104.143 -179.894 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.453 HG22 ' N ' ' A' ' 43' ' ' VAL . 25.4 mm -56.99 152.21 2.7 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.01 0 O-C-N 121.791 -0.568 . . . . 10.0 112.181 -179.727 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.453 ' N ' HG22 ' A' ' 42' ' ' ILE . 0.0 OUTLIER -146.49 95.29 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 N-CA-C 104.461 -2.422 . . . . 10.0 104.461 179.969 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 55.8 tt0 -122.78 118.76 28.76 Favored 'General case' 0 C--O 1.218 -0.597 0 O-C-N 119.846 -1.784 . . . . 10.0 108.634 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -69.02 -85.89 0.02 OUTLIER 'General case' 0 C--O 1.236 0.387 0 N-CA-C 105.638 -1.986 . . . . 10.0 105.638 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -160.45 -54.79 0.01 OUTLIER Glycine 0 N--CA 1.461 0.348 0 N-CA-C 106.192 -2.763 . . . . 10.0 106.192 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.9 m-20 -100.78 4.4 42.92 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 108.643 -0.873 . . . . 10.0 108.643 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 62.0 m-70 -142.07 174.2 10.82 Favored 'General case' 0 N--CA 1.438 -1.049 0 CA-C-O 117.82 -1.086 . . . . 10.0 110.246 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 14.0 ttp -149.22 165.07 32.98 Favored 'General case' 0 N--CA 1.441 -0.91 0 C-N-CA 118.699 -1.201 . . . . 10.0 111.806 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.437 ' C ' HD12 ' A' ' 51' ' ' ILE . 6.8 mm -149.25 123.5 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 103.563 -2.754 . . . . 10.0 103.563 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.437 HD12 ' C ' ' A' ' 50' ' ' ILE . 1.6 mp -110.51 133.23 56.6 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 N-CA-C 107.833 -1.173 . . . . 10.0 107.833 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.478 HH21 HD21 ' A' ' 54' ' ' LEU . 63.6 mtp180 -127.36 146.87 50.31 Favored 'General case' 0 C--O 1.214 -0.763 0 N-CA-C 109.021 -0.733 . . . . 10.0 109.021 179.828 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 18.4 m -128.22 108.21 10.42 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 102.402 -3.184 . . . . 10.0 102.402 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.478 HD21 HH21 ' A' ' 52' ' ' ARG . 11.0 mt -105.26 99.24 8.86 Favored 'General case' 0 C--N 1.32 -0.707 1 N-CA-C 122.095 4.109 . . . . 10.0 122.095 -179.775 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.5 m -129.94 173.29 10.83 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 104.879 -2.267 . . . . 10.0 104.879 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 32.5 p -101.49 31.5 3.73 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 107.211 -1.403 . . . . 10.0 107.211 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -124.5 -43.85 2.01 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-O 118.277 -0.868 . . . . 10.0 110.123 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -176.3 137.38 0.29 Allowed 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 118.006 -0.997 . . . . 10.0 112.389 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -101.55 171.07 7.79 Favored 'General case' 0 C--O 1.241 0.621 0 O-C-N 125.012 1.445 . . . . 10.0 113.81 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -130.32 117.25 19.49 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 104.533 -2.395 . . . . 10.0 104.533 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 26.0 mm -122.8 112.86 35.78 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 N-CA-C 115.024 1.49 . . . . 10.0 115.024 179.819 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 3.2 mmt -130.67 178.25 6.78 Favored 'General case' 0 C--O 1.212 -0.876 0 CA-C-O 123.507 1.622 . . . . 10.0 108.372 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -151.59 107.53 3.4 Favored 'General case' 0 N--CA 1.437 -1.102 0 N-CA-C 101.929 -3.36 . . . . 10.0 101.929 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -107.73 174.31 5.94 Favored 'General case' 0 C--O 1.247 0.964 0 N-CA-C 116.854 2.168 . . . . 10.0 116.854 -179.745 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 5.7 mm100 -126.06 115.27 19.58 Favored 'General case' 0 N--CA 1.444 -0.743 0 N-CA-C 104.934 -2.247 . . . . 10.0 104.934 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 3.4 t -71.12 95.25 0.49 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.728 0 N-CA-C 109.218 -0.66 . . . . 10.0 109.218 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 112.29 55.74 0.46 Allowed Glycine 0 CA--C 1.532 1.131 0 C-N-CA 124.705 1.145 . . . . 10.0 115.46 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -174.06 121.9 0.3 Allowed 'General case' 0 C--O 1.236 0.388 0 C-N-CA 123.386 0.674 . . . . 10.0 112.562 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -56.08 135.81 52.65 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 124.521 1.128 . . . . 10.0 112.708 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -120.5 -174.66 2.85 Favored 'General case' 0 N--CA 1.437 -1.085 0 C-N-CA 124.165 0.986 . . . . 10.0 110.74 -179.769 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -148.9 66.72 1.04 Allowed 'General case' 0 C--N 1.312 -1.039 0 N-CA-C 108.149 -1.056 . . . . 10.0 108.149 179.639 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -51.4 118.39 3.26 Favored 'General case' 0 CA--C 1.509 -0.624 0 O-C-N 124.682 1.239 . . . . 10.0 111.529 179.776 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -71.54 -36.91 71.14 Favored 'General case' 0 C--N 1.318 -0.768 0 O-C-N 125.539 1.774 . . . . 10.0 110.544 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 19.4 mt 41.76 71.71 0.2 Allowed 'General case' 0 N--CA 1.441 -0.88 0 C-N-CA 124.813 1.245 . . . . 10.0 114.268 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -113.79 116.75 29.85 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 106.722 -1.584 . . . . 10.0 106.722 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 140.35 -67.84 0.49 Allowed Glycine 0 N--CA 1.444 -0.825 0 CA-C-O 118.778 -1.012 . . . . 10.0 111.361 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -111.14 147.15 15.35 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 N-CA-C 105.539 -2.022 . . . . 10.0 105.539 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.448 ' H ' HG23 ' A' ' 25' ' ' VAL . 77.7 m-20 55.28 16.5 1.71 Allowed 'General case' 0 N--CA 1.443 -0.8 0 CA-C-O 116.019 -1.943 . . . . 10.0 113.414 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -2.35 68.41 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 118.062 2.615 . . . . 10.0 118.062 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.64 -163.43 1.37 Allowed 'General case' 0 N--CA 1.452 -0.337 0 O-C-N 119.936 -1.727 . . . . 10.0 111.868 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 2.1 tptp -153.18 147.64 25.98 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 102.998 -2.964 . . . . 10.0 102.998 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 5.7 p -158.84 140.6 13.55 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 122.395 1.093 . . . . 10.0 110.562 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.1 ttt -93.77 67.6 3.84 Favored 'General case' 0 N--CA 1.441 -0.895 0 N-CA-C 102.797 -3.038 . . . . 10.0 102.797 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.552 HG23 ' N ' ' A' ' 85' ' ' THR . 0.6 OUTLIER -50.89 166.21 0.09 Allowed 'General case' 0 N--CA 1.434 -1.263 0 CA-C-N 112.958 -1.928 . . . . 10.0 115.479 179.921 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.552 ' N ' HG23 ' A' ' 84' ' ' THR . 0.2 OUTLIER -164.27 106.05 0.89 Allowed 'General case' 0 N--CA 1.442 -0.842 0 N-CA-C 108.217 -1.031 . . . . 10.0 108.217 179.608 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.459 ' CG1' HD11 ' A' ' 93' ' ' LEU . 32.6 t -108.15 118.05 54.99 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.974 0 N-CA-C 103.237 -2.875 . . . . 10.0 103.237 -179.903 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -124.65 149.44 47.13 Favored 'General case' 0 C--N 1.315 -0.895 0 O-C-N 124.786 1.304 . . . . 10.0 114.483 -179.868 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 4.0 t90 -85.4 127.88 34.53 Favored 'General case' 0 C--N 1.329 -0.319 0 O-C-N 121.567 -0.708 . . . . 10.0 110.055 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -92.24 -55.33 3.47 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 101.434 -3.543 . . . . 10.0 101.434 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 146.59 -76.87 0.26 Allowed Glycine 0 C--O 1.245 0.787 0 N-CA-C 107.691 -2.164 . . . . 10.0 107.691 179.659 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.0 -24.12 67.59 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 114.837 -0.681 . . . . 10.0 111.078 -179.768 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.33 168.08 23.51 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-O 122.249 1.023 . . . . 10.0 110.129 179.831 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.68 HD13 ' N ' ' A' ' 94' ' ' GLN . 1.5 tm? -108.81 136.9 47.6 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 104.298 -2.482 . . . . 10.0 104.298 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' GLN . . . . . 0.68 ' N ' HD13 ' A' ' 93' ' ' LEU . 0.5 OUTLIER -138.33 145.25 40.95 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 118.772 0.715 . . . . 10.0 110.199 -179.911 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 6.7 m -123.03 159.98 27.27 Favored 'General case' 0 CA--C 1.505 -0.784 0 O-C-N 126.163 2.165 . . . . 10.0 114.129 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -159.02 128.75 0.75 Allowed 'Isoleucine or valine' 0 C--O 1.246 0.903 0 N-CA-C 105.134 -2.173 . . . . 10.0 105.134 -179.662 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -132.6 140.05 48.06 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 122.673 1.225 . . . . 10.0 110.998 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -86.92 179.69 6.67 Favored 'General case' 0 C--N 1.343 0.297 0 N-CA-C 115.013 1.486 . . . . 10.0 115.013 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 142.37 -157.01 26.44 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.972 -0.632 . . . . 10.0 112.281 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -89.03 -17.04 30.19 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 118.387 2.736 . . . . 10.0 118.387 179.725 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 17.3 mmtt -81.96 179.55 7.78 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 115.203 1.557 . . . . 10.0 115.203 -179.766 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -108.71 14.87 24.1 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 126.764 2.026 . . . . 10.0 113.004 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -148.24 -88.24 0.07 OUTLIER Glycine 0 C--N 1.342 0.914 0 CA-C-N 113.547 -1.661 . . . . 10.0 114.549 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 6.2 mtp180 31.71 92.17 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.808 0 O-C-N 126.912 2.183 . . . . 10.0 114.889 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 169.97 149.88 6.57 Favored Glycine 0 N--CA 1.441 -0.97 0 N-CA-C 110.085 -1.206 . . . . 10.0 110.085 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -112.26 168.08 9.91 Favored 'General case' 0 C--N 1.32 -0.679 0 O-C-N 120.64 -1.506 . . . . 10.0 109.257 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.7 m -151.01 120.06 6.7 Favored 'General case' 0 C--O 1.215 -0.72 0 N-CA-C 107.703 -1.221 . . . . 10.0 107.703 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -117.38 102.0 8.87 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 124.426 2.06 . . . . 10.0 114.738 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' TRP . . . . . 0.489 ' CD1' ' C ' ' A' ' 109' ' ' TRP . 0.0 OUTLIER -111.99 133.48 54.14 Favored 'General case' 0 C--O 1.217 -0.645 0 O-C-N 119.6 -1.938 . . . . 10.0 107.333 179.956 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 33.1 mt -98.93 142.13 15.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 O-C-N 126.603 2.439 . . . . 10.0 114.4 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -130.57 97.29 4.34 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 104.619 -2.363 . . . . 10.0 104.619 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 55.61 -118.13 10.04 Favored Glycine 0 C--O 1.221 -0.714 0 N-CA-C 109.721 -1.351 . . . . 10.0 109.721 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -92.4 12.72 21.76 Favored 'General case' 0 C--N 1.327 -0.392 0 O-C-N 126.06 1.682 . . . . 10.0 111.277 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -109.74 -179.18 3.74 Favored 'General case' 0 CA--C 1.513 -0.448 0 CA-C-O 117.701 -1.142 . . . . 10.0 111.234 179.807 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.707 HD23 ' CG ' ' A' ' 130' ' ' PHE . 2.3 tp -157.0 117.97 3.66 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 127.128 2.171 . . . . 10.0 106.725 179.749 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -104.47 121.21 42.96 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 106.367 -1.716 . . . . 10.0 106.367 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 10.8 tp -106.16 132.48 52.18 Favored 'General case' 0 C--N 1.315 -0.895 0 O-C-N 123.285 0.366 . . . . 10.0 111.101 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -119.25 100.53 7.38 Favored 'General case' 0 C--N 1.315 -0.893 0 O-C-N 125.149 1.531 . . . . 10.0 107.694 -179.664 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.537 ' HE1' ' CZ ' ' A' ' 19' ' ' TYR . 1.3 tmm? -109.55 136.67 48.55 Favored 'General case' 0 N--CA 1.444 -0.767 0 O-C-N 124.767 1.292 . . . . 10.0 109.372 -179.885 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -124.03 147.76 47.58 Favored 'General case' 0 C--N 1.315 -0.922 0 O-C-N 125.947 2.03 . . . . 10.0 113.172 179.756 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -156.17 131.49 9.41 Favored 'General case' 0 CA--C 1.501 -0.916 0 O-C-N 124.473 1.108 . . . . 10.0 109.314 179.803 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 47.42 29.5 1.35 Allowed 'General case' 0 C--N 1.319 -0.754 0 O-C-N 125.176 1.548 . . . . 10.0 114.409 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 93.6 -0.84 68.24 Favored Glycine 0 CA--C 1.528 0.881 0 N-CA-C 116.333 1.293 . . . . 10.0 116.333 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 21.2 t -107.21 158.9 7.0 Favored 'Isoleucine or valine' 0 C--O 1.242 0.676 0 N-CA-C 106.699 -1.593 . . . . 10.0 106.699 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -138.86 130.3 27.21 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 118.72 0.691 . . . . 10.0 111.94 -179.744 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 1.1 t -98.18 148.56 23.46 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 104.837 -2.282 . . . . 10.0 104.837 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 20.1 mtpt -126.83 111.48 14.24 Favored 'General case' 0 C--O 1.218 -0.605 0 O-C-N 125.491 1.744 . . . . 10.0 108.988 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -114.53 113.59 24.63 Favored 'General case' 0 N--CA 1.447 -0.622 0 O-C-N 127.287 2.867 . . . . 10.0 114.136 179.821 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 2.3 t -91.56 133.01 34.49 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.768 0 O-C-N 123.905 0.753 . . . . 10.0 109.043 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' PHE . . . . . 0.707 ' CG ' HD23 ' A' ' 115' ' ' LEU . 9.3 m-85 -121.58 177.62 5.16 Favored 'General case' 0 C--O 1.214 -0.802 0 C-N-CA 126.178 1.791 . . . . 10.0 107.259 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 4.9 ttpt -158.07 138.66 12.84 Favored 'General case' 0 N--CA 1.445 -0.715 0 O-C-N 126.281 2.238 . . . . 10.0 106.376 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 2.2 tttp -74.16 130.11 39.14 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 123.035 1.398 . . . . 10.0 108.692 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' VAL . . . . . 0.574 HG23 ' O ' ' A' ' 7' ' ' TYR . 2.1 t -96.83 -0.69 10.52 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 CA-C-N 114.846 -1.07 . . . . 10.0 109.219 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.24 0.604 0 O-C-N 126.773 2.545 . . . . 10.0 108.778 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo . . . . . 0 N--CA 1.488 1.176 0 CA-C-O 122.105 0.794 . . . . 10.0 113.359 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -123.67 61.08 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 O-C-N 120.679 -1.263 . . . . 10.0 110.191 179.808 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -94.85 110.02 21.94 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.351 1.46 . . . . 10.0 113.857 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -56.82 -28.7 61.92 Favored 'General case' 0 C--O 1.222 -0.358 0 N-CA-C 117.869 2.544 . . . . 10.0 117.869 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.4 p30 -52.46 153.15 3.14 Favored 'General case' 0 N--CA 1.478 0.962 0 O-C-N 125.75 1.906 . . . . 10.0 113.673 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 148.06 -140.91 8.71 Favored Glycine 0 C--N 1.336 0.533 0 N-CA-C 116.659 1.423 . . . . 10.0 116.659 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -144.17 156.9 44.51 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 103.392 -2.818 . . . . 10.0 103.392 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.751 ' CE2' HD22 ' A' ' 115' ' ' LEU . 3.8 m0 -160.11 72.73 0.5 Allowed 'General case' 0 C--N 1.315 -0.897 0 O-C-N 126.313 2.258 . . . . 10.0 113.202 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.31 113.83 1.73 Allowed 'General case' 0 C--O 1.238 0.458 0 N-CA-C 107.21 -1.404 . . . . 10.0 107.21 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -68.32 146.31 53.4 Favored 'General case' 0 CA--C 1.512 -0.51 0 O-C-N 119.338 -2.101 . . . . 10.0 113.424 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.0 mt -103.98 -46.56 4.44 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.994 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.5 t -155.31 153.82 31.13 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 116.182 1.919 . . . . 10.0 116.182 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -120.37 115.12 22.9 Favored 'General case' 0 C--N 1.318 -0.789 0 O-C-N 127.059 2.725 . . . . 10.0 104.508 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -92.68 139.22 30.78 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 120.243 1.383 . . . . 10.0 112.923 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 8.2 m120 56.09 31.66 18.59 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 113.683 0.994 . . . . 10.0 113.683 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 22.0 t80 -67.5 -32.13 72.74 Favored 'General case' 0 CA--C 1.55 0.967 0 O-C-N 120.778 -1.201 . . . . 10.0 113.733 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.65 -37.43 42.06 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-O 122.729 1.252 . . . . 10.0 110.565 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.33 -20.22 60.18 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-O 123.897 1.808 . . . . 10.0 107.064 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -74.81 -39.26 61.78 Favored 'General case' 0 CA--C 1.553 1.093 0 CA-C-N 114.141 -1.391 . . . . 10.0 111.105 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.591 HD12 ' HG3' ' A' ' 30' ' ' ARG . 4.0 mt -78.02 -21.13 51.22 Favored 'General case' 0 C--O 1.21 -0.987 0 O-C-N 125.152 1.532 . . . . 10.0 109.73 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 26.9 ttp180 -77.27 -24.13 51.11 Favored 'General case' 0 C--O 1.245 0.846 0 CA-C-N 114.015 -1.448 . . . . 10.0 109.101 179.737 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.22 -51.46 67.68 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 126.224 1.809 . . . . 10.0 113.731 -179.632 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -110.78 6.98 21.84 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 119.094 0.861 . . . . 10.0 112.001 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 50.57 80.77 0.07 Allowed 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.795 1.035 . . . . 10.0 113.795 179.568 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.449 ' CG1' HD13 ' A' ' 20' ' ' LEU . 8.7 p -99.09 39.69 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.808 0 CA-C-N 115.162 -0.926 . . . . 10.0 110.074 -179.624 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 75.11 143.7 0.08 Allowed 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 117.151 2.278 . . . . 10.0 117.151 -179.48 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 63.3 t -75.4 -33.42 27.57 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 O-C-N 124.893 1.371 . . . . 10.0 114.647 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -71.51 -27.87 63.5 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 122.933 1.349 . . . . 10.0 111.223 179.725 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.441 HD22 HG22 ' A' ' 25' ' ' VAL . 1.3 tp -79.17 -34.65 42.91 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 123.685 0.794 . . . . 10.0 110.206 179.751 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.591 ' HG3' HD12 ' A' ' 20' ' ' LEU . 42.8 ttp85 -77.37 -30.86 53.97 Favored 'General case' 0 C--O 1.242 0.702 0 O-C-N 120.742 -1.224 . . . . 10.0 111.746 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.66 -39.5 80.64 Favored 'General case' 0 C--N 1.314 -0.947 0 C-N-CA 126.45 1.9 . . . . 10.0 109.38 179.715 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 80.1 mt -79.41 -57.16 5.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 O-C-N 125.284 1.615 . . . . 10.0 112.595 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -50.01 -31.79 13.71 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 115.127 1.528 . . . . 10.0 115.127 -179.869 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -61.05 -26.76 67.86 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 123.38 1.562 . . . . 10.0 113.377 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.662 ' N ' HD22 ' A' ' 35' ' ' LEU . 0.9 OUTLIER -97.17 -6.3 35.15 Favored 'General case' 0 C--N 1.323 -0.576 0 O-C-N 119.074 -2.266 . . . . 10.0 113.666 179.848 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 47.2 mt -96.64 109.03 21.73 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 124.933 1.395 . . . . 10.0 108.023 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 20.1 mttp -120.01 93.86 48.17 Favored Pre-proline 0 C--O 1.236 0.392 0 O-C-N 119.657 -1.902 . . . . 10.0 106.935 -179.719 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -69.41 172.1 12.9 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 125.205 3.937 . . . . 10.0 118.211 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -122.0 113.63 19.83 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 104.429 -2.434 . . . . 10.0 104.429 -179.825 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.1 mttm -81.26 138.17 35.77 Favored 'General case' 0 C--N 1.316 -0.883 0 O-C-N 120.752 -1.218 . . . . 10.0 112.431 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -128.32 107.62 9.91 Favored 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 103.783 -2.673 . . . . 10.0 103.783 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.6 mt -95.82 149.34 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 CA-C-O 123.573 1.654 . . . . 10.0 108.968 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -147.41 131.03 9.07 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 CA-C-O 123.92 1.819 . . . . 10.0 106.105 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -116.61 143.95 44.99 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 105.638 -1.986 . . . . 10.0 105.638 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -126.29 -66.65 0.91 Allowed 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 108.31 -0.996 . . . . 10.0 108.31 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -171.54 92.78 0.1 OUTLIER Glycine 0 CA--C 1.522 0.479 0 N-CA-C 107.82 -2.112 . . . . 10.0 107.82 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 60.89 19.29 9.59 Favored 'General case' 0 C--N 1.32 -0.686 0 O-C-N 121.72 -0.871 . . . . 10.0 109.663 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 5.9 m80 -137.88 78.18 1.67 Allowed 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 104.884 -2.265 . . . . 10.0 104.884 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.479 ' HB2' ' CG2' ' A' ' 66' ' ' VAL . 1.0 OUTLIER -78.3 126.27 30.54 Favored 'General case' 0 N--CA 1.441 -0.889 0 CA-C-N 114.114 -1.403 . . . . 10.0 112.133 179.925 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.617 ' C ' HD12 ' A' ' 51' ' ' ILE . 76.3 mt -110.6 139.68 33.14 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.544 0 N-CA-C 107.872 -1.159 . . . . 10.0 107.872 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.617 HD12 ' C ' ' A' ' 50' ' ' ILE . 1.8 mp -132.43 109.56 15.0 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 N-CA-C 105.629 -1.989 . . . . 10.0 105.629 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 36.7 mtt180 -106.15 116.15 31.44 Favored 'General case' 0 C--N 1.315 -0.904 0 O-C-N 126.802 2.564 . . . . 10.0 111.487 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.1 m -105.28 127.59 53.02 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 100.441 -3.911 . . . . 10.0 100.441 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 11.6 mt -117.29 98.28 6.35 Favored 'General case' 0 C--N 1.321 -0.662 1 N-CA-C 121.929 4.048 . . . . 10.0 121.929 179.772 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 82.7 p -108.72 138.75 44.54 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 126.926 2.09 . . . . 10.0 106.342 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -82.36 9.22 9.43 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 116.873 -1.537 . . . . 10.0 111.564 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 29.1 t80 -110.1 -46.62 3.43 Favored 'General case' 0 C--O 1.24 0.599 0 N-CA-C 108.27 -1.011 . . . . 10.0 108.27 -179.869 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 2.4 tpm_? -163.86 102.62 0.9 Allowed 'General case' 0 C--O 1.241 0.618 0 O-C-N 124.65 1.219 . . . . 10.0 111.93 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -76.05 170.09 16.94 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 120.737 -1.227 . . . . 10.0 111.435 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.459 ' CG ' ' O ' ' A' ' 60' ' ' TYR . 0.1 OUTLIER -151.44 56.19 0.87 Allowed 'General case' 0 C--O 1.214 -0.802 0 CA-C-O 125.088 2.375 . . . . 10.0 107.194 179.902 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.436 HD13 ' N ' ' A' ' 61' ' ' ILE . 2.9 mm -39.79 134.15 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 O-C-N 120.429 -1.42 . . . . 10.0 114.593 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -106.92 -178.06 3.54 Favored 'General case' 0 CA--C 1.513 -0.457 0 O-C-N 125.426 1.704 . . . . 10.0 107.345 -179.668 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -166.76 87.76 0.32 Allowed 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 101.878 -3.378 . . . . 10.0 101.878 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -93.2 164.87 13.08 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 116.249 1.944 . . . . 10.0 116.249 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.64 125.22 33.49 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 102.79 -3.041 . . . . 10.0 102.79 -179.715 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.479 ' CG2' ' HB2' ' A' ' 49' ' ' MET . 5.1 t -80.18 95.51 2.37 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 O-C-N 124.143 0.902 . . . . 10.0 112.803 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 102.8 39.8 2.64 Favored Glycine 0 CA--C 1.52 0.383 0 N-CA-C 114.99 0.756 . . . . 10.0 114.99 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -160.96 144.84 13.41 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 115.256 1.576 . . . . 10.0 115.256 -179.789 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -91.91 129.2 37.93 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 108.639 -0.874 . . . . 10.0 108.639 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 29.6 p90 -150.05 31.17 0.69 Allowed 'General case' 0 N--CA 1.439 -0.989 0 CA-C-O 116.113 -1.898 . . . . 10.0 113.413 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 12.6 pm0 36.18 84.53 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.773 0 O-C-N 126.243 2.215 . . . . 10.0 110.762 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -23.65 -43.51 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.959 0 O-C-N 126.764 2.54 . . . . 10.0 117.124 -179.625 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 73.29 89.68 0.09 Allowed 'General case' 0 C--O 1.224 -0.277 0 CA-C-N 113.223 -1.808 . . . . 10.0 109.871 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.558 HD22 ' CD1' ' A' ' 77' ' ' ILE . 8.6 mt -104.41 65.46 0.78 Allowed 'General case' 0 C--N 1.313 -0.988 0 O-C-N 121.145 -0.972 . . . . 10.0 112.798 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 11.0 p -107.99 33.22 4.22 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.447 -0.946 . . . . 10.0 108.447 179.813 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -116.98 -26.68 2.93 Favored Glycine 0 CA--C 1.509 -0.334 0 CA-C-O 117.617 -1.657 . . . . 10.0 113.277 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.558 ' CD1' HD22 ' A' ' 74' ' ' LEU . 0.1 OUTLIER -132.11 -80.1 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.721 0 CA-C-N 119.202 1.501 . . . . 10.0 110.022 -179.826 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -87.52 36.85 0.76 Allowed 'General case' 0 N--CA 1.444 -0.768 0 CA-C-O 116.697 -1.621 . . . . 10.0 115.02 -179.802 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 25.0 t0 11.75 74.93 0.01 OUTLIER 'General case' 0 C--O 1.219 -0.501 0 O-C-N 126.283 2.24 . . . . 10.0 116.45 179.825 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.86 96.09 1.11 Allowed 'General case' 0 CA--C 1.508 -0.653 0 O-C-N 126.667 2.48 . . . . 10.0 114.299 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 11.1 ttpt -67.75 128.6 37.08 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 106.378 -1.712 . . . . 10.0 106.378 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 41.3 m -120.97 171.82 8.37 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 126.856 2.598 . . . . 10.0 108.159 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 18.5 mtt -95.54 107.35 19.52 Favored 'General case' 0 C--N 1.314 -0.977 1 N-CA-C 99.697 -4.186 . . . . 10.0 99.697 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 5.2 m -122.89 144.14 49.42 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 117.665 2.468 . . . . 10.0 117.665 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -136.52 125.61 24.49 Favored 'General case' 0 N--CA 1.441 -0.878 0 N-CA-C 107.661 -1.237 . . . . 10.0 107.661 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -100.1 149.62 5.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 N-CA-C 102.798 -3.038 . . . . 10.0 102.798 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -165.77 156.86 13.71 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 114.306 1.224 . . . . 10.0 114.306 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -97.55 112.32 24.22 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 114.574 -1.194 . . . . 10.0 109.49 -179.829 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -118.8 85.03 2.29 Favored 'General case' 0 CA--C 1.532 0.288 1 N-CA-C 99.998 -4.075 . . . . 10.0 99.998 -179.774 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 92.93 -133.91 11.93 Favored Glycine 0 CA--C 1.498 -0.977 0 N-CA-C 105.308 -3.117 . . . . 10.0 105.308 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -104.43 35.17 2.81 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 122.841 0.457 . . . . 10.0 110.0 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 7.5 mtpt -128.18 172.33 11.1 Favored 'General case' 0 N--CA 1.463 0.18 0 O-C-N 126.506 2.379 . . . . 10.0 106.817 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -133.65 89.48 2.59 Favored 'General case' 0 C--N 1.323 -0.572 0 O-C-N 126.715 2.509 . . . . 10.0 107.275 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -76.16 154.99 34.97 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 116.465 -0.334 . . . . 10.0 110.828 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 3.3 m -144.27 133.74 23.34 Favored 'General case' 0 C--O 1.218 -0.587 0 O-C-N 126.212 2.195 . . . . 10.0 110.506 179.771 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -136.83 132.84 48.05 Favored 'Isoleucine or valine' 0 C--O 1.243 0.747 0 CA-C-N 113.42 -1.718 . . . . 10.0 107.395 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -118.54 121.1 39.42 Favored 'General case' 0 C--O 1.24 0.597 0 C-N-CA 124.36 1.064 . . . . 10.0 110.776 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 6.9 mttm -90.7 87.31 6.64 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 119.123 0.874 . . . . 10.0 109.979 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -131.11 75.55 0.42 Allowed Glycine 0 N--CA 1.438 -1.174 0 CA-C-O 116.458 -2.301 . . . . 10.0 114.082 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 28.04 39.74 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 117.549 2.426 . . . . 10.0 117.549 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 5.8 mmtt -131.46 160.01 36.41 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 115.31 1.596 . . . . 10.0 115.31 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -73.75 -37.95 64.88 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 112.676 -2.056 . . . . 10.0 108.829 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -135.78 134.0 6.97 Favored Glycine 0 C--O 1.222 -0.617 0 CA-C-O 117.201 -1.888 . . . . 10.0 113.681 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 173.72 106.07 0.01 OUTLIER 'General case' 0 N--CA 1.439 -0.983 0 O-C-N 124.91 1.006 . . . . 10.0 110.034 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 166.45 160.31 13.49 Favored Glycine 0 C--O 1.215 -1.063 0 N-CA-C 109.313 -1.515 . . . . 10.0 109.313 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 6.2 m0 -123.04 -179.65 4.35 Favored 'General case' 0 N--CA 1.442 -0.841 0 O-C-N 126.496 1.939 . . . . 10.0 109.268 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -164.47 151.55 11.46 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 104.163 -2.532 . . . . 10.0 104.163 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.595 ' NE2' HD13 ' A' ' 117' ' ' LEU . 3.4 tp-100 -140.32 151.98 45.48 Favored 'General case' 0 N--CA 1.444 -0.744 0 O-C-N 125.731 1.894 . . . . 10.0 108.808 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' TRP . . . . . 0.458 ' CD1' ' C ' ' A' ' 109' ' ' TRP . 0.0 OUTLIER -167.34 137.39 2.88 Favored 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 125.156 1.382 . . . . 10.0 107.529 179.977 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 33.6 mt -96.92 114.98 35.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 118.624 2.824 . . . . 10.0 118.624 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -95.97 161.75 13.86 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 102.645 -3.094 . . . . 10.0 102.645 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -57.75 106.25 0.75 Allowed Glycine 0 N--CA 1.443 -0.843 0 CA-C-O 118.571 -1.127 . . . . 10.0 110.835 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 69.34 11.76 8.18 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 126.133 1.725 . . . . 10.0 112.701 -179.678 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -151.86 120.57 6.53 Favored 'General case' 0 CA--C 1.499 -0.989 0 CA-C-O 124.712 2.196 . . . . 10.0 114.559 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.751 HD22 ' CE2' ' A' ' 8' ' ' TRP . 2.9 tp -78.07 138.06 38.57 Favored 'General case' 0 C--N 1.319 -0.717 0 CA-C-N 113.903 -1.498 . . . . 10.0 107.52 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -117.81 112.01 19.83 Favored 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 106.601 -1.629 . . . . 10.0 106.601 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.595 HD13 ' NE2' ' A' ' 108' ' ' GLN . 6.9 tp -122.65 131.83 53.99 Favored 'General case' 0 C--N 1.315 -0.921 0 C-N-CA 124.952 1.301 . . . . 10.0 107.922 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -135.81 151.93 50.57 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 106.183 -1.784 . . . . 10.0 106.183 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -156.39 160.42 39.63 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.328 -0.851 . . . . 10.0 109.641 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 3.4 mtm180 -138.82 179.55 6.42 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 117.289 -1.338 . . . . 10.0 114.042 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -173.62 132.5 0.45 Allowed 'General case' 0 CA--C 1.499 -1.016 0 O-C-N 125.269 1.606 . . . . 10.0 106.734 179.612 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 35.56 60.46 0.75 Allowed 'General case' 0 N--CA 1.475 0.821 0 O-C-N 126.669 2.481 . . . . 10.0 116.661 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 64.52 10.33 42.63 Favored Glycine 0 N--CA 1.444 -0.813 0 C-N-CA 123.877 0.751 . . . . 10.0 113.091 179.601 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 14.9 t -107.81 151.42 9.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 CA-C-N 118.958 1.379 . . . . 10.0 108.203 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 3.1 m -121.85 140.01 52.92 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 122.648 1.213 . . . . 10.0 112.279 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -137.77 175.23 9.77 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 113.165 -1.834 . . . . 10.0 106.466 -179.749 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 177.74 163.33 0.6 Allowed 'General case' 0 C--O 1.24 0.553 0 O-C-N 123.973 0.795 . . . . 10.0 111.309 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -131.01 133.51 45.83 Favored 'General case' 0 CA--C 1.5 -0.961 0 CA-C-N 115.708 -0.678 . . . . 10.0 111.461 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 55.5 t -100.21 90.56 1.94 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.43 0 C-N-CA 124.675 1.19 . . . . 10.0 109.68 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' PHE . . . . . 0.46 ' HB2' ' HB3' ' A' ' 115' ' ' LEU . 13.4 m-30 -81.96 166.57 19.74 Favored 'General case' 0 N--CA 1.442 -0.85 0 CA-C-O 122.557 1.17 . . . . 10.0 111.31 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.23 127.14 16.36 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 106.318 -1.734 . . . . 10.0 106.318 179.789 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 8.6 tttp -77.55 142.98 38.72 Favored 'General case' 0 CA--C 1.504 -0.807 0 N-CA-C 106.376 -1.713 . . . . 10.0 106.376 179.831 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 10.4 p -97.03 -14.26 7.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 119.369 0.986 . . . . 10.0 111.978 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 12.0 t-80 . . . . . 0 C--N 1.314 -0.946 0 O-C-N 126.315 2.259 . . . . 10.0 110.87 -179.958 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo . . . . . 0 N--CA 1.484 0.968 0 CA-C-O 123.068 1.195 . . . . 10.0 113.398 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 1.4 p -122.22 97.53 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 CA-C-N 113.553 -1.658 . . . . 10.0 109.502 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -56.54 117.22 3.65 Favored 'General case' 0 C--O 1.239 0.52 0 N-CA-C 113.89 1.07 . . . . 10.0 113.89 179.727 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -85.45 24.32 1.2 Allowed 'General case' 0 C--O 1.243 0.719 0 O-C-N 121.119 -0.988 . . . . 10.0 111.759 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 13.2 m-80 -55.92 125.51 21.74 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 120.909 -1.12 . . . . 10.0 111.762 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 159.26 -163.38 33.35 Favored Glycine 0 C--O 1.214 -1.132 0 C-N-CA 117.963 -2.065 . . . . 10.0 116.409 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -122.7 173.26 7.84 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 105.058 -2.201 . . . . 10.0 105.058 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.657 ' CE3' HD12 ' A' ' 115' ' ' LEU . 1.1 m0 -169.56 98.58 0.33 Allowed 'General case' 0 N--CA 1.445 -0.698 0 O-C-N 125.306 1.629 . . . . 10.0 114.782 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.53 146.95 28.06 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 104.362 -2.458 . . . . 10.0 104.362 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -93.39 132.4 37.67 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 117.554 -1.658 . . . . 10.0 114.447 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -80.92 -54.98 5.1 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 113.731 -1.577 . . . . 10.0 110.07 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 33.9 m -156.47 130.79 8.68 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 115.598 1.703 . . . . 10.0 115.598 -179.675 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 5.1 p30 -116.18 171.36 7.86 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 112.534 -2.121 . . . . 10.0 105.521 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -136.57 -56.51 0.74 Allowed 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 116.703 2.112 . . . . 10.0 116.703 -179.771 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -92.96 51.05 1.62 Allowed 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 114.029 1.122 . . . . 10.0 114.029 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 27.9 t80 -71.72 -49.58 38.05 Favored 'General case' 0 C--O 1.243 0.761 0 CA-C-O 117.219 -1.372 . . . . 10.0 112.861 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -72.66 -39.09 67.39 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 114.362 1.245 . . . . 10.0 114.362 -179.766 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.94 -24.7 63.39 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 121.831 0.824 . . . . 10.0 110.871 -179.816 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -74.63 -42.8 57.92 Favored 'General case' 0 C--N 1.319 -0.756 0 O-C-N 120.292 -1.505 . . . . 10.0 107.803 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 45.7 mt -75.92 -20.13 58.23 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-O 123.408 1.575 . . . . 10.0 109.64 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -79.7 -29.1 40.61 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 107.577 -1.268 . . . . 10.0 107.577 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.468 ' HB1' ' HB3' ' A' ' 122' ' ' GLU . . . -68.82 -23.23 64.24 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 120.427 -1.421 . . . . 10.0 111.977 -179.61 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 85.2 mt -102.42 -21.92 14.17 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 118.247 -0.882 . . . . 10.0 111.394 179.607 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 50.0 m-20 70.86 63.85 0.18 Allowed 'General case' 0 C--O 1.247 0.935 0 O-C-N 126.965 2.666 . . . . 10.0 114.561 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -93.1 167.22 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 106.203 -1.777 . . . . 10.0 106.203 179.811 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 43.9 t30 -43.67 159.02 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 117.154 2.279 . . . . 10.0 117.154 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.4 t -77.19 -40.92 30.33 Favored 'Isoleucine or valine' 0 C--O 1.232 0.158 0 CA-C-N 113.057 -1.883 . . . . 10.0 112.791 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.75 -33.9 71.29 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.212 -0.904 . . . . 10.0 111.798 -179.484 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.625 HD23 ' O ' ' A' ' 29' ' ' LEU . 10.5 tt -72.31 -26.94 62.15 Favored 'General case' 0 C--O 1.218 -0.585 0 CA-C-N 115.662 -0.699 . . . . 10.0 111.969 -179.938 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.1 -31.35 62.76 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 125.024 1.33 . . . . 10.0 110.535 179.703 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 30.4 tttp -78.24 -41.28 34.7 Favored 'General case' 0 N--CA 1.447 -0.606 0 O-C-N 123.735 0.647 . . . . 10.0 112.736 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 40.2 mt -75.46 -44.48 41.43 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.321 0 O-C-N 124.048 0.843 . . . . 10.0 111.623 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.421 ' HA ' HD11 ' A' ' 36' ' ' LEU . . . -63.12 -22.57 66.95 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.267 -0.879 . . . . 10.0 113.034 -179.733 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -81.25 -5.35 57.68 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 113.934 1.087 . . . . 10.0 113.934 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.5 13.05 36.16 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-O 116.711 -1.614 . . . . 10.0 112.859 -179.902 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.421 HD11 ' HA ' ' A' ' 33' ' ' ALA . 0.0 OUTLIER -137.14 172.98 12.2 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 119.557 1.071 . . . . 10.0 110.184 179.791 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -127.94 102.29 22.15 Favored Pre-proline 0 C--O 1.24 0.601 0 N-CA-C 104.853 -2.277 . . . . 10.0 104.853 -179.593 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -57.56 87.57 0.05 OUTLIER 'Trans proline' 0 C--O 1.221 -0.374 0 N-CA-C 116.947 1.864 . . . . 10.0 116.947 179.83 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -61.55 152.57 30.0 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 122.165 0.983 . . . . 10.0 108.819 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -108.75 156.39 19.67 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.038 -1.437 . . . . 10.0 110.335 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.428 ' OE1' HG23 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -149.62 103.05 3.22 Favored 'General case' 0 N--CA 1.439 -1.007 0 N-CA-C 103.477 -2.786 . . . . 10.0 103.477 -179.866 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 5.0 mt -101.66 133.99 43.43 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 CA-C-N 115.586 -0.734 . . . . 10.0 111.885 179.834 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.428 HG23 ' OE1' ' A' ' 41' ' ' GLU . 47.2 t -136.66 90.62 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.883 0 N-CA-C 105.265 -2.124 . . . . 10.0 105.265 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 21.8 tt0 -90.0 126.76 35.87 Favored 'General case' 0 C--N 1.313 -0.983 0 O-C-N 125.6 1.813 . . . . 10.0 109.288 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -95.71 -22.48 17.52 Favored 'General case' 0 C--N 1.319 -0.747 0 O-C-N 120.571 -1.331 . . . . 10.0 108.829 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 140.34 -126.49 3.2 Favored Glycine 0 CA--C 1.534 1.243 0 N-CA-C 105.943 -2.863 . . . . 10.0 105.943 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -47.25 -30.75 3.23 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 119.737 1.769 . . . . 10.0 111.672 -179.927 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 40.7 m170 -102.37 128.46 48.94 Favored 'General case' 0 N--CA 1.444 -0.766 0 O-C-N 120.037 -1.664 . . . . 10.0 106.571 179.746 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 31.7 ttm -122.2 142.11 50.77 Favored 'General case' 0 N--CA 1.437 -1.102 0 O-C-N 119.698 -1.876 . . . . 10.0 112.374 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 10.1 mt -131.33 121.85 49.62 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.068 0 N-CA-C 107.383 -1.339 . . . . 10.0 107.383 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mp -116.16 125.98 73.46 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 N-CA-C 104.985 -2.228 . . . . 10.0 104.985 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.592 ' HA ' HG22 ' A' ' 61' ' ' ILE . 3.9 mtt85 -120.16 94.96 4.56 Favored 'General case' 0 C--O 1.214 -0.766 0 O-C-N 126.069 2.106 . . . . 10.0 109.074 -179.781 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.8 m -83.16 113.5 20.68 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 101.323 -3.584 . . . . 10.0 101.323 -179.682 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 6.6 mp -102.74 93.97 5.37 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 118.267 2.691 . . . . 10.0 118.267 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -100.21 132.0 45.83 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 104.413 -2.439 . . . . 10.0 104.413 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 8.4 p -46.88 -28.57 1.63 Allowed 'General case' 0 CA--C 1.545 0.776 0 O-C-N 125.252 1.595 . . . . 10.0 109.041 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -106.01 99.79 9.36 Favored 'General case' 0 C--O 1.245 0.817 0 C-N-CA 125.048 1.339 . . . . 10.0 110.446 -179.609 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 67.79 149.74 0.06 Allowed 'General case' 0 C--N 1.321 -0.659 0 O-C-N 126.697 2.498 . . . . 10.0 110.743 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -108.73 150.37 27.68 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 113.594 -1.639 . . . . 10.0 110.785 179.798 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 6.5 t80 -137.59 84.67 2.06 Favored 'General case' 0 N--CA 1.434 -1.244 0 CA-C-N 114.035 -1.438 . . . . 10.0 107.468 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.592 HG22 ' HA ' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -102.99 157.33 4.94 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-N 120.492 1.496 . . . . 10.0 112.488 179.821 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 2.4 mtp -134.82 158.97 42.83 Favored 'General case' 0 C--N 1.32 -0.686 0 O-C-N 126.378 2.299 . . . . 10.0 107.826 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -145.55 95.84 2.72 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 100.79 -3.782 . . . . 10.0 100.79 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 8.6 m-30 -116.87 163.38 16.28 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 117.026 2.232 . . . . 10.0 117.026 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 82.2 mt-30 -117.23 116.33 27.05 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 103.611 -2.737 . . . . 10.0 103.611 179.793 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.9 t -66.95 138.99 21.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 124.025 1.869 . . . . 10.0 109.483 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 66.06 24.39 71.73 Favored Glycine 0 C--N 1.336 0.553 0 CA-C-N 114.081 -1.418 . . . . 10.0 113.818 179.709 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 11.7 mttt -141.41 158.22 44.15 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 118.417 -1.313 . . . . 10.0 113.389 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -72.74 167.88 19.94 Favored 'General case' 0 C--N 1.316 -0.885 0 O-C-N 124.87 1.357 . . . . 10.0 109.145 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -157.48 -175.28 5.31 Favored 'General case' 0 C--O 1.247 0.941 0 C-N-CA 124.482 1.113 . . . . 10.0 110.547 -179.759 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -163.14 127.51 2.96 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 105.304 -2.11 . . . . 10.0 105.304 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -120.17 169.51 10.17 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 114.913 -1.039 . . . . 10.0 113.543 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -100.22 -15.24 18.17 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 107.258 -1.386 . . . . 10.0 107.258 179.702 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 3.3 pp -141.72 -174.64 4.12 Favored 'General case' 0 C--N 1.314 -0.954 0 O-C-N 125.495 1.747 . . . . 10.0 114.706 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -141.88 -76.1 0.29 Allowed 'General case' 0 C--O 1.218 -0.582 0 N-CA-C 106.899 -1.519 . . . . 10.0 106.899 179.829 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -130.78 76.33 0.41 Allowed Glycine 0 C--O 1.238 0.37 0 CA-C-O 119.702 -0.499 . . . . 10.0 112.273 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 19.5 mt 64.63 -71.22 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.714 0 CA-C-O 118.262 -0.875 . . . . 10.0 109.928 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -45.25 -29.81 1.08 Allowed 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 124.917 1.287 . . . . 10.0 110.536 -179.53 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.8 p30 56.25 168.77 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 129.386 3.074 . . . . 10.0 118.595 179.348 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.9 ttm-85 169.03 118.23 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 116.107 -1.902 . . . . 10.0 108.134 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 23.3 mtpt -47.52 121.19 3.76 Favored 'General case' 0 C--N 1.314 -0.973 0 O-C-N 125.336 1.648 . . . . 10.0 107.583 -179.545 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -133.93 170.61 15.36 Favored 'General case' 0 C--N 1.315 -0.901 0 O-C-N 125.933 2.021 . . . . 10.0 109.696 179.868 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 4.3 mtp -126.75 98.43 5.37 Favored 'General case' 0 N--CA 1.44 -0.964 1 N-CA-C 100.063 -4.051 . . . . 10.0 100.063 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 26.1 m -99.94 131.24 46.03 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 124.371 2.034 . . . . 10.0 114.762 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 1.2 m -115.88 128.93 56.18 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 112.773 -2.012 . . . . 10.0 107.032 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 2.2 t -106.2 127.32 61.51 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.929 0 N-CA-C 103.384 -2.821 . . . . 10.0 103.384 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.2 t -151.13 147.11 26.65 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 123.143 1.449 . . . . 10.0 111.547 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 2.2 p-90 -95.75 130.4 42.68 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 105.589 -2.004 . . . . 10.0 105.589 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -78.3 -51.17 10.53 Favored 'General case' 0 C--O 1.247 0.93 1 N-CA-C 99.904 -4.11 . . . . 10.0 99.904 179.888 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -157.25 -76.55 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.445 0 N-CA-C 108.192 -1.963 . . . . 10.0 108.192 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -114.48 19.05 16.45 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 115.103 1.52 . . . . 10.0 115.103 179.798 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 9.0 mttm -129.98 -171.96 2.66 Favored 'General case' 0 C--O 1.244 0.792 0 CA-C-O 118.24 -0.886 . . . . 10.0 108.725 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.3 tt -137.34 131.92 32.86 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 104.57 -2.382 . . . . 10.0 104.57 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -137.43 -173.62 3.53 Favored 'General case' 0 C--O 1.219 -0.508 0 N-CA-C 114.78 1.4 . . . . 10.0 114.78 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 1.1 m -156.33 137.28 13.53 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 118.817 0.735 . . . . 10.0 110.156 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 3.7 t -95.8 -52.83 8.9 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 N-CA-C 106.845 -1.539 . . . . 10.0 106.845 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 71.44 114.37 0.05 Allowed 'General case' 0 C--O 1.244 0.809 0 C-N-CA 127.395 2.278 . . . . 10.0 109.572 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 13.4 mttt -97.21 74.58 2.54 Favored 'General case' 0 C--N 1.343 0.306 0 CA-C-O 116.756 -1.593 . . . . 10.0 112.41 -179.743 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -107.5 -93.22 2.29 Favored Glycine 0 N--CA 1.451 -0.305 0 O-C-N 125.473 1.733 . . . . 10.0 109.967 179.82 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -167.55 -39.01 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 117.553 2.427 . . . . 10.0 117.553 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.05 146.34 11.43 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 113.808 1.04 . . . . 10.0 113.808 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -78.82 83.37 4.95 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 125.08 1.352 . . . . 10.0 112.341 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 142.23 -1.75 1.71 Allowed Glycine 0 C--O 1.219 -0.802 0 O-C-N 126.516 2.385 . . . . 10.0 115.544 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 23.7 mtt180 -52.63 161.81 0.66 Allowed 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 118.572 1.186 . . . . 10.0 112.835 -179.671 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 107.65 152.88 17.82 Favored Glycine 0 C--O 1.224 -0.485 0 CA-C-N 112.522 -2.126 . . . . 10.0 110.562 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' TRP . . . . . 0.423 ' CD1' ' N ' ' A' ' 106' ' ' TRP . 0.0 OUTLIER -117.39 179.28 4.09 Favored 'General case' 0 C--N 1.33 -0.249 0 O-C-N 120.198 -1.766 . . . . 10.0 110.246 179.909 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -153.51 99.08 2.3 Favored 'General case' 0 CA--C 1.503 -0.839 0 O-C-N 124.748 1.28 . . . . 10.0 108.517 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 62.4 mt-30 -98.49 147.41 24.78 Favored 'General case' 0 C--O 1.239 0.52 0 O-C-N 126.564 2.415 . . . . 10.0 112.309 -179.674 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -169.41 128.76 1.01 Allowed 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 105.966 -1.864 . . . . 10.0 105.966 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 69.5 mt -88.56 160.28 2.86 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.802 0 N-CA-C 116.894 2.183 . . . . 10.0 116.894 -179.802 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -139.28 63.04 1.51 Allowed 'General case' 0 N--CA 1.463 0.194 0 O-C-N 126.36 2.287 . . . . 10.0 106.474 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 72.89 -98.64 0.88 Allowed Glycine 0 CA--C 1.531 1.036 0 N-CA-C 107.928 -2.069 . . . . 10.0 107.928 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -108.13 19.63 19.71 Favored 'General case' 0 C--N 1.321 -0.655 0 O-C-N 121.453 -1.028 . . . . 10.0 113.078 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -128.86 95.8 4.19 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 120.554 -1.341 . . . . 10.0 111.071 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.657 HD12 ' CE3' ' A' ' 8' ' ' TRP . 0.2 OUTLIER -64.89 120.1 11.91 Favored 'General case' 0 C--N 1.319 -0.738 0 O-C-N 121.123 -0.985 . . . . 10.0 109.677 -179.838 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 5.0 t60 -109.97 103.28 12.01 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 107.083 -1.451 . . . . 10.0 107.083 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.529 ' O ' HD23 ' A' ' 117' ' ' LEU . 0.2 OUTLIER -110.09 115.94 30.66 Favored 'General case' 0 C--N 1.321 -0.653 0 O-C-N 125.237 1.586 . . . . 10.0 109.11 -179.853 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -108.83 90.99 3.46 Favored 'General case' 0 CA--C 1.507 -0.711 0 N-CA-C 105.408 -2.071 . . . . 10.0 105.408 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -78.01 154.93 31.03 Favored 'General case' 0 N--CA 1.443 -0.823 0 C-N-CA 126.336 1.854 . . . . 10.0 111.15 179.776 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -136.98 137.62 39.68 Favored 'General case' 0 C--N 1.319 -0.734 0 O-C-N 126.027 2.079 . . . . 10.0 113.809 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 121' ' ' ALA . . . . . 0.722 ' O ' HG22 ' A' ' 124' ' ' VAL . . . -160.91 129.97 4.72 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 116.362 -1.78 . . . . 10.0 109.291 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' GLU . . . . . 0.468 ' HB3' ' HB1' ' A' ' 22' ' ' ALA . 3.5 tt0 40.23 49.42 2.46 Favored 'General case' 0 C--O 1.241 0.647 0 N-CA-C 115.639 1.718 . . . . 10.0 115.639 -179.747 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 70.49 16.87 74.1 Favored Glycine 0 CA--C 1.538 1.512 0 CA-C-O 115.945 -2.586 . . . . 10.0 115.847 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.722 HG22 ' O ' ' A' ' 121' ' ' ALA . 4.0 m -108.1 169.45 3.04 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 O-C-N 125.723 1.484 . . . . 10.0 108.698 179.758 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 2.7 m -136.39 91.08 2.63 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.98 -0.554 . . . . 10.0 111.573 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 26.2 t -95.23 99.62 11.55 Favored 'General case' 0 C--O 1.216 -0.66 0 N-CA-C 105.691 -1.966 . . . . 10.0 105.691 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.33 151.01 22.4 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 114.055 -1.429 . . . . 10.0 109.564 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 14.1 mt-30 -144.4 125.5 14.53 Favored 'General case' 0 C--N 1.315 -0.911 0 O-C-N 126.136 2.147 . . . . 10.0 113.462 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 19.4 t -91.03 114.4 28.31 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 107.077 -1.453 . . . . 10.0 107.077 -179.663 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -101.99 177.21 4.96 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.661 -0.866 . . . . 10.0 108.661 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -148.17 120.06 8.16 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 106.339 -1.726 . . . . 10.0 106.339 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -79.64 125.58 29.81 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 117.86 -1.536 . . . . 10.0 107.632 -179.619 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 18.3 t -82.61 -66.18 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-O 117.934 -1.031 . . . . 10.0 109.996 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.255 1.364 0 O-C-N 125.289 1.618 . . . . 10.0 109.711 179.841 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.482 0.852 0 CA-C-O 118.287 -0.797 . . . . 10.0 112.575 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 60.0 t 73.65 -56.77 0.28 Allowed 'Isoleucine or valine' 0 C--O 1.241 0.632 0 C-N-CA 125.167 1.387 . . . . 10.0 110.44 179.656 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 62.49 -68.33 0.07 Allowed 'General case' 0 C--N 1.32 -0.692 0 O-C-N 126.53 2.394 . . . . 10.0 112.59 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 68.1 -28.97 0.15 Allowed 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 117.296 2.332 . . . . 10.0 117.296 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -37.39 115.14 0.38 Allowed 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 116.499 2.037 . . . . 10.0 116.499 179.695 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -176.16 164.19 33.98 Favored Glycine 0 CA--C 1.527 0.808 0 N-CA-C 117.384 1.714 . . . . 10.0 117.384 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 16.9 m-30 -94.96 141.92 28.08 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 101.138 -3.653 . . . . 10.0 101.138 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.758 ' NE1' HD12 ' A' ' 42' ' ' ILE . 57.8 m95 -134.82 85.73 2.2 Favored 'General case' 0 C--N 1.313 -1.0 0 O-C-N 126.012 2.07 . . . . 10.0 111.591 179.726 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.06 149.39 27.82 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 104.912 -2.255 . . . . 10.0 104.912 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.425 ' HE2' ' CZ ' ' A' ' 130' ' ' PHE . 27.4 ttm -99.93 150.09 22.76 Favored 'General case' 0 N--CA 1.444 -0.748 0 N-CA-C 115.171 1.545 . . . . 10.0 115.171 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.8 mp -108.71 -64.71 1.2 Allowed 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 113.394 -1.73 . . . . 10.0 107.281 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -156.42 154.61 30.74 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 117.023 2.231 . . . . 10.0 117.023 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -113.8 165.79 12.21 Favored 'General case' 0 CA--C 1.509 -0.616 0 O-C-N 128.406 3.566 . . . . 10.0 109.154 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -142.37 138.06 30.92 Favored 'General case' 0 C--O 1.24 0.565 0 O-C-N 120.659 -1.275 . . . . 10.0 112.962 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 60.79 17.71 7.94 Favored 'General case' 0 C--O 1.247 0.959 0 CA-C-O 124.737 2.208 . . . . 10.0 115.686 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -52.24 -50.48 61.94 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 116.607 -3.808 . . . . 10.0 115.966 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 59.7 mt-10 -63.33 -30.43 71.57 Favored 'General case' 0 C--O 1.219 -0.535 0 N-CA-C 114.748 1.388 . . . . 10.0 114.748 179.496 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -79.87 -28.99 39.92 Favored 'General case' 0 C--N 1.328 -0.361 0 O-C-N 127.022 2.701 . . . . 10.0 109.989 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -65.5 -53.26 44.95 Favored 'General case' 0 C--N 1.317 -0.823 0 O-C-N 124.209 0.943 . . . . 10.0 111.369 179.59 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.55 ' HB3' HG22 ' A' ' 25' ' ' VAL . 12.8 mt -65.45 -21.7 66.68 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 114.091 1.145 . . . . 10.0 114.091 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -71.18 -31.41 67.62 Favored 'General case' 0 C--N 1.317 -0.81 0 C-N-CA 124.316 1.046 . . . . 10.0 110.534 -179.776 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.68 -48.64 79.89 Favored 'General case' 0 CA--C 1.531 0.24 0 O-C-N 125.204 1.565 . . . . 10.0 113.396 179.301 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -90.76 -12.3 36.96 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.406 -1.27 . . . . 10.0 109.167 179.906 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.2 t0 55.83 57.82 4.91 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 114.512 -1.222 . . . . 10.0 113.529 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.55 HG22 ' HB3' ' A' ' 20' ' ' LEU . 14.5 m -73.37 -164.8 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-N 114.703 -1.135 . . . . 10.0 109.123 -179.837 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -64.17 140.83 58.91 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 116.232 1.938 . . . . 10.0 116.232 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.408 ' H ' HG12 ' A' ' 27' ' ' VAL . 1.4 p -60.15 -39.14 79.67 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.945 0 C-N-CA 126.188 1.795 . . . . 10.0 115.775 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.63 -21.16 64.49 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 114.16 -1.382 . . . . 10.0 111.043 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.41 -43.18 23.87 Favored 'General case' 0 C--O 1.218 -0.603 0 O-C-N 124.773 1.296 . . . . 10.0 110.719 -179.762 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.5 ttm180 -59.58 -34.12 72.31 Favored 'General case' 0 C--O 1.243 0.763 0 C-N-CA 125.709 1.604 . . . . 10.0 114.291 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.0 ttpt -75.89 -46.73 28.6 Favored 'General case' 0 N--CA 1.438 -1.032 0 O-C-N 125.715 1.885 . . . . 10.0 112.659 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 7.8 mm -76.19 -39.36 35.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 O-C-N 121.427 -0.796 . . . . 10.0 111.451 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.468 ' HA ' ' HB3' ' A' ' 36' ' ' LEU . . . -63.64 -24.23 67.71 Favored 'General case' 0 C--O 1.215 -0.752 0 N-CA-C 115.732 1.752 . . . . 10.0 115.732 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -65.32 -56.54 12.06 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 119.522 -0.871 . . . . 10.0 109.903 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.534 ' C ' HD12 ' A' ' 35' ' ' LEU . 4.5 pp -79.89 0.87 29.38 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 113.031 0.752 . . . . 10.0 113.031 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.468 ' HB3' ' HA ' ' A' ' 33' ' ' ALA . 12.3 tp -105.68 125.1 50.6 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 124.451 1.094 . . . . 10.0 108.728 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.56 103.06 53.08 Favored Pre-proline 0 C--N 1.316 -0.862 0 CA-C-N 120.463 1.483 . . . . 10.0 109.582 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -70.59 112.41 3.22 Favored 'Trans proline' 0 C--N 1.354 0.826 0 CA-C-O 123.906 1.544 . . . . 10.0 114.516 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -71.5 169.61 15.07 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 114.407 -1.27 . . . . 10.0 109.443 -179.78 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.6 mtmt -136.58 153.21 51.03 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-O 122.575 1.178 . . . . 10.0 112.527 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -142.1 115.35 8.89 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 103.003 -2.962 . . . . 10.0 103.003 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.758 HD12 ' NE1' ' A' ' 8' ' ' TRP . 61.7 mt -100.49 147.65 7.58 Favored 'Isoleucine or valine' 0 C--O 1.247 0.925 0 N-CA-C 108.757 -0.831 . . . . 10.0 108.757 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.5 t -147.96 130.32 7.05 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.836 0 N-CA-C 105.727 -1.953 . . . . 10.0 105.727 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -132.56 151.98 51.75 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 122.68 1.229 . . . . 10.0 109.667 -179.787 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -149.82 100.47 2.96 Favored 'General case' 0 N--CA 1.444 -0.763 0 N-CA-C 106.876 -1.528 . . . . 10.0 106.876 179.841 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.17 -115.49 4.04 Favored Glycine 0 C--N 1.345 1.045 0 N-CA-C 109.056 -1.618 . . . . 10.0 109.056 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -119.12 18.46 13.09 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 108.62 -0.882 . . . . 10.0 108.62 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 7.6 t-160 -107.85 122.24 46.39 Favored 'General case' 0 CA--C 1.508 -0.671 0 N-CA-C 106.601 -1.629 . . . . 10.0 106.601 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 4.1 ttt -109.68 134.43 51.98 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 114.333 1.234 . . . . 10.0 114.333 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 7.1 mt -118.63 98.79 6.85 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.994 0 N-CA-C 107.751 -1.204 . . . . 10.0 107.751 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.418 ' N ' HD12 ' A' ' 51' ' ' ILE . 2.0 mp -89.0 131.37 36.5 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.969 0 N-CA-C 105.527 -2.027 . . . . 10.0 105.527 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 22.0 mtm180 -129.31 133.96 47.7 Favored 'General case' 0 C--O 1.215 -0.745 0 N-CA-C 113.506 0.928 . . . . 10.0 113.506 -179.749 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 54.1 m -114.13 99.37 7.58 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 101.048 -3.686 . . . . 10.0 101.048 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 8.4 mt -99.41 133.22 44.04 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 120.194 3.405 . . . . 10.0 120.194 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -158.33 155.26 28.46 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 126.679 1.992 . . . . 10.0 105.683 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 7.0 t -87.05 -1.96 58.27 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 105.753 -1.943 . . . . 10.0 105.753 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -124.49 102.41 7.63 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 105.27 -2.122 . . . . 10.0 105.27 179.761 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 63.85 129.83 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 125.434 2.54 . . . . 10.0 110.825 179.799 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -150.28 157.24 42.86 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-O 125.15 2.405 . . . . 10.0 110.376 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 32.3 p90 -152.25 139.74 19.62 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 104.743 -2.317 . . . . 10.0 104.743 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.534 ' N ' HD12 ' A' ' 61' ' ' ILE . 2.0 mp -130.87 139.64 50.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 O-C-N 125.299 1.625 . . . . 10.0 111.443 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 5.0 ptp -115.89 179.78 3.88 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 127.322 2.249 . . . . 10.0 104.975 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -157.08 102.93 1.99 Allowed 'General case' 0 N--CA 1.441 -0.876 0 N-CA-C 102.575 -3.12 . . . . 10.0 102.575 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -114.47 160.67 18.94 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 117.696 2.48 . . . . 10.0 117.696 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 5.6 mm-40 -116.31 152.01 34.71 Favored 'General case' 0 C--O 1.216 -0.706 0 N-CA-C 107.734 -1.21 . . . . 10.0 107.734 179.732 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 14.7 t -95.19 115.9 35.25 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 CA-C-O 123.492 1.615 . . . . 10.0 111.062 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 79.41 23.94 61.91 Favored Glycine 0 C--O 1.224 -0.481 0 CA-C-N 113.943 -1.481 . . . . 10.0 113.729 179.714 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.86 145.08 51.33 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 123.346 0.658 . . . . 10.0 111.145 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 66.5 tt0 -68.95 165.17 20.58 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 107.56 -1.274 . . . . 10.0 107.56 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -160.26 131.44 5.76 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 122.741 1.258 . . . . 10.0 112.465 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -96.24 67.52 2.56 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.514 -1.221 . . . . 10.0 109.916 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 57.1 tt0 -58.79 125.11 22.13 Favored 'General case' 0 N--CA 1.442 -0.865 0 O-C-N 126.798 2.561 . . . . 10.0 115.985 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -111.61 105.11 13.56 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-O 122.853 1.311 . . . . 10.0 108.337 179.729 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 20.9 mt -80.53 137.39 36.42 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 114.752 -1.113 . . . . 10.0 113.587 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 53.8 p -120.2 105.38 10.91 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 106.155 -1.794 . . . . 10.0 106.155 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 98.79 -169.39 23.17 Favored Glycine 0 C--O 1.243 0.69 0 CA-C-O 117.171 -1.905 . . . . 10.0 108.98 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.404 HG23 ' O ' ' A' ' 77' ' ' ILE . 0.1 OUTLIER 39.64 54.11 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 O-C-N 126.739 2.082 . . . . 10.0 110.474 179.83 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 5.0 t70 86.97 -26.85 0.08 Allowed 'General case' 0 C--O 1.239 0.526 0 O-C-N 126.126 2.141 . . . . 10.0 112.426 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 47.07 100.24 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 123.947 1.832 . . . . 10.0 115.931 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.89 93.73 1.98 Allowed 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 114.222 -1.354 . . . . 10.0 110.187 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 5.4 pttt -58.44 141.02 52.84 Favored 'General case' 0 N--CA 1.444 -0.743 0 N-CA-C 104.51 -2.404 . . . . 10.0 104.51 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -134.64 -177.3 4.55 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 113.715 -1.584 . . . . 10.0 110.002 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 25.6 mtm -119.85 66.15 0.81 Allowed 'General case' 0 CA--C 1.503 -0.844 0 N-CA-C 102.564 -3.125 . . . . 10.0 102.564 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 96.7 m -72.17 139.12 48.09 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 117.623 2.453 . . . . 10.0 117.623 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -120.63 116.64 25.73 Favored 'General case' 0 C--N 1.319 -0.752 0 O-C-N 126.955 2.659 . . . . 10.0 105.566 179.782 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 1.4 t -107.36 146.89 13.01 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 O-C-N 126.961 2.663 . . . . 10.0 104.407 179.647 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.9 t -148.78 -173.83 4.46 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 123.65 0.78 . . . . 10.0 109.091 -179.843 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 1.1 p-90 -151.65 122.71 7.64 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 106.834 -1.543 . . . . 10.0 106.834 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -112.24 56.67 0.66 Allowed 'General case' 0 CA--C 1.5 -0.976 0 N-CA-C 101.648 -3.464 . . . . 10.0 101.648 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 117.43 -154.0 16.94 Favored Glycine 0 C--N 1.338 0.659 0 N-CA-C 104.92 -3.272 . . . . 10.0 104.92 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 12.0 t0 -82.85 58.63 4.42 Favored 'General case' 0 C--O 1.219 -0.528 0 O-C-N 120.024 -1.868 . . . . 10.0 112.027 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.5 mtmt -136.03 -172.11 3.04 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 122.644 1.211 . . . . 10.0 108.249 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 1.5 tp -152.64 98.29 2.34 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 108.385 -0.968 . . . . 10.0 108.385 -179.773 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.31 138.31 40.25 Favored 'General case' 0 C--O 1.216 -0.688 0 CA-C-O 121.863 0.84 . . . . 10.0 110.023 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 7.7 m -128.81 143.99 51.05 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 123.784 0.834 . . . . 10.0 111.7 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 23.8 t -137.46 110.48 7.75 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 N-CA-C 105.157 -2.164 . . . . 10.0 105.157 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 -101.65 127.29 48.45 Favored 'General case' 0 C--O 1.244 0.79 0 C-N-CA 123.219 0.608 . . . . 10.0 110.041 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 1.3 pttt -114.62 88.39 2.85 Favored 'General case' 0 C--O 1.233 0.204 0 N-CA-C 113.06 0.763 . . . . 10.0 113.06 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -115.17 -91.49 1.77 Allowed Glycine 0 N--CA 1.437 -1.252 0 N-CA-C 110.361 -1.096 . . . . 10.0 110.361 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -134.83 -8.15 2.4 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 116.966 2.21 . . . . 10.0 116.966 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.04 -177.53 4.52 Favored 'General case' 0 C--N 1.326 -0.423 0 O-C-N 126.682 2.489 . . . . 10.0 113.856 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -123.04 30.64 6.29 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 126.962 2.105 . . . . 10.0 112.869 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -161.93 -19.32 0.03 OUTLIER Glycine 0 N--CA 1.467 0.758 0 N-CA-C 119.855 2.702 . . . . 10.0 119.855 -179.742 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 1.5 mtt180 -51.42 116.12 1.92 Allowed 'General case' 0 C--O 1.223 -0.339 0 CA-C-O 124.133 1.921 . . . . 10.0 110.989 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 165.11 150.39 6.18 Favored Glycine 0 CA--C 1.518 0.26 0 N-CA-C 108.963 -1.655 . . . . 10.0 108.963 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -135.27 -173.05 3.22 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-N 114.181 -1.01 . . . . 10.0 112.227 -179.869 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' THR . . . . . 0.518 ' O ' HD12 ' A' ' 117' ' ' LEU . 35.5 m -165.63 136.03 3.64 Favored 'General case' 0 N--CA 1.443 -0.782 0 C-N-CA 124.651 1.18 . . . . 10.0 108.544 -179.767 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -125.94 103.75 7.92 Favored 'General case' 0 C--O 1.244 0.807 0 C-N-CA 126.675 1.99 . . . . 10.0 108.944 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' TRP . . . . . 0.476 ' C ' ' CD1' ' A' ' 109' ' ' TRP . 0.0 OUTLIER -100.9 161.48 13.56 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 106.254 -1.758 . . . . 10.0 106.254 -179.805 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.421 ' N ' ' CD1' ' A' ' 109' ' ' TRP . 0.6 OUTLIER -131.28 143.03 41.87 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.028 0 N-CA-C 114.957 1.466 . . . . 10.0 114.957 179.999 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -136.59 90.14 2.53 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 112.703 -2.044 . . . . 10.0 108.993 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 47.4 -91.86 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.672 0 N-CA-C 109.278 -1.529 . . . . 10.0 109.278 179.781 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -96.94 -19.83 18.53 Favored 'General case' 0 C--N 1.333 -0.146 0 O-C-N 120.57 -1.547 . . . . 10.0 113.95 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -98.09 148.87 23.1 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 121.162 1.801 . . . . 10.0 113.937 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.442 ' HB3' ' HB2' ' A' ' 130' ' ' PHE . 13.7 tp -116.53 138.0 51.73 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 106.483 -1.673 . . . . 10.0 106.483 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 48.3 m80 -132.76 89.38 2.63 Favored 'General case' 0 C--N 1.315 -0.928 0 O-C-N 121.006 -1.058 . . . . 10.0 108.62 -179.651 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.518 HD12 ' O ' ' A' ' 107' ' ' THR . 31.6 tp -94.68 142.95 26.85 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 114.317 -1.31 . . . . 10.0 109.686 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -140.78 107.5 5.36 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 119.239 -0.984 . . . . 10.0 108.769 179.904 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 6.4 mtt -87.83 149.3 24.22 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 109.446 -0.575 . . . . 10.0 109.446 179.693 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -133.61 142.93 48.33 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 118.814 0.734 . . . . 10.0 109.481 179.616 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -154.27 134.5 13.28 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 108.828 -0.805 . . . . 10.0 108.828 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 36.0 44.14 0.24 Allowed 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 116.298 1.962 . . . . 10.0 116.298 -179.694 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 91.46 2.35 70.46 Favored Glycine 0 N--CA 1.468 0.807 0 CA-C-O 118.15 -1.361 . . . . 10.0 115.878 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -109.9 162.56 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 CA-C-N 120.398 2.099 . . . . 10.0 109.667 179.873 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 20.9 m -135.92 101.68 4.81 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 114.966 1.469 . . . . 10.0 114.966 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -86.09 143.78 27.88 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 107.538 -1.282 . . . . 10.0 107.538 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 2.1 mttt -140.17 118.8 12.32 Favored 'General case' 0 C--N 1.322 -0.612 0 O-C-N 124.081 0.863 . . . . 10.0 111.539 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 83.2 mt-30 -111.02 130.01 55.72 Favored 'General case' 0 C--O 1.244 0.811 0 O-C-N 125.068 1.48 . . . . 10.0 113.106 -179.491 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 4.8 t -97.58 127.12 50.22 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-O 122.302 1.048 . . . . 10.0 111.516 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' PHE . . . . . 0.442 ' HB2' ' HB3' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -121.39 155.7 34.24 Favored 'General case' 0 N--CA 1.443 -0.793 0 C-N-CA 126.156 1.782 . . . . 10.0 110.646 179.952 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 4.9 tptt -125.59 120.45 30.85 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 105.128 -2.175 . . . . 10.0 105.128 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.81 116.14 8.15 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 120.928 1.694 . . . . 10.0 111.182 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 27.6 m -122.98 52.29 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 113.772 1.027 . . . . 10.0 113.772 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 . . . . . 0 C--O 1.242 0.7 0 CA-C-N 114.639 -1.164 . . . . 10.0 113.701 -180.0 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo . . . . . 0 N--CA 1.48 0.69 0 N-CA-C 108.901 -1.23 . . . . 10.0 108.901 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 14.5 p -78.9 154.63 4.87 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.417 0 O-C-N 126.184 2.177 . . . . 10.0 112.815 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -96.04 126.16 41.08 Favored 'General case' 0 C--N 1.329 -0.309 0 O-C-N 120.899 -1.126 . . . . 10.0 110.394 -179.645 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.524 ' CZ ' HD13 ' A' ' 93' ' ' LEU . 2.9 m-85 -128.74 -39.3 1.63 Allowed 'General case' 0 C--O 1.241 0.629 0 N-CA-C 117.531 2.419 . . . . 10.0 117.531 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -50.24 137.91 17.32 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 115.665 1.728 . . . . 10.0 115.665 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -167.04 -97.33 0.11 Allowed Glycine 0 C--N 1.341 0.827 0 CA-C-O 125.011 2.451 . . . . 10.0 112.903 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.492 ' CB ' ' CG1' ' A' ' 133' ' ' VAL . 0.1 OUTLIER 178.4 178.28 0.4 Allowed 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 104.626 -2.361 . . . . 10.0 104.626 -179.833 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.566 ' CD2' ' HB2' ' A' ' 39' ' ' ASP 0.297 36.0 p-90 -147.4 -179.6 6.97 Favored 'General case' 0 C--N 1.317 -0.809 0 O-C-N 127.403 2.939 . . . . 10.0 113.846 -178.384 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.2 ptmm? 166.42 99.8 0.0 OUTLIER 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 111.756 -2.475 . . . . 10.0 108.564 178.678 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.48 148.54 48.36 Favored 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 125.139 1.525 . . . . 10.0 114.44 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.501 HD13 ' HB2' ' A' ' 131' ' ' LYS . 0.1 OUTLIER -113.25 -10.93 13.29 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.263 -0.881 . . . . 10.0 109.572 179.973 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 42.3 t -172.06 168.19 5.89 Favored 'General case' 0 CA--C 1.515 -0.377 0 N-CA-C 115.199 1.555 . . . . 10.0 115.199 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.4 t-20 -163.76 122.97 2.02 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 105.198 -2.149 . . . . 10.0 105.198 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -125.28 178.09 5.78 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 119.734 1.152 . . . . 10.0 111.278 -179.785 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 37.7 m-20 34.22 33.59 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.478 0 O-C-N 127.057 2.723 . . . . 10.0 112.298 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.645 ' HE2' ' HB1' ' A' ' 33' ' ' ALA . 6.0 t80 -68.42 -42.87 78.31 Favored 'General case' 0 CA--C 1.546 0.796 0 O-C-N 120.018 -1.676 . . . . 10.0 112.939 179.607 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 74.7 mt-10 -71.22 -34.48 70.87 Favored 'General case' 0 N--CA 1.464 0.238 0 O-C-N 120.317 -1.489 . . . . 10.0 112.55 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -74.58 -34.43 62.89 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 106.968 -1.493 . . . . 10.0 106.968 179.524 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -69.63 -27.9 65.46 Favored 'General case' 0 C--O 1.245 0.832 0 O-C-N 126.04 2.088 . . . . 10.0 109.079 179.587 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 44.5 mt -79.0 -25.59 43.33 Favored 'General case' 0 C--O 1.22 -0.479 0 N-CA-C 112.652 0.612 . . . . 10.0 112.652 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 17.3 tpt180 -79.11 -20.37 48.82 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 113.629 -1.623 . . . . 10.0 109.437 179.889 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.68 -44.42 96.3 Favored 'General case' 0 C--O 1.213 -0.847 0 C-N-CA 126.383 1.873 . . . . 10.0 113.228 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -84.88 -21.56 29.69 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 123.714 1.721 . . . . 10.0 109.712 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.9 t0 74.45 67.73 0.09 Allowed 'General case' 0 N--CA 1.48 1.027 0 CA-C-N 113.404 -1.725 . . . . 10.0 113.519 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 5.8 m -98.44 -176.89 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.469 0 N-CA-C 105.316 -2.105 . . . . 10.0 105.316 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.43 133.54 55.17 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-O 123.617 1.675 . . . . 10.0 113.411 -179.771 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 4.2 m -63.69 -31.77 54.34 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 N-CA-C 116.409 2.003 . . . . 10.0 116.409 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -74.14 -30.22 62.18 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-O 123.593 1.663 . . . . 10.0 108.829 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 60.8 tp -73.63 -22.06 60.11 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 113.325 -1.761 . . . . 10.0 112.686 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.5 ttp-105 -71.97 -31.02 65.87 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 114.931 -1.031 . . . . 10.0 111.917 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 14.8 tttm -74.2 -39.13 63.36 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-O 122.943 1.354 . . . . 10.0 113.872 -179.447 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.615 ' N ' HD13 ' A' ' 32' ' ' ILE . 1.2 mm -72.61 -33.21 44.1 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.747 0 O-C-N 119.619 -1.926 . . . . 10.0 112.074 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.645 ' HB1' ' HE2' ' A' ' 16' ' ' PHE . . . -69.77 -33.15 72.01 Favored 'General case' 0 C--O 1.217 -0.654 0 CA-C-O 118.348 -0.834 . . . . 10.0 111.659 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.405 ' C ' HD23 ' A' ' 35' ' ' LEU . 26.8 t-20 -60.21 -14.3 16.93 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 118.04 -1.464 . . . . 10.0 113.109 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.534 HD23 ' N ' ' A' ' 35' ' ' LEU . 5.9 mt -93.8 -18.6 21.87 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 118.517 -1.273 . . . . 10.0 111.86 -179.793 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -91.28 134.39 34.62 Favored 'General case' 0 N--CA 1.48 1.05 0 O-C-N 124.654 1.221 . . . . 10.0 109.033 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 16.8 mtpp -123.33 103.93 35.13 Favored Pre-proline 0 N--CA 1.475 0.783 0 N-CA-C 104.785 -2.302 . . . . 10.0 104.785 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -60.69 136.64 68.02 Favored 'Trans proline' 0 C--N 1.357 1.009 0 N-CA-C 117.796 2.191 . . . . 10.0 117.796 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.566 ' HB2' ' CD2' ' A' ' 8' ' ' TRP . 0.4 OUTLIER -100.05 174.66 6.06 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 104.876 -2.268 . . . . 10.0 104.876 179.455 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.408 ' C ' ' CD1' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -167.77 119.05 0.85 Allowed 'General case' 0 CA--C 1.497 -1.075 0 C-N-CA 116.82 -1.952 . . . . 10.0 112.681 179.839 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.413 ' HA ' ' HD1' ' A' ' 8' ' ' TRP . 9.0 tt0 -103.71 137.6 41.51 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 107.084 -1.45 . . . . 10.0 107.084 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 16.0 mt -112.64 153.23 14.28 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-O 117.427 -1.273 . . . . 10.0 107.709 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -147.75 126.32 3.79 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.734 0 N-CA-C 105.523 -2.029 . . . . 10.0 105.523 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 6.5 mm100 -131.86 113.44 13.47 Favored 'General case' 0 C--N 1.314 -0.977 0 O-C-N 125.605 1.816 . . . . 10.0 110.404 179.667 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -104.66 -11.77 16.73 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 105.089 -2.189 . . . . 10.0 105.089 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 166.47 -123.89 1.18 Allowed Glycine 0 CA--C 1.511 -0.171 0 N-CA-C 108.958 -1.657 . . . . 10.0 108.958 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -84.37 -8.13 59.08 Favored 'General case' 0 C--O 1.216 -0.701 0 CA-C-N 121.242 2.521 . . . . 10.0 108.308 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -96.02 118.03 31.82 Favored 'General case' 0 C--O 1.219 -0.524 0 N-CA-C 105.907 -1.886 . . . . 10.0 105.907 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 17.9 ttp -115.46 127.29 55.22 Favored 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 115.216 1.561 . . . . 10.0 115.216 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 15.0 mt -113.5 145.37 19.48 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.057 0 N-CA-C 105.175 -2.157 . . . . 10.0 105.175 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.6 mt -136.75 114.15 13.66 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-O 122.956 1.36 . . . . 10.0 107.807 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -95.92 84.32 3.84 Favored 'General case' 0 CA--C 1.503 -0.83 0 CA-C-N 112.911 -1.95 . . . . 10.0 111.555 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.415 ' HB ' ' HB3' ' A' ' 60' ' ' TYR . 98.5 m -89.35 115.91 27.16 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 100.203 -3.999 . . . . 10.0 100.203 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 43.9 mt -117.47 73.79 0.9 Allowed 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 119.174 3.028 . . . . 10.0 119.174 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 4.3 m -69.01 101.09 1.32 Allowed 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 102.572 -3.122 . . . . 10.0 102.572 179.809 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.8 t -60.16 96.35 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 119.991 1.269 . . . . 10.0 108.466 -179.716 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER 160.08 -42.6 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 126.713 2.005 . . . . 10.0 106.247 -179.865 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -144.11 105.16 4.21 Favored 'General case' 0 CA--C 1.511 -0.55 0 O-C-N 126.117 2.135 . . . . 10.0 112.517 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.92 125.38 23.78 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 120.079 -1.638 . . . . 10.0 108.637 179.848 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.415 ' HB3' ' HB ' ' A' ' 53' ' ' THR . 0.3 OUTLIER -109.01 125.92 52.57 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 102.403 -3.184 . . . . 10.0 102.403 -179.817 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 5.1 mt -132.81 129.55 58.25 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.722 0 N-CA-C 112.931 0.715 . . . . 10.0 112.931 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -134.0 164.32 27.58 Favored 'General case' 0 C--O 1.216 -0.7 0 N-CA-C 108.033 -1.099 . . . . 10.0 108.033 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -157.61 77.21 0.83 Allowed 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 101.041 -3.689 . . . . 10.0 101.041 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 1.8 m-30 -91.59 -178.07 4.97 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 117.212 2.301 . . . . 10.0 117.212 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -132.69 145.04 50.72 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 107.099 -1.445 . . . . 10.0 107.099 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 95.3 t -81.74 85.41 1.63 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.207 0 O-C-N 124.669 1.231 . . . . 10.0 113.335 -179.679 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 110.16 55.21 0.54 Allowed Glycine 0 C--O 1.221 -0.676 0 C-N-CA 120.547 -0.835 . . . . 10.0 113.367 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 34.4 ttmt -157.93 138.46 12.85 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-N 118.663 1.231 . . . . 10.0 112.6 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -78.2 123.15 26.58 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-O 123.197 1.475 . . . . 10.0 110.142 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -106.54 178.04 4.68 Favored 'General case' 0 C--O 1.244 0.79 0 CA-C-N 112.737 -2.028 . . . . 10.0 108.444 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -145.84 81.82 1.61 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 113.265 -1.789 . . . . 10.0 109.439 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -75.31 139.99 42.82 Favored 'General case' 0 C--O 1.219 -0.545 0 O-C-N 124.768 1.293 . . . . 10.0 112.068 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -112.32 70.88 0.72 Allowed 'General case' 0 N--CA 1.456 -0.154 0 CA-C-O 124.082 1.896 . . . . 10.0 106.007 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.434 HD22 ' HA ' ' A' ' 74' ' ' LEU . 0.2 OUTLIER -65.63 129.96 41.61 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 123.789 1.757 . . . . 10.0 111.625 179.778 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -135.19 65.75 1.55 Allowed 'General case' 0 CA--C 1.51 -0.589 0 N-CA-C 105.806 -1.924 . . . . 10.0 105.806 179.78 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -159.5 -178.89 33.91 Favored Glycine 0 N--CA 1.438 -1.207 0 CA-C-O 117.334 -1.814 . . . . 10.0 109.705 -179.621 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.631 HD13 ' N ' ' A' ' 77' ' ' ILE . 0.0 OUTLIER 37.7 -93.99 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.51 -0.589 0 O-C-N 127.179 2.34 . . . . 10.0 110.035 -179.848 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -87.94 -31.19 19.55 Favored 'General case' 0 CA--C 1.51 -0.578 0 N-CA-C 114.963 1.468 . . . . 10.0 114.963 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.4 t0 77.91 116.25 0.06 Allowed 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 127.451 2.3 . . . . 10.0 113.587 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 3.6 mtt180 169.15 161.96 0.05 Allowed 'General case' 0 C--N 1.315 -0.899 0 O-C-N 120.676 -1.265 . . . . 10.0 109.152 -179.705 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.04 165.78 11.22 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 108.802 -0.814 . . . . 10.0 108.802 -179.732 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -135.13 -174.8 3.71 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 122.522 1.153 . . . . 10.0 110.179 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -145.86 44.49 1.27 Allowed 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 101.44 -3.541 . . . . 10.0 101.44 179.868 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.41 ' HA ' ' HA ' ' A' ' 97' ' ' GLN . 0.9 OUTLIER -42.14 150.13 0.13 Allowed 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 118.931 2.937 . . . . 10.0 118.931 179.869 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 87.6 m -139.16 104.36 4.99 Favored 'General case' 0 CA--C 1.506 -0.746 0 N-CA-C 104.785 -2.302 . . . . 10.0 104.785 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -91.53 107.02 18.26 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.068 0 N-CA-C 102.795 -3.039 . . . . 10.0 102.795 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 15.6 p -139.97 135.41 32.73 Favored 'General case' 0 C--O 1.243 0.724 0 C-N-CA 119.001 -1.08 . . . . 10.0 111.562 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -65.94 110.74 3.01 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-O 123.072 1.415 . . . . 10.0 108.21 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -84.96 -24.12 28.47 Favored 'General case' 0 C--O 1.248 1.001 0 N-CA-C 102.76 -3.052 . . . . 10.0 102.76 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 146.05 70.74 0.02 OUTLIER Glycine 0 C--N 1.317 -0.525 0 N-CA-C 103.175 -3.97 . . . . 10.0 103.175 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 86.56 -57.23 0.06 Allowed 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 124.812 1.245 . . . . 10.0 108.113 -179.865 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.7 ttpp -55.86 105.29 0.17 Allowed 'General case' 0 C--O 1.236 0.36 0 N-CA-C 106.112 -1.81 . . . . 10.0 106.112 -179.785 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.524 HD13 ' CZ ' ' A' ' 4' ' ' PHE . 4.2 tp -67.97 99.48 0.86 Allowed 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 103.935 -2.617 . . . . 10.0 103.935 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -88.44 113.62 24.22 Favored 'General case' 0 C--O 1.218 -0.598 0 N-CA-C 114.858 1.429 . . . . 10.0 114.858 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 27.1 m -104.83 98.43 8.16 Favored 'General case' 0 N--CA 1.443 -0.787 0 O-C-N 126.044 2.09 . . . . 10.0 110.068 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -108.24 116.89 52.6 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 N-CA-C 105.061 -2.2 . . . . 10.0 105.061 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.41 ' HA ' ' HA ' ' A' ' 84' ' ' THR . 1.4 pt20 -110.45 118.4 36.16 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 126.727 2.517 . . . . 10.0 112.942 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 12.0 mtmt -74.61 119.53 18.92 Favored 'General case' 0 C--O 1.215 -0.754 0 O-C-N 124.276 0.985 . . . . 10.0 112.431 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -173.99 -160.69 22.72 Favored Glycine 0 C--N 1.338 0.669 0 N-CA-C 109.683 -1.367 . . . . 10.0 109.683 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -82.54 -172.15 3.88 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-O 116.204 -1.855 . . . . 10.0 111.568 179.86 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 81.05 -157.07 0.02 OUTLIER 'General case' 0 C--N 1.317 -0.84 0 O-C-N 127.087 2.742 . . . . 10.0 111.319 -179.863 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -136.29 -41.34 0.64 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.983 0.897 . . . . 10.0 113.087 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -97.61 1.39 60.02 Favored Glycine 0 CA--C 1.526 0.78 0 CA-C-O 116.108 -2.496 . . . . 10.0 117.041 -179.7 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 1.8 mtt180 -53.16 129.69 32.01 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 123.289 1.518 . . . . 10.0 109.692 -179.815 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 134.88 133.29 3.26 Favored Glycine 0 C--O 1.219 -0.829 0 CA-C-N 113.493 -1.685 . . . . 10.0 109.558 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -110.75 -169.47 1.46 Allowed 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 108.812 -0.81 . . . . 10.0 108.812 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -162.03 132.94 5.06 Favored 'General case' 0 C--O 1.211 -0.933 0 O-C-N 125.684 1.865 . . . . 10.0 108.713 -179.753 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -115.74 95.3 5.06 Favored 'General case' 0 C--N 1.316 -0.877 0 O-C-N 125.69 1.869 . . . . 10.0 109.846 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' TRP . . . . . 0.461 ' CD1' ' C ' ' A' ' 109' ' ' TRP . 1.3 t90 -109.73 114.18 27.56 Favored 'General case' 0 C--O 1.221 -0.414 0 CA-C-N 114.592 -1.185 . . . . 10.0 108.859 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.623 HG23 ' O ' ' A' ' 114' ' ' GLU . 88.3 mt -91.52 140.08 16.67 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 CA-C-N 113.412 -1.722 . . . . 10.0 114.041 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -116.67 64.45 0.71 Allowed 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 104.143 -2.54 . . . . 10.0 104.143 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 66.68 -119.24 11.93 Favored Glycine 0 N--CA 1.467 0.744 0 N-CA-C 108.294 -1.923 . . . . 10.0 108.294 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -63.15 -4.37 2.36 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 121.121 -1.223 . . . . 10.0 113.247 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.623 ' O ' HG23 ' A' ' 110' ' ' ILE . 10.3 mt-10 -118.14 156.66 28.32 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 119.388 0.994 . . . . 10.0 110.047 179.848 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.406 HD12 ' C ' ' A' ' 115' ' ' LEU . 0.2 OUTLIER -124.19 105.86 9.85 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 105.299 -2.111 . . . . 10.0 105.299 179.755 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 18.8 m80 -97.81 85.96 3.66 Favored 'General case' 0 CA--C 1.505 -0.788 0 O-C-N 119.55 -1.969 . . . . 10.0 109.049 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.82 115.15 24.05 Favored 'General case' 0 N--CA 1.447 -0.599 0 O-C-N 125.271 1.607 . . . . 10.0 110.869 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -117.16 90.68 3.39 Favored 'General case' 0 CA--C 1.498 -1.055 0 CA-C-O 118.47 -0.776 . . . . 10.0 111.264 -179.781 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 34.6 mtm -82.28 162.22 22.37 Favored 'General case' 0 CA--C 1.514 -0.414 0 C-N-CA 119.193 -1.003 . . . . 10.0 110.425 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 3.8 ttm180 -150.53 150.24 30.99 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 122.396 1.093 . . . . 10.0 112.38 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -166.62 124.75 1.39 Allowed 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 114.338 -1.301 . . . . 10.0 108.457 -179.799 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 53.58 34.74 19.25 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 117.952 2.575 . . . . 10.0 117.952 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 91.01 -6.97 81.69 Favored Glycine 0 C--N 1.336 0.546 0 N-CA-C 117.551 1.78 . . . . 10.0 117.551 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 15.1 t -108.72 117.97 55.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 CA-C-N 118.213 1.007 . . . . 10.0 112.469 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 22.7 m -92.37 119.28 31.76 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 126.009 2.068 . . . . 10.0 112.352 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -107.96 139.29 42.8 Favored 'General case' 0 C--N 1.322 -0.595 0 O-C-N 127.513 3.008 . . . . 10.0 106.175 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.42 149.58 34.98 Favored 'General case' 0 C--N 1.319 -0.745 0 C-N-CA 118.759 -1.176 . . . . 10.0 112.926 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -132.96 117.7 17.97 Favored 'General case' 0 C--N 1.318 -0.78 0 O-C-N 127.877 3.236 . . . . 10.0 109.509 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 38.9 t -78.39 87.42 1.1 Allowed 'Isoleucine or valine' 0 C--O 1.217 -0.636 0 C-N-CA 118.549 -1.26 . . . . 10.0 110.227 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -73.42 167.68 20.78 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 108.451 -0.944 . . . . 10.0 108.451 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.501 ' HB2' HD13 ' A' ' 11' ' ' LEU . 1.0 OUTLIER -139.04 88.25 2.27 Favored 'General case' 0 C--O 1.241 0.616 0 N-CA-C 106.343 -1.725 . . . . 10.0 106.343 -179.962 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 9.2 ttpt -61.67 98.82 0.1 Allowed 'General case' 0 C--N 1.32 -0.702 0 O-C-N 121.95 -0.469 . . . . 10.0 110.017 179.771 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' VAL . . . . . 0.492 ' CG1' ' CB ' ' A' ' 7' ' ' TYR . 9.5 p -43.96 -31.18 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 C-N-CA 124.76 1.224 . . . . 10.0 111.275 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 54.7 t-80 . . . . . 0 C--O 1.245 0.826 0 O-C-N 126.189 2.181 . . . . 10.0 110.981 -179.72 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.473 0.286 0 CA-C-O 122.366 0.902 . . . . 10.0 112.687 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 2.0 t -127.02 15.79 3.57 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-O 123.138 1.447 . . . . 10.0 111.371 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -70.92 112.65 7.26 Favored 'General case' 0 C--O 1.24 0.601 0 CA-C-N 113.927 -1.488 . . . . 10.0 110.715 -179.877 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.42 ' HB3' HG21 ' A' ' 42' ' ' ILE . 8.1 m-85 -74.08 -15.9 61.04 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 123.989 0.806 . . . . 10.0 112.652 179.747 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -58.01 115.38 2.84 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 122.493 1.14 . . . . 10.0 112.766 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -162.3 -101.33 0.16 Allowed Glycine 0 C--N 1.344 0.986 0 N-CA-C 118.87 2.308 . . . . 10.0 118.87 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.414 ' HA ' ' CE3' ' A' ' 8' ' ' TRP . 6.4 m-85 -167.9 163.28 13.85 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 102.535 -3.135 . . . . 10.0 102.535 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.566 ' CZ3' ' CG ' ' A' ' 41' ' ' GLU 0.285 29.6 p90 -144.41 -176.39 5.02 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 125.683 1.593 . . . . 10.0 113.51 -179.492 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 164.41 93.52 0.0 OUTLIER 'General case' 0 C--O 1.232 0.173 0 CA-C-N 111.984 -2.371 . . . . 10.0 107.999 179.3 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.402 ' HG3' ' HB3' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -41.68 153.36 0.06 Allowed 'General case' 0 C--N 1.311 -1.083 0 N-CA-C 115.164 1.542 . . . . 10.0 115.164 179.435 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.462 HD22 ' CG1' ' A' ' 129' ' ' VAL . 0.3 OUTLIER -118.61 -49.0 2.47 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 108.065 -1.087 . . . . 10.0 108.065 -179.976 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.8 t -161.76 164.36 29.01 Favored 'General case' 0 C--O 1.242 0.68 0 N-CA-C 115.079 1.511 . . . . 10.0 115.079 179.76 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -129.25 151.36 50.0 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 105.121 -2.177 . . . . 10.0 105.121 179.837 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -151.47 137.53 18.26 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 116.839 2.163 . . . . 10.0 116.839 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 74.1 m-20 55.56 19.97 3.54 Favored 'General case' 0 N--CA 1.444 -0.754 0 O-C-N 125.793 1.933 . . . . 10.0 112.657 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.421 ' CZ ' ' HA ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -69.01 -20.43 64.15 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 114.551 1.315 . . . . 10.0 114.551 179.723 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -78.58 -40.14 35.5 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 119.794 -1.816 . . . . 10.0 111.576 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -75.55 -20.89 58.35 Favored 'General case' 0 CA--C 1.51 -0.581 0 N-CA-C 108.256 -1.016 . . . . 10.0 108.256 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -72.93 -34.2 66.43 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 105.964 -1.865 . . . . 10.0 105.964 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 41.5 mt -78.81 -23.31 45.2 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 120.82 1.646 . . . . 10.0 108.858 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.5 ttm-85 -69.33 -30.39 68.43 Favored 'General case' 0 N--CA 1.447 -0.617 0 O-C-N 126.127 2.142 . . . . 10.0 108.652 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.86 -38.95 83.75 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 125.152 1.381 . . . . 10.0 110.923 -179.645 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 33.4 mt -75.9 -28.17 57.98 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 117.51 -1.233 . . . . 10.0 109.454 179.816 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.4 t70 78.51 45.96 0.06 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 126.762 2.539 . . . . 10.0 113.042 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 3.2 m -85.64 -162.65 0.08 OUTLIER 'Isoleucine or valine' 0 C--O 1.243 0.748 0 N-CA-C 106.998 -1.482 . . . . 10.0 106.998 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -93.4 170.83 9.32 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 116.599 2.074 . . . . 10.0 116.599 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.5 m -75.89 -35.46 29.99 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 CA-C-N 112.847 -1.979 . . . . 10.0 111.733 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.05 -34.19 74.79 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 122.884 1.326 . . . . 10.0 111.293 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.734 HD13 ' O ' ' A' ' 29' ' ' LEU . 1.7 tm? -76.9 -40.85 45.95 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.492 -1.231 . . . . 10.0 111.553 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.5 ttp85 -61.38 -29.08 69.69 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 125.432 1.493 . . . . 10.0 113.948 179.706 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.48 -41.47 39.37 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 106.495 -1.669 . . . . 10.0 106.495 179.75 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.452 HD13 ' HA ' ' A' ' 32' ' ' ILE . 2.1 mm -62.25 -40.57 88.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 O-C-N 120.204 -1.56 . . . . 10.0 112.196 -179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -73.79 -48.25 32.9 Favored 'General case' 0 N--CA 1.476 0.83 0 O-C-N 125.245 1.591 . . . . 10.0 110.943 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.421 ' HA ' ' CZ ' ' A' ' 16' ' ' PHE . 0.0 OUTLIER -67.79 175.24 3.09 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-O 115.381 -2.247 . . . . 10.0 107.976 179.085 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.412 ' N ' ' CG ' ' A' ' 34' ' ' ASN . 0.3 OUTLIER 84.0 -43.6 0.09 Allowed 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 114.957 1.466 . . . . 10.0 114.957 179.831 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.479 HD11 ' HB3' ' A' ' 57' ' ' PHE . 51.9 mt -83.79 152.13 24.81 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 126.626 2.454 . . . . 10.0 111.182 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.402 ' HB3' ' HG3' ' A' ' 10' ' ' MET . 6.9 mttt -125.52 96.22 39.06 Favored Pre-proline 0 C--N 1.318 -0.797 0 O-C-N 127.374 2.921 . . . . 10.0 107.132 -179.737 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -63.6 -170.35 0.11 Allowed 'Trans proline' 0 C--O 1.219 -0.447 0 O-C-N 124.806 1.95 . . . . 10.0 116.261 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.551 ' HB3' ' CD1' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -141.93 171.36 14.16 Favored 'General case' 0 C--O 1.235 0.33 0 O-C-N 126.665 2.478 . . . . 10.0 108.024 179.942 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.441 ' HB2' ' CZ ' ' A' ' 130' ' ' PHE . 0.8 OUTLIER -149.21 90.93 1.78 Allowed 'General case' 0 CA--C 1.498 -1.046 0 CA-C-O 123.63 1.681 . . . . 10.0 112.398 -179.698 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.566 ' CG ' ' CZ3' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -88.98 142.72 27.4 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 103.609 -2.737 . . . . 10.0 103.609 -179.793 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.42 HG21 ' HB3' ' A' ' 4' ' ' PHE . 7.7 mm -127.31 149.97 32.8 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.736 0 CA-C-N 119.403 1.001 . . . . 10.0 108.51 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.413 HG23 ' O ' ' A' ' 42' ' ' ILE . 16.9 t -153.82 132.43 2.95 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 N-CA-C 104.963 -2.236 . . . . 10.0 104.963 179.853 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -141.7 130.03 22.37 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 124.178 1.942 . . . . 10.0 107.397 179.625 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -88.8 -9.21 52.62 Favored 'General case' 0 C--N 1.313 -0.995 0 C-N-CA 126.399 1.88 . . . . 10.0 107.98 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 145.49 -96.1 0.18 Allowed Glycine 0 N--CA 1.468 0.786 0 O-C-N 127.333 2.896 . . . . 10.0 108.888 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -90.57 -23.67 20.8 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 118.555 1.177 . . . . 10.0 110.586 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.4 t-160 -85.51 116.8 24.03 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 104.447 -2.427 . . . . 10.0 104.447 179.866 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 58.3 ttp -101.81 147.11 26.88 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 113.637 -1.62 . . . . 10.0 114.179 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 31.9 mt -137.79 115.46 12.81 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.735 0 O-C-N 119.113 -2.242 . . . . 10.0 107.852 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.6 mp -105.89 127.63 60.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 105.415 -2.068 . . . . 10.0 105.415 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 83.4 mtt180 -116.33 138.48 51.29 Favored 'General case' 0 C--O 1.212 -0.88 0 O-C-N 126.687 2.492 . . . . 10.0 111.799 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.421 ' HB ' ' O ' ' A' ' 59' ' ' ASN . 5.8 m -131.19 134.28 46.33 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 100.547 -3.871 . . . . 10.0 100.547 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.2 mp -126.48 63.81 1.27 Allowed 'General case' 0 C--N 1.321 -0.636 1 N-CA-C 121.845 4.017 . . . . 10.0 121.845 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.3 m -84.57 153.05 23.47 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 105.376 -2.083 . . . . 10.0 105.376 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -63.54 -29.16 70.46 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 107.249 -1.389 . . . . 10.0 107.249 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.479 ' HB3' HD11 ' A' ' 36' ' ' LEU . 2.1 t80 -112.41 123.74 50.95 Favored 'General case' 0 C--O 1.243 0.76 0 O-C-N 125.831 1.957 . . . . 10.0 107.945 -179.899 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 53.53 91.67 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 113.813 1.042 . . . . 10.0 113.813 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ASN . . . . . 0.503 ' HB3' ' CD1' ' A' ' 61' ' ' ILE . 6.0 m-20 -58.32 -52.39 65.81 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 115.126 -0.943 . . . . 10.0 110.736 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER 76.42 84.95 0.09 Allowed 'General case' 0 C--N 1.311 -1.105 0 C-N-CA 126.325 1.85 . . . . 10.0 106.105 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.503 ' CD1' ' HB3' ' A' ' 59' ' ' ASN . 1.7 mp -105.75 135.54 43.55 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.81 0 O-C-N 120.834 -1.166 . . . . 10.0 110.33 -179.868 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 7.8 mtt -125.58 166.58 16.43 Favored 'General case' 0 C--O 1.214 -0.802 0 N-CA-C 107.692 -1.225 . . . . 10.0 107.692 179.813 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -146.02 89.61 1.9 Allowed 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 100.301 -3.963 . . . . 10.0 100.301 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.654 ' CD2' HG21 ' A' ' 86' ' ' VAL . 3.7 m-30 -100.63 157.43 16.68 Favored 'General case' 0 C--N 1.32 -0.714 0 O-C-N 126.168 2.168 . . . . 10.0 113.999 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -120.22 104.47 10.09 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 105.504 -2.035 . . . . 10.0 105.504 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.433 ' O ' HG12 ' A' ' 66' ' ' VAL . 1.7 t -59.48 113.12 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.921 0 CA-C-N 115.423 -0.808 . . . . 10.0 109.49 -179.678 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 103.2 22.01 9.56 Favored Glycine 0 C--O 1.224 -0.5 0 CA-C-O 117.613 -1.659 . . . . 10.0 114.98 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.1 tttm -140.95 159.36 42.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 121.055 2.428 . . . . 10.0 115.951 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.86 144.19 35.22 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 107.765 -1.198 . . . . 10.0 107.765 -179.846 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -144.02 98.69 3.26 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-O 123.543 1.639 . . . . 10.0 112.686 179.735 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -70.33 103.4 2.39 Favored 'General case' 0 C--O 1.22 -0.474 0 O-C-N 119.364 -2.085 . . . . 10.0 105.639 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.458 ' HB3' ' HG ' ' A' ' 74' ' ' LEU . 3.5 mt-10 -75.86 -34.39 60.04 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-O 117.214 -1.374 . . . . 10.0 114.342 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 41.53 73.65 0.12 Allowed 'General case' 0 C--N 1.317 -0.816 0 O-C-N 126.409 2.318 . . . . 10.0 109.702 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.458 ' HG ' ' HB3' ' A' ' 72' ' ' GLU . 1.2 mt -95.55 126.77 41.07 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 115.742 1.756 . . . . 10.0 115.742 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 35.6 p -123.84 41.56 3.45 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 103.845 -2.65 . . . . 10.0 103.845 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -155.0 165.99 32.36 Favored Glycine 0 N--CA 1.446 -0.668 0 N-CA-C 109.733 -1.347 . . . . 10.0 109.733 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.472 HD13 ' N ' ' A' ' 77' ' ' ILE . 3.0 mm 64.21 -73.81 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 O-C-N 126.089 1.699 . . . . 10.0 107.772 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 23.7 p30 -139.09 39.02 2.12 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 117.548 -1.215 . . . . 10.0 108.567 179.635 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 4.26 91.16 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.646 0 O-C-N 127.523 3.014 . . . . 10.0 117.528 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.46 112.59 8.59 Favored 'General case' 0 CA--C 1.506 -0.726 0 CA-C-O 121.645 0.736 . . . . 10.0 112.828 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 7.3 pttt -80.25 121.54 25.76 Favored 'General case' 0 N--CA 1.438 -1.074 0 N-CA-C 103.515 -2.772 . . . . 10.0 103.515 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 28.2 p -153.21 -178.59 7.06 Favored 'General case' 0 C--O 1.216 -0.705 0 CA-C-N 114.906 -1.043 . . . . 10.0 108.204 -179.856 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.1 ptt? -130.48 132.78 45.83 Favored 'General case' 0 CA--C 1.505 -0.773 1 N-CA-C 99.003 -4.443 . . . . 10.0 99.003 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 25.6 m -132.64 120.71 22.12 Favored 'General case' 0 CA--C 1.505 -0.769 0 N-CA-C 118.179 2.659 . . . . 10.0 118.179 -179.737 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.12 118.6 36.83 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 112.313 -2.221 . . . . 10.0 108.471 -179.811 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.654 HG21 ' CD2' ' A' ' 64' ' ' PHE . 96.5 t -104.66 120.3 54.89 Favored 'Isoleucine or valine' 0 C--O 1.24 0.561 0 N-CA-C 105.795 -1.928 . . . . 10.0 105.795 -179.922 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -127.15 -159.14 0.91 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 123.94 1.829 . . . . 10.0 109.821 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 7.4 p-90 -148.77 123.59 9.93 Favored 'General case' 0 CA--C 1.51 -0.573 0 O-C-N 120.569 -1.332 . . . . 10.0 107.9 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -80.0 -38.33 32.33 Favored 'General case' 0 N--CA 1.447 -0.62 1 N-CA-C 98.862 -4.495 . . . . 10.0 98.862 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 134.4 126.81 2.67 Favored Glycine 0 N--CA 1.44 -1.034 0 N-CA-C 103.857 -3.697 . . . . 10.0 103.857 -179.855 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 58.14 20.44 7.01 Favored 'General case' 0 N--CA 1.468 0.426 0 O-C-N 120.706 -1.467 . . . . 10.0 110.247 179.821 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 5.0 ttpt -156.7 143.47 18.55 Favored 'General case' 0 C--N 1.341 0.211 0 O-C-N 125.879 1.987 . . . . 10.0 108.501 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 2.9 tp -111.45 82.94 1.69 Allowed 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 106.137 -1.801 . . . . 10.0 106.137 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -86.79 145.31 26.67 Favored 'General case' 0 CA--C 1.505 -0.769 0 O-C-N 119.716 -1.865 . . . . 10.0 111.303 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -144.07 141.72 30.23 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-N 114.392 -1.277 . . . . 10.0 109.777 179.75 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 1.6 t -122.62 142.71 38.08 Favored 'Isoleucine or valine' 0 C--O 1.242 0.702 0 N-CA-C 105.217 -2.142 . . . . 10.0 105.217 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 31.3 mt-30 -125.15 100.01 6.36 Favored 'General case' 0 C--O 1.246 0.881 0 CA-C-N 114.074 -1.421 . . . . 10.0 112.247 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 28.8 mmtt -63.45 113.49 3.3 Favored 'General case' 0 CA--C 1.505 -0.77 0 N-CA-C 115.396 1.628 . . . . 10.0 115.396 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -145.99 -114.11 0.85 Allowed Glycine 0 C--O 1.217 -0.953 0 C-N-CA 118.584 -1.769 . . . . 10.0 113.357 -179.651 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 18.8 tp10 -126.8 -9.02 6.1 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 115.348 1.611 . . . . 10.0 115.348 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 21.5 mmtt -107.57 158.26 17.38 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 117.699 2.481 . . . . 10.0 117.699 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -51.55 -63.07 1.25 Allowed 'General case' 0 C--O 1.238 0.48 0 O-C-N 119.674 -1.891 . . . . 10.0 109.948 -179.778 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -78.09 -82.76 0.6 Allowed Glycine 0 CA--C 1.505 -0.558 0 C-N-CA 121.14 -0.552 . . . . 10.0 114.143 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 46.2 81.85 0.04 OUTLIER 'General case' 0 N--CA 1.44 -0.956 0 CA-C-O 124.524 2.107 . . . . 10.0 114.398 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 179.23 174.57 45.46 Favored Glycine 0 C--O 1.219 -0.841 0 CA-C-N 112.686 -2.052 . . . . 10.0 111.191 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' TRP . . . . . 0.673 ' CE3' HD11 ' A' ' 117' ' ' LEU . 15.5 m0 -123.02 144.47 49.24 Favored 'General case' 0 C--O 1.217 -0.613 0 N-CA-C 108.077 -1.083 . . . . 10.0 108.077 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -131.1 133.34 45.55 Favored 'General case' 0 C--O 1.21 -0.979 0 N-CA-C 106.252 -1.759 . . . . 10.0 106.252 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.484 ' NE2' HD13 ' A' ' 115' ' ' LEU . 9.5 tp60 -141.97 112.79 7.32 Favored 'General case' 0 C--N 1.323 -0.569 0 O-C-N 125.706 1.879 . . . . 10.0 113.462 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -126.46 104.11 7.98 Favored 'General case' 0 C--O 1.212 -0.89 0 CA-C-O 122.929 1.347 . . . . 10.0 112.102 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 14.6 mt -55.21 109.29 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 112.968 -1.924 . . . . 10.0 112.614 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -96.46 -175.96 3.49 Favored 'General case' 0 C--N 1.333 -0.123 0 O-C-N 126.685 2.491 . . . . 10.0 106.865 -179.745 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -52.5 94.31 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.638 0 O-C-N 126.103 2.127 . . . . 10.0 111.378 179.786 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 44.86 33.42 0.99 Allowed 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 123.555 1.645 . . . . 10.0 111.669 -179.656 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -139.39 124.17 18.56 Favored 'General case' 0 C--O 1.241 0.613 0 N-CA-C 115.539 1.681 . . . . 10.0 115.539 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.484 HD13 ' NE2' ' A' ' 108' ' ' GLN . 0.5 OUTLIER -84.96 125.51 32.74 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 103.643 -2.725 . . . . 10.0 103.643 179.797 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -129.13 91.62 3.23 Favored 'General case' 0 N--CA 1.445 -0.689 0 O-C-N 121.784 -0.573 . . . . 10.0 110.239 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.673 HD11 ' CE3' ' A' ' 106' ' ' TRP . 1.1 tp -95.79 122.17 38.29 Favored 'General case' 0 N--CA 1.442 -0.857 0 O-C-N 124.988 1.43 . . . . 10.0 110.722 179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -122.23 108.0 12.79 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 117.999 -1.0 . . . . 10.0 109.085 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -98.32 136.51 38.39 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 118.571 0.623 . . . . 10.0 112.124 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -113.65 146.63 39.48 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 113.022 0.749 . . . . 10.0 113.022 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -162.44 113.54 1.56 Allowed 'General case' 0 C--N 1.32 -0.699 0 O-C-N 125.527 1.767 . . . . 10.0 109.639 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 52.72 46.7 26.23 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 117.279 -1.343 . . . . 10.0 112.899 179.804 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 74.13 14.49 80.45 Favored Glycine 0 N--CA 1.469 0.888 0 O-C-N 125.72 1.888 . . . . 10.0 117.205 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 97.3 t -116.31 112.98 41.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 N-CA-C 106.974 -1.491 . . . . 10.0 106.974 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 37.0 m -90.97 87.65 6.7 Favored 'General case' 0 N--CA 1.444 -0.736 0 O-C-N 125.169 1.543 . . . . 10.0 114.508 179.811 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 8.6 t -76.31 136.28 39.58 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 105.148 -2.168 . . . . 10.0 105.148 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -127.46 157.46 40.0 Favored 'General case' 0 N--CA 1.474 0.773 0 O-C-N 125.284 1.615 . . . . 10.0 112.055 -179.61 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -140.38 97.1 3.15 Favored 'General case' 0 CA--C 1.503 -0.846 0 CA-C-O 122.478 1.132 . . . . 10.0 110.044 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.462 ' CG1' HD22 ' A' ' 11' ' ' LEU . 40.7 t -72.93 129.09 36.11 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 O-C-N 120.62 -1.3 . . . . 10.0 107.92 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 130' ' ' PHE . . . . . 0.441 ' CZ ' ' HB2' ' A' ' 40' ' ' LYS . 0.6 OUTLIER -128.21 160.13 33.05 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 113.614 -1.63 . . . . 10.0 110.218 179.776 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.448 ' CG ' HD11 ' A' ' 11' ' ' LEU . 4.4 mmtt -132.54 127.78 35.87 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 105.817 -1.92 . . . . 10.0 105.817 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 12.7 tttt -90.7 102.84 15.59 Favored 'General case' 0 C--O 1.219 -0.536 0 O-C-N 125.178 1.549 . . . . 10.0 108.904 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' VAL . . . . . 0.43 ' H ' HG23 ' A' ' 133' ' ' VAL . 16.5 t -41.83 -55.17 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 127.491 2.994 . . . . 10.0 114.257 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.445 -0.699 0 O-C-N 125.508 1.755 . . . . 10.0 111.463 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 99.9 Cg_exo . . . . . 0 C--O 1.239 0.54 0 CA-C-O 118.052 -0.895 . . . . 10.0 111.23 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.431 ' O ' HG13 ' A' ' 2' ' ' VAL . 4.7 p -86.0 124.11 40.01 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.784 0 CA-C-O 117.904 -1.046 . . . . 10.0 111.532 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -131.28 114.72 15.37 Favored 'General case' 0 C--O 1.241 0.615 0 O-C-N 124.776 1.297 . . . . 10.0 108.936 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.541 ' CD1' ' CD1' ' A' ' 110' ' ' ILE . 20.8 m-30 -59.0 -14.85 10.52 Favored 'General case' 0 C--O 1.22 -0.486 0 N-CA-C 112.828 0.677 . . . . 10.0 112.828 -179.751 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -59.49 124.9 21.55 Favored 'General case' 0 C--O 1.244 0.765 0 N-CA-C 114.347 1.24 . . . . 10.0 114.347 -179.704 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -155.91 -105.39 0.23 Allowed Glycine 0 CA--C 1.532 1.106 0 C-N-CA 118.447 -1.835 . . . . 10.0 116.198 -179.737 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -166.11 166.38 17.14 Favored 'General case' 0 C--O 1.241 0.619 0 N-CA-C 102.445 -3.169 . . . . 10.0 102.445 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.529 ' CZ3' ' HB2' ' A' ' 41' ' ' GLU 0.302 18.1 p90 -144.3 -173.71 4.1 Favored 'General case' 0 C--N 1.314 -0.942 0 C-N-CA 126.591 1.957 . . . . 10.0 113.458 179.964 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.59 ' HD2' HG22 ' A' ' 133' ' ' VAL . 0.0 OUTLIER 162.5 72.71 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.575 0 O-C-N 127.428 2.955 . . . . 10.0 106.271 177.757 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.414 ' CE ' ' HB2' ' A' ' 37' ' ' LYS . 0.0 OUTLIER 0.51 -58.46 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.924 0 O-C-N 127.697 3.123 . . . . 10.0 117.57 -179.459 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.449 ' N ' ' O ' ' A' ' 9' ' ' LYS . 0.2 OUTLIER 81.71 -58.17 0.24 Allowed 'General case' 0 C--O 1.246 0.92 0 C-N-CA 127.421 2.288 . . . . 10.0 107.671 179.83 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -163.71 159.3 21.34 Favored 'General case' 0 C--N 1.323 -0.574 0 O-C-N 125.178 1.549 . . . . 10.0 114.114 179.844 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 4.6 p-10 -157.57 164.16 37.59 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 112.429 -2.169 . . . . 10.0 108.291 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -144.31 -178.92 6.21 Favored 'General case' 0 C--O 1.219 -0.515 0 O-C-N 125.623 1.827 . . . . 10.0 111.88 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 28.09 44.13 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.555 0 O-C-N 126.458 2.349 . . . . 10.0 114.119 179.879 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -72.13 -45.79 59.16 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-O 117.88 -1.057 . . . . 10.0 110.608 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -78.4 -22.51 47.69 Favored 'General case' 0 C--O 1.218 -0.567 0 CA-C-O 123.488 1.613 . . . . 10.0 110.358 179.82 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -76.55 -27.06 55.77 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 123.499 1.619 . . . . 10.0 107.11 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -77.25 -33.65 55.98 Favored 'General case' 0 CA--C 1.55 0.947 0 CA-C-N 113.475 -1.693 . . . . 10.0 110.49 -179.856 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 83.5 mt -70.55 -31.28 68.27 Favored 'General case' 0 C--O 1.215 -0.712 0 O-C-N 124.501 1.126 . . . . 10.0 110.561 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.56 -22.77 58.83 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 114.972 -1.013 . . . . 10.0 110.383 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.93 -31.34 67.92 Favored 'General case' 0 C--O 1.214 -0.807 0 CA-C-N 119.154 0.888 . . . . 10.0 112.287 179.793 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.8 mt -92.26 -21.36 20.37 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 124.658 1.224 . . . . 10.0 109.175 179.568 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 34.9 t0 76.98 49.36 0.05 Allowed 'General case' 0 C--O 1.244 0.788 0 N-CA-C 115.849 1.796 . . . . 10.0 115.849 -179.726 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 33.1 m -80.12 -179.2 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.815 0 O-C-N 118.716 -2.49 . . . . 10.0 108.406 179.816 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -60.54 155.48 18.48 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 119.093 -1.043 . . . . 10.0 111.769 179.583 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.6 m -75.91 -26.09 17.51 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.921 0 N-CA-C 116.834 2.161 . . . . 10.0 116.834 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -77.52 -25.26 50.09 Favored 'General case' 0 C--O 1.243 0.755 0 O-C-N 121.047 -1.033 . . . . 10.0 109.866 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.38 -31.14 65.33 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 114.625 -1.171 . . . . 10.0 111.757 -179.693 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.4 ttm180 -68.39 -33.3 74.0 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 125.791 1.636 . . . . 10.0 110.223 179.667 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -74.39 -40.29 62.15 Favored 'General case' 0 CA--C 1.508 -0.65 0 CA-C-N 113.168 -1.833 . . . . 10.0 111.535 -179.746 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.468 HG21 ' CE1' ' A' ' 57' ' ' PHE . 0.4 OUTLIER -73.58 -52.57 20.74 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 CA-C-O 122.471 1.129 . . . . 10.0 112.975 179.968 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -56.06 -21.8 23.96 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 112.511 -2.131 . . . . 10.0 112.659 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -66.87 -47.67 71.16 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-O 118.231 -0.89 . . . . 10.0 112.656 -179.742 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.422 ' O ' HD12 ' A' ' 35' ' ' LEU . 1.2 pp -73.01 -2.53 21.48 Favored 'General case' 0 CA--C 1.517 -0.303 0 O-C-N 125.091 1.494 . . . . 10.0 114.088 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -103.66 156.04 18.1 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 122.928 1.347 . . . . 10.0 112.748 179.504 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.414 ' HB2' ' CE ' ' A' ' 10' ' ' MET . 17.4 mttt -140.32 126.94 12.08 Favored Pre-proline 0 N--CA 1.466 0.347 0 N-CA-C 105.689 -1.967 . . . . 10.0 105.689 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_exo -86.27 153.14 9.4 Favored 'Trans proline' 0 CA--C 1.538 0.715 0 C-N-CA 124.836 3.69 . . . . 10.0 116.632 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.48 ' HB2' ' NE1' ' A' ' 8' ' ' TRP . 0.5 OUTLIER -114.63 166.74 11.41 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 125.571 1.548 . . . . 10.0 106.974 179.872 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.4 ttmt -161.36 104.93 1.27 Allowed 'General case' 0 CA--C 1.496 -1.103 0 C-N-CA 116.697 -2.001 . . . . 10.0 112.148 -179.643 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.529 ' HB2' ' CZ3' ' A' ' 8' ' ' TRP . 27.6 tt0 -94.79 135.64 36.04 Favored 'General case' 0 C--O 1.24 0.556 0 N-CA-C 102.41 -3.182 . . . . 10.0 102.41 179.881 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.435 HG23 HD12 ' A' ' 51' ' ' ILE . 62.4 mt -120.62 150.78 23.42 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 CA-C-N 120.291 1.405 . . . . 10.0 109.319 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -141.84 127.19 17.87 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 N-CA-C 103.898 -2.63 . . . . 10.0 103.898 -179.882 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 -132.62 103.52 6.18 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 125.203 1.564 . . . . 10.0 110.953 -179.757 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -69.45 -63.05 1.14 Allowed 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 106.262 -1.755 . . . . 10.0 106.262 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -163.67 -78.75 0.03 OUTLIER Glycine 0 CA--C 1.532 1.108 0 N-CA-C 109.614 -1.394 . . . . 10.0 109.614 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -107.24 53.71 0.69 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 123.351 1.548 . . . . 10.0 109.089 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -163.43 168.52 20.16 Favored 'General case' 0 C--O 1.215 -0.733 0 N-CA-C 105.041 -2.207 . . . . 10.0 105.041 -179.846 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.481 ' HE1' HD21 ' A' ' 93' ' ' LEU . 6.6 ttp -163.41 102.54 0.95 Allowed 'General case' 0 C--O 1.216 -0.659 0 O-C-N 126.112 2.132 . . . . 10.0 112.317 179.66 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.592 HD12 ' N ' ' A' ' 50' ' ' ILE . 2.3 mp -93.98 100.6 11.43 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.759 0 O-C-N 124.483 1.115 . . . . 10.0 108.177 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.466 ' N ' HD13 ' A' ' 51' ' ' ILE . 0.4 OUTLIER -95.59 114.82 33.12 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.805 0 CA-C-O 123.722 1.725 . . . . 10.0 106.745 -179.897 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -115.03 125.97 54.19 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 112.926 -1.943 . . . . 10.0 111.843 179.817 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 26.7 m -112.32 121.71 45.66 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 100.908 -3.738 . . . . 10.0 100.908 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.9 mt -94.64 12.82 26.3 Favored 'General case' 0 CA--C 1.513 -0.467 0 N-CA-C 121.597 3.925 . . . . 10.0 121.597 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.2 p -68.19 129.08 38.86 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 103.908 -2.627 . . . . 10.0 103.908 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -83.32 156.53 23.0 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 107.869 -1.16 . . . . 10.0 107.869 -179.906 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.468 ' CE1' HG21 ' A' ' 32' ' ' ILE . 3.9 t80 83.75 10.77 0.46 Allowed 'General case' 0 C--N 1.324 -0.506 0 O-C-N 126.468 2.355 . . . . 10.0 105.308 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.759 ' HG2' HD11 ' A' ' 77' ' ' ILE . 5.7 mtp85 -151.45 -69.01 0.17 Allowed 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 126.066 1.747 . . . . 10.0 111.235 -179.795 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 24.49 88.91 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.775 0 O-C-N 128.441 3.588 . . . . 10.0 112.139 179.66 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 46.3 p90 -121.78 148.85 44.14 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 106.86 -1.533 . . . . 10.0 106.86 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.417 HG22 ' N ' ' A' ' 62' ' ' MET . 3.2 mp -133.27 158.87 43.14 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.869 0 N-CA-C 112.475 0.546 . . . . 10.0 112.475 180.0 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.417 ' N ' HG22 ' A' ' 61' ' ' ILE . 0.7 OUTLIER -141.86 158.31 43.94 Favored 'General case' 0 C--O 1.215 -0.715 0 N-CA-C 107.031 -1.47 . . . . 10.0 107.031 -179.672 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 29.9 t0 -125.63 77.73 1.68 Allowed 'General case' 0 N--CA 1.441 -0.876 0 N-CA-C 104.279 -2.489 . . . . 10.0 104.279 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 8.4 m-30 -76.8 177.03 7.95 Favored 'General case' 0 C--O 1.242 0.686 0 N-CA-C 115.898 1.814 . . . . 10.0 115.898 -179.726 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 56.5 mt-30 -151.61 123.65 8.14 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 125.038 1.461 . . . . 10.0 108.089 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 53.2 t -58.16 137.79 19.96 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 C-N-CA 125.848 1.659 . . . . 10.0 109.156 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 65.74 9.89 47.59 Favored Glycine 0 N--CA 1.439 -1.108 0 CA-C-O 118.418 -1.212 . . . . 10.0 114.506 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.06 165.58 12.49 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 120.714 2.257 . . . . 10.0 112.442 179.668 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -122.34 149.11 44.22 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 108.09 -1.078 . . . . 10.0 108.09 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -152.38 -170.66 3.7 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 122.98 1.371 . . . . 10.0 110.528 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -143.73 110.38 5.56 Favored 'General case' 0 C--N 1.319 -0.73 0 C-N-CA 119.139 -1.024 . . . . 10.0 110.468 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -95.8 72.77 3.07 Favored 'General case' 0 N--CA 1.441 -0.877 0 O-C-N 120.385 -1.447 . . . . 10.0 111.172 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.419 ' HA ' ' CB ' ' A' ' 81' ' ' LYS . 6.0 p-10 -44.59 137.33 3.86 Favored 'General case' 0 C--N 1.315 -0.929 0 O-C-N 128.945 3.903 . . . . 10.0 105.815 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.71 HD13 ' O ' ' A' ' 74' ' ' LEU . 0.8 OUTLIER 63.85 119.72 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 116.748 2.129 . . . . 10.0 116.748 -179.717 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.533 ' N ' HD22 ' A' ' 74' ' ' LEU . 1.7 m -104.6 102.42 12.03 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 106.794 -1.558 . . . . 10.0 106.794 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -57.9 101.35 0.18 Allowed Glycine 0 CA--C 1.531 1.054 0 CA-C-O 115.945 -2.586 . . . . 10.0 110.216 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.759 HD11 ' HG2' ' A' ' 58' ' ' ARG . 7.0 mt 134.32 -68.53 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.954 0 O-C-N 127.748 2.675 . . . . 10.0 109.81 179.522 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -103.41 8.29 38.03 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 112.908 0.707 . . . . 10.0 112.908 -179.526 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.404 ' N ' ' O ' ' A' ' 75' ' ' THR . 0.0 OUTLIER 44.02 -166.71 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 127.136 2.174 . . . . 10.0 116.472 -179.694 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.402 ' HG3' ' N ' ' A' ' 81' ' ' LYS . 0.0 OUTLIER 78.08 156.52 0.17 Allowed 'General case' 0 CA--C 1.505 -0.766 0 CA-C-O 122.35 1.072 . . . . 10.0 110.998 179.761 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.419 ' CB ' ' HA ' ' A' ' 73' ' ' ASP . 1.4 pttm -96.11 136.61 36.34 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 105.32 -2.104 . . . . 10.0 105.32 179.804 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -120.45 137.71 54.19 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 125.651 1.58 . . . . 10.0 107.481 179.701 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.3 mtp -100.95 91.48 4.6 Favored 'General case' 0 N--CA 1.441 -0.897 0 N-CA-C 102.926 -2.99 . . . . 10.0 102.926 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 68.7 m -91.83 129.13 37.85 Favored 'General case' 0 C--O 1.215 -0.761 0 N-CA-C 114.121 1.156 . . . . 10.0 114.121 179.843 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 40.9 m -127.2 118.02 23.48 Favored 'General case' 0 N--CA 1.44 -0.94 0 O-C-N 126.564 2.415 . . . . 10.0 104.594 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 22.9 m -91.42 -175.75 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 N-CA-C 104.084 -2.561 . . . . 10.0 104.084 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 172.2 132.76 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.86 0 O-C-N 124.256 0.973 . . . . 10.0 111.268 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' TRP . . . . . 0.627 ' CD1' ' HA ' ' A' ' 91' ' ' ASP . 0.7 OUTLIER -78.74 80.83 5.08 Favored 'General case' 0 C--O 1.22 -0.469 0 N-CA-C 105.209 -2.145 . . . . 10.0 105.209 179.873 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -95.22 105.47 17.41 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 103.986 -2.598 . . . . 10.0 103.986 179.777 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 67.13 31.62 78.13 Favored Glycine 0 CA--C 1.504 -0.608 0 N-CA-C 108.552 -1.819 . . . . 10.0 108.552 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.627 ' HA ' ' CD1' ' A' ' 88' ' ' TRP . 0.5 OUTLIER 73.81 -11.59 0.94 Allowed 'General case' 0 C--O 1.236 0.394 0 CA-C-N 119.694 1.747 . . . . 10.0 114.768 179.911 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.502 ' HD3' ' CZ3' ' A' ' 109' ' ' TRP . 11.0 pttm -90.45 151.76 21.25 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 106.797 -1.557 . . . . 10.0 106.797 -179.863 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.481 HD21 ' HE1' ' A' ' 49' ' ' MET . 0.2 OUTLIER -82.41 92.73 7.07 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 106.104 -1.813 . . . . 10.0 106.104 179.962 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -98.41 95.88 7.63 Favored 'General case' 0 C--O 1.214 -0.789 0 O-C-N 120.515 -1.366 . . . . 10.0 110.003 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 30.8 p -106.25 143.87 33.76 Favored 'General case' 0 CA--C 1.507 -0.693 0 CA-C-O 124.382 2.039 . . . . 10.0 114.102 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -123.02 138.91 51.44 Favored 'Isoleucine or valine' 0 C--O 1.245 0.827 0 N-CA-C 104.551 -2.389 . . . . 10.0 104.551 179.801 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -123.41 76.23 1.38 Allowed 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.33 1.019 . . . . 10.0 112.642 -179.802 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 3.5 mmmt -46.39 124.92 6.24 Favored 'General case' 0 CA--C 1.512 -0.492 0 N-CA-C 113.753 1.02 . . . . 10.0 113.753 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 172.34 62.48 0.04 OUTLIER Glycine 0 CA--C 1.501 -0.82 0 O-C-N 126.081 2.113 . . . . 10.0 112.337 179.903 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 75.88 -172.44 0.1 Allowed 'General case' 0 C--N 1.316 -0.864 0 O-C-N 126.433 1.902 . . . . 10.0 114.574 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 13.0 mmtt 65.34 -177.25 0.18 Allowed 'General case' 0 N--CA 1.442 -0.873 0 CA-C-O 123.689 1.709 . . . . 10.0 113.184 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -124.3 49.6 1.77 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 113.519 -1.673 . . . . 10.0 114.231 179.903 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 153.21 36.59 0.03 OUTLIER Glycine 0 C--O 1.218 -0.885 0 N-CA-C 118.814 2.285 . . . . 10.0 118.814 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 43.3 mtp180 -75.95 163.64 26.97 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 116.951 0.375 . . . . 10.0 110.11 179.592 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 119.29 144.54 7.38 Favored Glycine 0 N--CA 1.437 -1.27 0 C-N-CA 118.956 -1.592 . . . . 10.0 110.225 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 19.1 m0 -111.27 173.89 6.12 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-O 117.123 -1.418 . . . . 10.0 109.267 179.714 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 2.7 m -147.96 135.73 20.94 Favored 'General case' 0 C--O 1.209 -1.07 0 O-C-N 124.908 1.38 . . . . 10.0 108.384 179.853 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -120.56 131.25 54.57 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 125.758 1.911 . . . . 10.0 107.974 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' TRP . . . . . 0.502 ' CZ3' ' HD3' ' A' ' 92' ' ' LYS . 2.6 t-105 -146.37 124.87 12.4 Favored 'General case' 0 CA--C 1.5 -0.959 0 CA-C-O 122.453 1.121 . . . . 10.0 110.134 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.541 ' CD1' ' CD1' ' A' ' 4' ' ' PHE . 43.2 mt -99.16 124.6 52.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 116.281 1.956 . . . . 10.0 116.281 179.63 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -129.78 110.25 11.6 Favored 'General case' 0 CA--C 1.509 -0.611 0 O-C-N 126.318 2.261 . . . . 10.0 105.514 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 53.97 -104.4 0.23 Allowed Glycine 0 N--CA 1.459 0.227 0 N-CA-C 108.682 -1.767 . . . . 10.0 108.682 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -114.86 4.0 14.75 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 125.331 1.253 . . . . 10.0 110.683 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 73.5 tt0 -102.96 101.52 11.54 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 115.176 1.547 . . . . 10.0 115.176 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.648 HD12 ' C ' ' A' ' 115' ' ' LEU . 0.2 OUTLIER -67.48 107.65 2.54 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 103.574 -2.75 . . . . 10.0 103.574 179.764 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 116' ' ' HIS . . . . . 0.405 ' N ' HD12 ' A' ' 115' ' ' LEU . 0.3 OUTLIER -99.34 103.63 15.46 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 119.671 -1.893 . . . . 10.0 110.372 -179.902 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.856 HD21 ' CE ' ' A' ' 119' ' ' MET . 0.0 OUTLIER -103.73 143.06 33.3 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 124.228 1.966 . . . . 10.0 111.534 179.814 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -141.01 120.14 12.88 Favored 'General case' 0 CA--C 1.5 -0.98 0 O-C-N 120.507 -1.37 . . . . 10.0 108.758 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.856 ' CE ' HD21 ' A' ' 117' ' ' LEU . 3.5 mtm -95.53 -174.85 3.29 Favored 'General case' 0 N--CA 1.439 -1.007 0 N-CA-C 113.779 1.029 . . . . 10.0 113.779 179.974 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 9.2 tpt180 -167.84 129.8 1.51 Allowed 'General case' 0 N--CA 1.445 -0.695 0 O-C-N 124.238 0.961 . . . . 10.0 112.912 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' ALA . . . . . 0.614 ' O ' HG22 ' A' ' 124' ' ' VAL . . . -156.91 121.16 4.36 Favored 'General case' 0 CA--C 1.503 -0.832 0 CA-C-O 122.936 1.35 . . . . 10.0 110.037 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 59.99 14.52 4.39 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 124.022 1.868 . . . . 10.0 115.338 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 105.9 9.55 32.22 Favored Glycine 0 C--O 1.241 0.591 0 O-C-N 120.818 -1.176 . . . . 10.0 115.775 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.614 HG22 ' O ' ' A' ' 121' ' ' ALA . 20.1 m -101.69 164.32 3.05 Favored 'Isoleucine or valine' 0 C--O 1.239 0.539 0 CA-C-N 118.77 1.285 . . . . 10.0 110.061 179.776 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 1.3 m -131.41 108.67 9.78 Favored 'General case' 0 N--CA 1.447 -0.599 0 O-C-N 125.3 1.625 . . . . 10.0 114.558 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -111.47 137.45 49.26 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 104.753 -2.314 . . . . 10.0 104.753 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.88 166.98 23.15 Favored 'General case' 0 CA--C 1.509 -0.618 0 O-C-N 125.362 1.664 . . . . 10.0 114.913 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -139.99 163.76 31.83 Favored 'General case' 0 C--O 1.242 0.7 0 O-C-N 125.902 2.001 . . . . 10.0 108.665 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 6.9 m -125.98 66.95 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 N-CA-C 105.713 -1.958 . . . . 10.0 105.713 179.735 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 130' ' ' PHE . . . . . 0.528 ' HB3' ' HB3' ' A' ' 115' ' ' LEU . 0.1 OUTLIER -56.22 132.34 50.33 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 125.576 1.55 . . . . 10.0 109.309 -179.927 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 37.4 tptt -111.48 104.78 13.22 Favored 'General case' 0 C--O 1.242 0.68 0 N-CA-C 106.387 -1.708 . . . . 10.0 106.387 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 1.4 ttpt -73.72 97.62 2.74 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 105.467 -2.049 . . . . 10.0 105.467 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 133' ' ' VAL . . . . . 0.59 HG22 ' HD2' ' A' ' 9' ' ' LYS . 2.6 t -42.97 -31.9 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 124.546 1.154 . . . . 10.0 112.947 -179.865 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 10.1 t60 . . . . . 0 C--N 1.317 -0.837 0 O-C-N 127.372 2.92 . . . . 10.0 110.924 179.677 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo . . . . . 0 N--CA 1.482 0.848 0 CA-C-O 119.758 -0.184 . . . . 10.0 111.871 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 9.8 p -98.12 -30.37 3.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 O-C-N 126.617 2.448 . . . . 10.0 112.826 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.0 t0 71.67 147.87 0.08 Allowed 'General case' 0 C--N 1.328 -0.339 0 O-C-N 124.686 1.241 . . . . 10.0 111.268 179.723 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.524 ' HE2' HD13 ' A' ' 93' ' ' LEU . 2.2 m-85 -175.45 -49.38 0.01 OUTLIER 'General case' 0 C--O 1.244 0.776 0 N-CA-C 116.356 1.984 . . . . 10.0 116.356 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 35.0 t-20 -35.91 104.5 0.03 OUTLIER 'General case' 0 C--O 1.241 0.655 0 N-CA-C 115.659 1.726 . . . . 10.0 115.659 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -148.06 -137.04 2.83 Favored Glycine 0 C--O 1.217 -0.906 0 N-CA-C 117.61 1.804 . . . . 10.0 117.61 179.726 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 15.4 t80 -156.26 101.08 2.04 Favored 'General case' 0 C--O 1.242 0.691 0 N-CA-C 102.964 -2.976 . . . . 10.0 102.964 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.668 ' CE3' ' CE2' ' A' ' 130' ' ' PHE . 0.0 OUTLIER -90.59 121.93 32.95 Favored 'General case' 0 C--N 1.312 -1.04 0 N-CA-C 114.657 1.354 . . . . 10.0 114.657 -179.972 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.69 132.25 42.54 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 103.033 -2.951 . . . . 10.0 103.033 178.825 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.98 150.52 31.97 Favored 'General case' 0 C--N 1.312 -1.049 0 N-CA-C 116.386 1.995 . . . . 10.0 116.386 -179.419 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.9 tp -124.02 -59.21 1.51 Allowed 'General case' 0 CA--C 1.505 -0.778 0 CA-C-N 113.265 -1.789 . . . . 10.0 111.535 -179.765 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -131.73 172.38 12.34 Favored 'General case' 0 C--O 1.221 -0.413 0 N-CA-C 115.958 1.836 . . . . 10.0 115.958 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -161.57 135.32 6.62 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 111.375 -2.648 . . . . 10.0 109.037 179.814 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -107.05 -77.13 0.6 Allowed 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 115.818 1.784 . . . . 10.0 115.818 -179.828 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 36.1 m120 -96.4 58.51 1.77 Allowed 'General case' 0 C--N 1.32 -0.683 0 O-C-N 126.525 2.391 . . . . 10.0 111.389 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -70.06 -58.56 3.68 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 113.651 0.982 . . . . 10.0 113.651 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.614 ' HA ' HD12 ' A' ' 20' ' ' LEU . 64.3 mt-10 -67.86 -29.06 68.1 Favored 'General case' 0 C--O 1.243 0.719 0 C-N-CA 123.758 0.823 . . . . 10.0 112.74 -179.849 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -76.39 -23.33 54.08 Favored 'General case' 0 C--O 1.218 -0.561 0 C-N-CA 119.118 -1.033 . . . . 10.0 109.652 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -73.98 -41.91 61.24 Favored 'General case' 0 CA--C 1.557 1.235 0 C-N-CA 124.455 1.102 . . . . 10.0 109.146 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.614 HD12 ' HA ' ' A' ' 17' ' ' GLU . 1.8 mt -70.7 -28.27 64.62 Favored 'General case' 0 C--O 1.217 -0.645 0 O-C-N 126.35 2.281 . . . . 10.0 112.891 -179.839 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.8 ttm-85 -73.61 -29.3 62.28 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 113.464 -1.698 . . . . 10.0 108.517 -179.787 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.3 -29.89 67.85 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 120.625 -1.297 . . . . 10.0 113.678 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.4 HD21 ' HB1' ' A' ' 121' ' ' ALA . 20.4 mt -105.45 1.2 27.49 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 125.35 1.656 . . . . 10.0 114.529 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 43.64 82.83 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.01 0 O-C-N 126.158 2.161 . . . . 10.0 110.164 -179.757 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 15.5 m -113.79 46.02 0.31 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.54 0 CA-C-N 113.344 -1.753 . . . . 10.0 111.167 -179.714 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 65.44 138.47 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 114.676 1.361 . . . . 10.0 114.676 179.781 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 31.1 m -64.12 -31.26 52.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 117.181 2.289 . . . . 10.0 117.181 -179.708 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -73.64 -41.48 62.69 Favored 'General case' 0 C--O 1.245 0.85 0 CA-C-N 114.373 -1.285 . . . . 10.0 111.748 -179.9 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.406 HD11 HH12 ' A' ' 58' ' ' ARG . 0.5 OUTLIER -64.54 -34.73 78.92 Favored 'General case' 0 C--O 1.223 -0.333 0 C-N-CA 123.628 0.771 . . . . 10.0 112.646 -179.604 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.93 -33.41 51.73 Favored 'General case' 0 CA--C 1.542 0.636 0 O-C-N 125.074 1.484 . . . . 10.0 111.488 179.718 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 33.1 ttmt -77.67 -33.71 53.28 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 123.064 1.411 . . . . 10.0 108.502 179.347 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -78.28 -38.93 23.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 N-CA-C 108.446 -0.946 . . . . 10.0 108.446 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -73.15 -20.1 60.98 Favored 'General case' 0 C--N 1.317 -0.814 0 O-C-N 124.386 1.054 . . . . 10.0 110.314 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -77.35 -33.11 55.41 Favored 'General case' 0 C--N 1.32 -0.689 0 O-C-N 121.46 -0.775 . . . . 10.0 111.677 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 73.3 mt -95.0 31.79 1.8 Allowed 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 122.24 1.019 . . . . 10.0 108.611 179.55 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 10.3 tp -153.83 140.59 19.06 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.495 1.118 . . . . 10.0 109.35 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -122.02 119.43 28.8 Favored Pre-proline 0 N--CA 1.47 0.57 0 N-CA-C 105.348 -2.093 . . . . 10.0 105.348 179.823 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -76.43 111.49 3.27 Favored 'Trans proline' 0 N--CA 1.446 -1.313 1 C-N-CA 126.365 4.71 . . . . 10.0 118.925 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -83.41 122.01 27.93 Favored 'General case' 0 C--O 1.219 -0.518 0 N-CA-C 104.329 -2.471 . . . . 10.0 104.329 179.12 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.598 ' HE3' ' CH2' ' A' ' 8' ' ' TRP . 2.5 ttpt -104.62 131.84 51.56 Favored 'General case' 0 C--O 1.209 -1.067 0 CA-C-O 123.293 1.521 . . . . 10.0 112.905 -179.511 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -115.88 129.34 56.37 Favored 'General case' 0 C--O 1.239 0.522 0 N-CA-C 104.841 -2.281 . . . . 10.0 104.841 179.835 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.5 mt -102.76 144.62 13.42 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 C-N-CA 119.012 -1.075 . . . . 10.0 113.331 179.684 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 92.8 t -140.73 124.2 16.83 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.938 0 N-CA-C 104.427 -2.434 . . . . 10.0 104.427 179.849 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -111.04 154.19 24.56 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 108.718 -0.845 . . . . 10.0 108.718 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -131.75 53.71 1.98 Allowed 'General case' 0 C--O 1.236 0.359 0 CA-C-O 123.163 1.459 . . . . 10.0 107.352 179.834 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 77.03 -92.45 1.04 Allowed Glycine 0 C--N 1.339 0.708 0 N-CA-C 105.602 -2.999 . . . . 10.0 105.602 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -92.48 -49.2 6.25 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 108.138 -1.06 . . . . 10.0 108.138 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 43.4 m170 -60.52 141.73 56.18 Favored 'General case' 0 C--O 1.218 -0.581 0 CA-C-O 122.482 1.134 . . . . 10.0 108.556 179.755 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 33.1 ttp -135.1 141.95 46.15 Favored 'General case' 0 N--CA 1.437 -1.101 0 CA-C-N 113.635 -1.62 . . . . 10.0 111.493 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 3.2 mt -130.19 136.73 58.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 106.701 -1.592 . . . . 10.0 106.701 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.7 mm -119.93 105.36 17.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 122.998 1.38 . . . . 10.0 108.759 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.514 ' HB3' HD23 ' A' ' 54' ' ' LEU . 21.5 mtp85 -89.98 113.36 25.01 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 113.7 -1.591 . . . . 10.0 109.423 179.859 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.447 HG23 ' HE2' ' A' ' 40' ' ' LYS . 4.3 m -108.83 95.52 5.71 Favored 'General case' 0 C--O 1.239 0.543 0 N-CA-C 100.286 -3.968 . . . . 10.0 100.286 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.514 HD23 ' HB3' ' A' ' 52' ' ' ARG . 2.8 mm? -95.33 146.09 24.63 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 117.531 2.419 . . . . 10.0 117.531 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -159.19 174.49 14.77 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 113.008 -1.905 . . . . 10.0 106.898 179.817 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 19.9 p -95.47 -8.71 34.61 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 121.647 -0.658 . . . . 10.0 110.82 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 6.4 t80 -92.6 -50.33 5.66 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 124.996 1.319 . . . . 10.0 109.461 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.406 HH12 HD11 ' A' ' 29' ' ' LEU . 0.0 OUTLIER -162.89 -177.1 5.29 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 125.332 1.645 . . . . 10.0 111.052 179.714 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 51.8 p30 -138.68 156.83 47.08 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-O 124.276 1.989 . . . . 10.0 113.883 179.631 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -123.87 112.79 17.67 Favored 'General case' 0 C--O 1.211 -0.928 0 N-CA-C 104.904 -2.258 . . . . 10.0 104.904 179.827 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 19.9 mm -114.19 129.86 69.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 O-C-N 124.184 0.928 . . . . 10.0 110.65 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 3.0 mtt -130.19 156.3 44.82 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 107.134 -1.432 . . . . 10.0 107.134 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -141.43 75.13 1.48 Allowed 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 103.797 -2.668 . . . . 10.0 103.797 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.525 ' CD2' HG21 ' A' ' 86' ' ' VAL . 2.6 m-30 -76.66 162.87 27.38 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 114.378 1.251 . . . . 10.0 114.378 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -131.32 107.1 8.72 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 113.322 -1.763 . . . . 10.0 108.34 -179.804 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -64.29 135.19 28.31 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 N-CA-C 108.255 -1.017 . . . . 10.0 108.255 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 56.39 36.25 69.08 Favored Glycine 0 N--CA 1.437 -1.257 0 O-C-N 126.016 2.073 . . . . 10.0 117.254 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -156.42 139.23 15.21 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 115.256 1.576 . . . . 10.0 115.256 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -52.7 138.83 27.88 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-O 119.16 -0.448 . . . . 10.0 111.786 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -140.75 96.22 2.98 Favored 'General case' 0 C--O 1.243 0.753 0 CA-C-O 123.209 1.48 . . . . 10.0 113.02 179.831 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -74.86 137.82 42.06 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 105.003 -2.221 . . . . 10.0 105.003 -179.861 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -138.58 130.53 28.16 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 124.228 1.011 . . . . 10.0 113.288 -179.854 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 20.9 p-10 -104.6 118.42 36.53 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-O 125.233 2.444 . . . . 10.0 111.684 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -124.66 126.62 46.04 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 116.658 2.096 . . . . 10.0 116.658 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -144.04 104.68 4.17 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 107.955 -1.128 . . . . 10.0 107.955 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 140.66 -80.42 0.26 Allowed Glycine 0 N--CA 1.442 -0.951 0 C-N-CA 119.766 -1.207 . . . . 10.0 111.047 -179.887 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -84.74 96.18 4.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 N-CA-C 106.302 -1.74 . . . . 10.0 106.302 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.48 -19.33 0.4 Allowed 'General case' 0 C--O 1.243 0.741 0 N-CA-C 115.16 1.541 . . . . 10.0 115.16 -179.919 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.0 p30 49.75 -164.25 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 125.756 1.622 . . . . 10.0 114.733 -179.802 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 8.6 ttm-85 83.82 143.74 0.07 Allowed 'General case' 0 C--N 1.32 -0.7 0 O-C-N 125.303 1.627 . . . . 10.0 110.906 179.775 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 5.5 pttt -93.98 165.34 12.7 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 102.412 -3.181 . . . . 10.0 102.412 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -155.1 144.42 21.12 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 120.89 -1.131 . . . . 10.0 108.695 179.848 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 31.2 mtt -114.34 52.05 0.85 Allowed 'General case' 0 N--CA 1.439 -1.001 0 N-CA-C 102.865 -3.013 . . . . 10.0 102.865 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 50.2 m -52.23 126.09 17.84 Favored 'General case' 0 N--CA 1.442 -0.862 0 N-CA-C 117.44 2.385 . . . . 10.0 117.44 -179.88 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 9.3 m -125.46 112.74 16.61 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 103.668 -2.716 . . . . 10.0 103.668 179.762 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.525 HG21 ' CD2' ' A' ' 64' ' ' PHE . 31.6 t -85.06 159.55 3.34 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.594 0 N-CA-C 101.095 -3.669 . . . . 10.0 101.095 -179.805 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -156.0 165.75 35.53 Favored 'General case' 0 C--N 1.318 -0.789 0 O-C-N 125.022 1.451 . . . . 10.0 113.296 179.857 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' TRP . . . . . 0.465 ' CD1' ' C ' ' A' ' 88' ' ' TRP . 0.0 OUTLIER -115.41 125.37 53.06 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 105.308 -2.108 . . . . 10.0 105.308 179.922 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -142.77 103.75 4.25 Favored 'General case' 0 CA--C 1.506 -0.726 0 N-CA-C 101.559 -3.497 . . . . 10.0 101.559 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 74.63 -146.94 36.27 Favored Glycine 0 CA--C 1.501 -0.796 0 N-CA-C 109.271 -1.531 . . . . 10.0 109.271 179.821 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -97.32 20.32 11.73 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-O 122.446 1.117 . . . . 10.0 109.681 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 6.6 mtmm -104.58 -174.67 2.59 Favored 'General case' 0 CA--C 1.508 -0.647 0 O-C-N 120.741 -1.225 . . . . 10.0 109.633 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.524 HD13 ' HE2' ' A' ' 4' ' ' PHE . 8.1 tp -131.36 128.6 39.99 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 103.125 -2.917 . . . . 10.0 103.125 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 6.6 mp0 -128.07 125.66 39.71 Favored 'General case' 0 C--N 1.316 -0.873 0 O-C-N 124.941 1.401 . . . . 10.0 112.515 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -124.7 125.62 44.38 Favored 'General case' 0 C--N 1.321 -0.667 0 O-C-N 121.9 -0.5 . . . . 10.0 109.845 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 71.1 t -120.8 142.95 34.57 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 N-CA-C 107.326 -1.361 . . . . 10.0 107.326 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 11.2 mt-30 -126.47 146.31 50.15 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 117.702 -1.142 . . . . 10.0 110.983 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 25.6 mmtt -86.24 -96.95 0.08 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 117.426 -1.273 . . . . 10.0 110.183 -179.839 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 51.4 -166.52 0.75 Allowed Glycine 0 CA--C 1.503 -0.674 0 O-C-N 124.126 0.891 . . . . 10.0 111.307 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -82.13 -170.11 2.73 Favored 'General case' 0 N--CA 1.447 -0.603 0 N-CA-C 112.788 0.662 . . . . 10.0 112.788 179.747 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 4.3 mttm 71.18 -158.75 0.13 Allowed 'General case' 0 N--CA 1.442 -0.867 0 CA-C-O 122.878 1.323 . . . . 10.0 113.178 179.78 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -146.75 18.2 1.29 Allowed 'General case' 0 CA--C 1.506 -0.736 0 O-C-N 119.861 -1.775 . . . . 10.0 115.272 -179.845 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -156.55 27.12 0.53 Allowed Glycine 0 C--O 1.226 -0.386 0 N-CA-C 118.226 2.05 . . . . 10.0 118.226 -179.571 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 8.6 mtm180 -86.07 117.78 25.12 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 121.492 -1.005 . . . . 10.0 109.641 179.621 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 163.24 151.58 6.48 Favored Glycine 0 N--CA 1.437 -1.242 0 O-C-N 125.66 1.85 . . . . 10.0 110.57 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 1.8 m0 -114.1 161.27 17.97 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 108.035 -1.098 . . . . 10.0 108.035 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.9 m -142.31 131.23 23.0 Favored 'General case' 0 C--O 1.212 -0.92 0 O-C-N 124.628 1.205 . . . . 10.0 110.984 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.463 ' NE2' HD21 ' A' ' 115' ' ' LEU . 3.0 mt-30 -119.3 131.57 55.77 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.602 1.161 . . . . 10.0 109.603 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 109' ' ' TRP . . . . . 0.492 ' CD1' ' C ' ' A' ' 109' ' ' TRP . 0.0 OUTLIER -137.47 113.71 10.04 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 106.871 -1.529 . . . . 10.0 106.871 179.977 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -86.27 146.41 6.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 N-CA-C 116.38 1.992 . . . . 10.0 116.38 179.76 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -149.94 127.49 11.57 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-O 116.072 -1.918 . . . . 10.0 107.575 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 46.61 -129.23 11.37 Favored Glycine 0 CA--C 1.534 1.233 0 N-CA-C 106.24 -2.744 . . . . 10.0 106.24 179.857 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -95.51 29.11 2.68 Favored 'General case' 0 C--N 1.321 -0.659 0 O-C-N 124.829 0.958 . . . . 10.0 113.304 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -140.71 151.8 44.8 Favored 'General case' 0 C--O 1.24 0.595 0 CA-C-N 119.801 1.182 . . . . 10.0 111.634 179.855 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.655 ' HG ' ' CE2' ' A' ' 130' ' ' PHE . 0.7 OUTLIER -108.99 130.8 55.48 Favored 'General case' 0 C--N 1.316 -0.869 0 O-C-N 125.949 2.03 . . . . 10.0 108.992 179.882 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 116' ' ' HIS . . . . . 0.644 ' N ' HD12 ' A' ' 115' ' ' LEU . 13.0 m80 -111.59 98.77 7.67 Favored 'General case' 0 CA--C 1.503 -0.83 0 N-CA-C 108.369 -0.974 . . . . 10.0 108.369 -179.809 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 15.7 tp -80.49 121.9 26.34 Favored 'General case' 0 CA--C 1.51 -0.567 0 C-N-CA 118.141 -1.424 . . . . 10.0 113.606 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -113.34 88.13 2.76 Favored 'General case' 0 C--O 1.214 -0.79 0 N-CA-C 104.239 -2.504 . . . . 10.0 104.239 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.47 149.96 26.31 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-N 114.387 -1.278 . . . . 10.0 111.447 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 24.4 mtt180 -144.56 137.52 26.84 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 120.466 1.485 . . . . 10.0 114.237 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' ALA . . . . . 0.4 ' HB1' HD21 ' A' ' 23' ' ' LEU . . . -150.18 133.61 16.49 Favored 'General case' 0 CA--C 1.507 -0.701 0 N-CA-C 107.073 -1.454 . . . . 10.0 107.073 -179.84 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 40.74 44.73 1.93 Allowed 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 116.943 2.201 . . . . 10.0 116.943 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 91.95 -11.96 70.76 Favored Glycine 0 CA--C 1.533 1.201 0 O-C-N 120.711 -1.243 . . . . 10.0 115.935 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 92.7 t -90.28 154.74 3.13 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 N-CA-C 107.385 -1.339 . . . . 10.0 107.385 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 34.5 m -144.57 92.35 2.29 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-O 124.728 2.204 . . . . 10.0 111.062 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -79.93 144.18 33.58 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-N 112.847 -1.978 . . . . 10.0 106.615 -179.839 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.18 101.01 5.4 Favored 'General case' 0 CA--C 1.504 -0.818 0 O-C-N 125.127 1.517 . . . . 10.0 110.948 -179.806 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.79 156.47 18.02 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 122.715 1.245 . . . . 10.0 108.625 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 11.0 p -143.73 137.29 24.67 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-O 117.296 -1.335 . . . . 10.0 107.756 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 130' ' ' PHE . . . . . 0.668 ' CE2' ' CE3' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -138.61 -169.98 2.73 Favored 'General case' 0 C--N 1.315 -0.894 0 O-C-N 125.138 1.524 . . . . 10.0 108.751 -179.858 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . 0.287 16.3 tptp -142.97 129.43 20.08 Favored 'General case' 0 C--N 1.32 -0.714 0 O-C-N 119.362 -2.086 . . . . 10.0 105.962 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 11.5 mtpt -81.47 110.55 16.98 Favored 'General case' 0 CA--C 1.503 -0.84 0 CA-C-O 123.464 1.602 . . . . 10.0 111.856 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 2.5 t -92.53 -0.45 10.02 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 114.773 -1.103 . . . . 10.0 109.091 179.679 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 12.1 m80 . . . . . 0 N--CA 1.434 -1.271 0 CA-C-N 113.938 -1.483 . . . . 10.0 111.572 179.79 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.564 ' C ' HG23 ' A' ' 2' ' ' VAL . 10.3 Cg_endo . . . . . 0 N--CA 1.48 0.726 0 N-CA-C 115.044 1.132 . . . . 10.0 115.044 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.637 HG22 ' HA ' ' A' ' 91' ' ' ASP . 1.8 t 72.18 104.31 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.244 0.775 0 O-C-N 125.864 1.978 . . . . 10.0 109.0 179.966 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -150.55 81.03 1.35 Allowed 'General case' 0 CA--C 1.54 0.587 0 O-C-N 125.218 1.574 . . . . 10.0 108.934 179.671 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -70.73 -33.71 71.12 Favored 'General case' 0 C--O 1.224 -0.26 0 C-N-CA 125.653 1.581 . . . . 10.0 112.363 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 30.1 t-20 -46.38 94.49 0.01 OUTLIER 'General case' 0 C--O 1.243 0.711 0 O-C-N 124.613 1.196 . . . . 10.0 111.305 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -148.96 -114.23 0.73 Allowed Glycine 0 N--CA 1.443 -0.859 0 N-CA-C 119.2 2.44 . . . . 10.0 119.2 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -155.64 -166.37 2.21 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 104.912 -2.255 . . . . 10.0 104.912 -179.792 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.464 ' NE1' ' CB ' ' A' ' 39' ' ' ASP 0.359 41.9 p90 -157.93 -170.44 3.16 Favored 'General case' 0 C--N 1.311 -1.077 0 C-N-CA 125.228 1.411 . . . . 10.0 113.966 -178.104 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.501 ' HE3' ' CG1' ' A' ' 133' ' ' VAL . 5.7 ttmt 166.19 98.95 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 111.733 -2.485 . . . . 10.0 109.07 176.676 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.49 ' HA ' ' CD1' ' A' ' 130' ' ' PHE . 0.0 OUTLIER -53.85 137.49 38.43 Favored 'General case' 0 N--CA 1.442 -0.836 0 N-CA-C 115.72 1.748 . . . . 10.0 115.72 -179.746 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -108.65 -55.53 2.38 Favored 'General case' 0 C--O 1.246 0.878 0 N-CA-C 108.394 -0.965 . . . . 10.0 108.394 -179.77 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -169.24 145.62 3.39 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 123.646 1.688 . . . . 10.0 115.337 -179.985 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -119.17 157.31 28.2 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 111.407 -2.633 . . . . 10.0 104.094 179.735 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -152.58 170.86 19.16 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 117.353 -1.308 . . . . 10.0 111.711 179.867 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 47.87 38.19 8.58 Favored 'General case' 0 C--O 1.243 0.738 0 O-C-N 125.063 1.477 . . . . 10.0 111.699 -179.855 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -76.0 -33.67 59.7 Favored 'General case' 0 C--N 1.34 0.178 0 CA-C-N 114.342 -1.299 . . . . 10.0 114.328 -179.546 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -77.08 -34.88 56.93 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 122.344 1.069 . . . . 10.0 112.557 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -76.89 -25.37 52.96 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 113.754 -1.566 . . . . 10.0 109.124 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.408 ' HA ' HG11 ' A' ' 124' ' ' VAL . 2.6 t80 -65.91 -44.29 85.63 Favored 'General case' 0 CA--C 1.55 0.948 0 O-C-N 126.122 2.139 . . . . 10.0 110.01 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.803 HD12 ' HG2' ' A' ' 30' ' ' ARG . 19.6 mt -76.37 -23.58 54.14 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 119.578 1.081 . . . . 10.0 112.825 -179.982 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.43 -25.56 67.58 Favored 'General case' 0 C--O 1.244 0.807 0 O-C-N 125.479 1.737 . . . . 10.0 109.001 -179.752 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.7 -45.06 72.62 Favored 'General case' 0 N--CA 1.466 0.341 0 O-C-N 124.829 1.331 . . . . 10.0 111.47 -179.598 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.9 mt -85.07 -15.85 42.62 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 120.018 -1.676 . . . . 10.0 112.115 -179.669 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 19.3 t0 65.79 70.93 0.43 Allowed 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 114.642 1.349 . . . . 10.0 114.642 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.628 HG21 HD23 ' A' ' 29' ' ' LEU . 0.9 OUTLIER -103.65 167.34 2.64 Favored 'Isoleucine or valine' 0 C--N 1.344 0.367 0 N-CA-C 108.996 -0.742 . . . . 10.0 108.996 -179.825 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -51.57 160.02 0.68 Allowed 'General case' 0 C--O 1.244 0.77 0 O-C-N 125.148 1.53 . . . . 10.0 114.331 -179.959 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 39.3 t -76.18 -25.54 16.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 115.038 1.495 . . . . 10.0 115.038 -179.762 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -74.81 -33.62 62.24 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 114.482 -1.235 . . . . 10.0 112.629 179.746 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.628 HD23 HG21 ' A' ' 25' ' ' VAL . 13.1 tp -68.75 -26.25 65.14 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 122.003 0.906 . . . . 10.0 112.737 179.782 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.803 ' HG2' HD12 ' A' ' 20' ' ' LEU . 0.0 OUTLIER -77.54 -22.21 51.43 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 113.395 -1.729 . . . . 10.0 113.682 179.869 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.9 tptm -73.13 -46.72 49.49 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 124.621 1.168 . . . . 10.0 110.195 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.449 HG21 ' CE2' ' A' ' 57' ' ' PHE . 5.8 mm -61.69 -57.29 12.77 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 O-C-N 125.531 1.769 . . . . 10.0 111.498 -179.9 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -48.87 -66.23 0.43 Allowed 'General case' 0 C--N 1.319 -0.725 0 O-C-N 126.524 2.39 . . . . 10.0 113.255 179.808 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -59.74 83.3 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.453 0 O-C-N 119.481 -2.012 . . . . 10.0 115.194 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.511 HD12 HD23 ' A' ' 36' ' ' LEU . 0.8 OUTLIER 159.69 -29.87 0.0 OUTLIER 'General case' 0 N--CA 1.445 -0.696 0 O-C-N 125.407 1.692 . . . . 10.0 109.61 179.95 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.511 HD23 HD12 ' A' ' 35' ' ' LEU . 35.0 mt -79.39 145.21 33.5 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 119.581 -0.848 . . . . 10.0 112.964 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.2 mttt -129.89 103.11 17.36 Favored Pre-proline 0 N--CA 1.466 0.346 0 N-CA-C 107.129 -1.434 . . . . 10.0 107.129 -179.836 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 0.2 OUTLIER -82.66 155.5 15.85 Favored 'Trans proline' 0 N--CA 1.448 -1.198 1 C-N-CA 126.599 4.866 . . . . 10.0 117.384 179.999 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.464 ' CB ' ' NE1' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -107.86 159.4 16.55 Favored 'General case' 0 C--N 1.313 -0.984 0 O-C-N 128.661 3.725 . . . . 10.0 106.538 179.752 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.418 ' HG3' ' CZ ' ' A' ' 130' ' ' PHE . 2.4 mtpm? -144.82 109.98 5.15 Favored 'General case' 0 N--CA 1.435 -1.197 0 C-N-CA 117.837 -1.545 . . . . 10.0 113.54 -179.543 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.429 ' OE1' HG23 ' A' ' 43' ' ' VAL . 1.0 OUTLIER -96.19 146.71 24.46 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 102.602 -3.11 . . . . 10.0 102.602 179.086 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 13.0 mt -132.26 139.44 50.11 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 O-C-N 124.902 1.376 . . . . 10.0 111.007 179.82 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.429 HG23 ' OE1' ' A' ' 41' ' ' GLU . 49.5 t -132.18 114.04 22.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 113.03 -1.896 . . . . 10.0 106.248 179.742 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.448 ' HG2' ' CG ' ' A' ' 49' ' ' MET . 0.0 OUTLIER -115.86 135.17 54.25 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 108.043 -1.095 . . . . 10.0 108.043 179.603 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -142.52 101.29 3.85 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 107.148 -1.426 . . . . 10.0 107.148 -179.756 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 61.14 -121.33 26.09 Favored Glycine 0 C--O 1.243 0.717 0 CA-C-O 123.154 1.419 . . . . 10.0 110.228 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -103.01 37.49 1.95 Allowed 'General case' 0 N--CA 1.472 0.668 0 O-C-N 121.907 -0.761 . . . . 10.0 109.259 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 20.5 m80 -147.39 129.35 15.38 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 106.955 -1.498 . . . . 10.0 106.955 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.561 ' HE1' HD11 ' A' ' 93' ' ' LEU . 2.6 ttm -133.89 158.11 44.27 Favored 'General case' 0 C--O 1.215 -0.728 0 N-CA-C 114.279 1.215 . . . . 10.0 114.279 179.802 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.401 ' N ' ' HG2' ' A' ' 49' ' ' MET . 35.1 mt -134.19 136.48 53.25 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.98 0 N-CA-C 105.191 -2.152 . . . . 10.0 105.191 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.2 mp -122.18 143.86 33.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 N-CA-C 104.528 -2.397 . . . . 10.0 104.528 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 5.1 mtt180 -133.37 109.96 9.71 Favored 'General case' 0 C--O 1.212 -0.913 0 O-C-N 125.79 1.932 . . . . 10.0 115.295 -179.934 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.9 m -90.23 125.14 35.38 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 100.554 -3.869 . . . . 10.0 100.554 -179.885 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -120.2 33.56 5.55 Favored 'General case' 0 C--N 1.319 -0.723 1 N-CA-C 122.555 4.28 . . . . 10.0 122.555 -179.631 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 43.0 t -69.45 177.86 2.7 Favored 'General case' 0 C--N 1.323 -0.572 0 O-C-N 120.143 -1.598 . . . . 10.0 107.046 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.5 m -108.61 64.36 0.61 Allowed 'General case' 0 C--N 1.328 -0.356 0 O-C-N 125.819 1.949 . . . . 10.0 112.05 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.449 ' CE2' HG21 ' A' ' 32' ' ' ILE . 0.8 OUTLIER -173.47 -62.23 0.02 OUTLIER 'General case' 0 C--N 1.347 0.475 0 CA-C-N 113.758 -1.565 . . . . 10.0 107.504 -179.891 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 5.6 mtp180 -118.81 110.4 17.17 Favored 'General case' 0 C--N 1.328 -0.345 0 O-C-N 124.569 1.168 . . . . 10.0 112.412 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -114.71 91.44 3.62 Favored 'General case' 0 C--N 1.327 -0.381 0 O-C-N 124.807 1.317 . . . . 10.0 112.258 -179.912 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.563 ' C ' HD12 ' A' ' 61' ' ' ILE . 54.4 p90 -110.82 134.22 52.7 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 103.07 -2.937 . . . . 10.0 103.07 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.563 HD12 ' C ' ' A' ' 60' ' ' TYR . 1.4 mp -112.11 158.18 12.63 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.362 0 O-C-N 123.98 0.8 . . . . 10.0 111.912 179.801 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 1.2 mmm -134.93 152.0 51.35 Favored 'General case' 0 C--N 1.322 -0.614 0 O-C-N 125.056 1.472 . . . . 10.0 107.517 179.774 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -134.38 90.44 2.67 Favored 'General case' 0 C--N 1.309 -1.156 0 N-CA-C 102.182 -3.266 . . . . 10.0 102.182 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -81.88 171.06 14.92 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 117.106 2.262 . . . . 10.0 117.106 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.98 93.09 2.21 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 103.812 -2.662 . . . . 10.0 103.812 -179.78 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.437 ' CG1' ' HB2' ' A' ' 88' ' ' TRP . 22.6 t -49.47 145.53 1.22 Allowed 'Isoleucine or valine' 0 C--O 1.246 0.901 0 CA-C-N 114.439 -1.255 . . . . 10.0 109.407 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 69.78 -3.17 9.84 Favored Glycine 0 C--O 1.213 -1.205 0 N-CA-C 116.571 1.389 . . . . 10.0 116.571 179.718 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.5 tttt -109.9 146.94 34.3 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 119.212 1.506 . . . . 10.0 111.846 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.36 164.98 3.87 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 107.479 -1.304 . . . . 10.0 107.479 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -166.96 117.32 0.89 Allowed 'General case' 0 N--CA 1.439 -1.006 0 O-C-N 124.629 1.206 . . . . 10.0 113.473 -179.79 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -76.89 154.1 34.06 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 117.454 -1.698 . . . . 10.0 106.722 -179.824 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -140.92 72.37 1.39 Allowed 'General case' 0 C--O 1.22 -0.494 0 N-CA-C 115.537 1.68 . . . . 10.0 115.537 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -78.22 121.51 24.47 Favored 'General case' 0 N--CA 1.439 -0.977 0 N-CA-C 106.552 -1.647 . . . . 10.0 106.552 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 5.7 mt -110.96 67.79 0.65 Allowed 'General case' 0 C--N 1.318 -0.777 0 O-C-N 126.628 2.455 . . . . 10.0 114.692 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 1.4 p -88.44 66.39 8.26 Favored 'General case' 0 C--O 1.241 0.635 0 N-CA-C 105.527 -2.027 . . . . 10.0 105.527 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -156.25 -43.46 0.02 OUTLIER Glycine 0 C--O 1.241 0.583 0 C-N-CA 117.608 -2.234 . . . . 10.0 112.318 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 55.4 mt -113.5 -29.66 2.25 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.912 0 CA-C-N 119.257 1.529 . . . . 10.0 110.96 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -145.67 15.09 1.41 Allowed 'General case' 0 C--O 1.239 0.506 0 N-CA-C 114.053 1.131 . . . . 10.0 114.053 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 38.27 83.34 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 115.253 1.575 . . . . 10.0 115.253 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -141.49 -176.08 4.6 Favored 'General case' 0 C--N 1.316 -0.876 0 O-C-N 127.344 2.903 . . . . 10.0 111.965 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.14 156.82 27.34 Favored 'General case' 0 N--CA 1.445 -0.707 0 N-CA-C 103.656 -2.72 . . . . 10.0 103.656 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 1.5 p -166.84 -176.8 3.58 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 106.08 -1.822 . . . . 10.0 106.08 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 33.0 mtp -127.66 95.63 4.29 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 100.243 -3.984 . . . . 10.0 100.243 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 59.6 m -95.87 139.3 32.28 Favored 'General case' 0 CA--C 1.513 -0.471 0 N-CA-C 117.149 2.277 . . . . 10.0 117.149 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 19.8 m -133.21 97.47 3.99 Favored 'General case' 0 N--CA 1.437 -1.122 0 N-CA-C 106.89 -1.522 . . . . 10.0 106.89 179.748 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 2.5 t -76.64 97.87 1.71 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.466 0 N-CA-C 104.657 -2.349 . . . . 10.0 104.657 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.0 t -89.7 170.39 10.49 Favored 'General case' 0 C--N 1.316 -0.857 0 O-C-N 124.946 1.404 . . . . 10.0 108.959 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' TRP . . . . . 0.469 ' HE1' HG11 ' A' ' 2' ' ' VAL . 5.8 t90 -123.88 96.7 5.05 Favored 'General case' 0 C--O 1.24 0.579 0 N-CA-C 107.203 -1.406 . . . . 10.0 107.203 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -57.3 -64.51 0.86 Allowed 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 103.433 -2.803 . . . . 10.0 103.433 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 141.88 115.1 1.11 Allowed Glycine 0 CA--C 1.499 -0.914 0 N-CA-C 103.973 -3.651 . . . . 10.0 103.973 179.79 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.637 ' HA ' HG22 ' A' ' 2' ' ' VAL . 20.1 t0 87.9 -30.83 0.04 OUTLIER 'General case' 0 N--CA 1.448 -0.55 0 O-C-N 125.894 1.585 . . . . 10.0 109.834 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 8.5 mtmt -125.06 139.82 53.46 Favored 'General case' 0 C--N 1.32 -0.682 0 O-C-N 121.215 -0.928 . . . . 10.0 110.239 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.561 HD11 ' HE1' ' A' ' 49' ' ' MET . 0.4 OUTLIER -91.04 108.38 19.83 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 103.107 -2.923 . . . . 10.0 103.107 -179.899 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -121.29 138.64 54.15 Favored 'General case' 0 C--O 1.216 -0.706 0 O-C-N 125.136 1.522 . . . . 10.0 114.077 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 19.3 p -138.42 152.75 48.64 Favored 'General case' 0 C--N 1.321 -0.667 0 O-C-N 125.022 1.451 . . . . 10.0 108.396 -179.92 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 2.9 t -109.66 -54.83 5.3 Favored 'Isoleucine or valine' 0 C--O 1.247 0.922 0 N-CA-C 107.143 -1.429 . . . . 10.0 107.143 179.866 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.406 ' CG ' ' HB3' ' A' ' 104' ' ' ARG . 0.0 OUTLIER 71.08 111.99 0.06 Allowed 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 123.802 1.763 . . . . 10.0 109.263 179.926 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.33 67.2 7.18 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-O 123.578 1.656 . . . . 10.0 115.012 179.711 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -92.04 147.91 18.95 Favored Glycine 0 C--O 1.218 -0.86 0 N-CA-C 107.754 -2.138 . . . . 10.0 107.754 179.759 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -48.38 -25.99 1.86 Allowed 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 116.993 2.22 . . . . 10.0 116.993 179.855 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.55 -158.56 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.804 0 CA-C-N 119.788 1.176 . . . . 10.0 113.688 179.799 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -117.01 -24.93 7.38 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 126.186 1.795 . . . . 10.0 114.0 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -117.0 10.58 15.26 Favored Glycine 0 C--N 1.342 0.865 0 N-CA-C 116.757 1.463 . . . . 10.0 116.757 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.406 ' HB3' ' CG ' ' A' ' 97' ' ' GLN . 24.2 mmm-85 -55.34 143.16 29.4 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 119.031 1.416 . . . . 10.0 113.404 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 120.07 146.02 7.59 Favored Glycine 0 C--O 1.217 -0.922 0 O-C-N 124.576 1.173 . . . . 10.0 111.376 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -124.96 176.34 6.72 Favored 'General case' 0 CA--C 1.509 -0.623 0 O-C-N 120.854 -1.38 . . . . 10.0 109.961 179.871 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 76.7 m -145.74 132.74 20.27 Favored 'General case' 0 CA--C 1.509 -0.63 0 CA-C-O 118.799 -0.62 . . . . 10.0 109.593 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -123.92 126.58 46.61 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 123.929 0.891 . . . . 10.0 111.741 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 8.5 p90 -145.4 149.34 34.56 Favored 'General case' 0 C--O 1.213 -0.848 0 C-N-CA 124.301 1.04 . . . . 10.0 110.919 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 44.1 mt -89.82 147.18 5.38 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 O-C-N 125.541 1.776 . . . . 10.0 114.81 -179.799 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -131.74 75.05 1.62 Allowed 'General case' 0 C--O 1.24 0.589 0 N-CA-C 107.047 -1.464 . . . . 10.0 107.047 179.679 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 43.53 81.73 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.544 0 CA-C-O 118.176 -1.346 . . . . 10.0 110.71 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 71.15 23.78 4.04 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 118.277 -0.868 . . . . 10.0 110.947 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -143.0 103.1 4.12 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 114.774 1.398 . . . . 10.0 114.774 -179.723 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.437 ' CB ' ' HB2' ' A' ' 130' ' ' PHE . 0.8 OUTLIER -63.18 123.89 19.78 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 103.86 -2.644 . . . . 10.0 103.86 -179.97 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 8.2 t-80 -134.32 99.43 4.38 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 106.906 -1.516 . . . . 10.0 106.906 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 13.8 tp -89.23 149.22 23.2 Favored 'General case' 0 C--N 1.314 -0.935 0 O-C-N 125.665 1.853 . . . . 10.0 113.43 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -133.96 124.09 25.74 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 104.999 -2.223 . . . . 10.0 104.999 -179.856 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.01 131.77 53.36 Favored 'General case' 0 C--N 1.319 -0.757 0 O-C-N 120.834 -1.166 . . . . 10.0 108.423 -179.693 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 77.2 mtm-85 -125.88 145.66 50.16 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 122.568 1.175 . . . . 10.0 110.49 179.712 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -153.62 115.04 4.18 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 106.465 -1.68 . . . . 10.0 106.465 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 45.95 57.08 5.43 Favored 'General case' 0 C--O 1.245 0.843 0 O-C-N 126.154 2.159 . . . . 10.0 116.697 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 87.69 -22.18 18.64 Favored Glycine 0 CA--C 1.534 1.278 0 N-CA-C 116.543 1.377 . . . . 10.0 116.543 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.408 HG11 ' HA ' ' A' ' 19' ' ' TYR . 2.6 t -75.64 151.73 6.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 CA-C-N 119.478 1.639 . . . . 10.0 109.556 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 125' ' ' THR . . . . . 0.479 ' O ' HG22 ' A' ' 125' ' ' THR . 12.8 m -136.56 86.12 2.19 Favored 'General case' 0 C--N 1.318 -0.782 0 O-C-N 124.473 1.108 . . . . 10.0 110.811 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 30.6 p -98.66 154.48 17.92 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 112.337 -2.21 . . . . 10.0 105.062 -179.726 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.01 146.38 27.75 Favored 'General case' 0 C--O 1.221 -0.445 0 CA-C-O 123.374 1.559 . . . . 10.0 114.397 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -113.11 124.58 52.9 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 114.035 -1.439 . . . . 10.0 111.133 179.902 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 55.2 t -105.57 138.4 30.86 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.82 0 CA-C-N 113.41 -1.723 . . . . 10.0 107.203 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 130' ' ' PHE . . . . . 0.49 ' CD1' ' HA ' ' A' ' 10' ' ' MET . 15.3 m-85 -128.93 -177.68 4.31 Favored 'General case' 0 C--O 1.215 -0.72 0 C-N-CA 124.996 1.319 . . . . 10.0 110.452 -179.619 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.416 ' CB ' ' HD2' ' A' ' 9' ' ' LYS . 0.0 OUTLIER -134.1 99.37 4.39 Favored 'General case' 0 C--O 1.24 0.597 0 CA-C-N 113.972 -1.467 . . . . 10.0 107.454 179.852 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -68.07 98.3 0.76 Allowed 'General case' 0 CA--C 1.508 -0.659 0 C-N-CA 117.345 -1.742 . . . . 10.0 107.623 179.888 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 133' ' ' VAL . . . . . 0.501 ' CG1' ' HE3' ' A' ' 9' ' ' LYS . 20.2 m -76.15 -4.26 5.95 Favored 'Isoleucine or valine' 0 C--O 1.241 0.62 0 C-N-CA 118.689 -1.204 . . . . 10.0 112.574 -179.696 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 66.5 t-80 . . . . . 0 C--N 1.325 -0.493 0 O-C-N 125.623 1.827 . . . . 10.0 111.751 179.766 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.466 ' C ' HG23 ' A' ' 2' ' ' VAL . 5.5 Cg_endo . . . . . 0 N--CA 1.478 0.576 0 N-CA-C 109.031 -1.18 . . . . 10.0 109.031 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.466 HG23 ' C ' ' A' ' 1' ' ' PRO . 1.6 t 69.19 98.12 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 N-CA-C 108.672 -0.862 . . . . 10.0 108.672 -179.938 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.4 ' O ' ' N ' ' A' ' 5' ' ' ASN . 0.4 OUTLIER -86.05 -9.24 57.1 Favored 'General case' 0 C--O 1.216 -0.661 0 C-N-CA 119.4 -0.92 . . . . 10.0 110.859 -179.987 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.468 ' CE1' HD12 ' A' ' 93' ' ' LEU . 43.1 m-85 62.72 -67.11 0.08 Allowed 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 115.968 1.84 . . . . 10.0 115.968 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.4 ' N ' ' O ' ' A' ' 3' ' ' ASP . 0.1 OUTLIER -49.64 149.05 2.58 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.1 0.96 . . . . 10.0 111.854 179.981 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 170.15 -61.9 0.18 Allowed Glycine 0 N--CA 1.438 -1.203 0 O-C-N 125.082 1.489 . . . . 10.0 116.386 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -177.18 -166.65 0.14 Allowed 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 102.805 -3.035 . . . . 10.0 102.805 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.622 ' CZ3' ' HB3' ' A' ' 39' ' ' ASP 0.257 0.5 OUTLIER -153.36 -44.57 0.09 Allowed 'General case' 0 N--CA 1.442 -0.857 0 CA-C-O 116.663 -1.637 . . . . 10.0 115.108 -178.036 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.465 ' HA ' ' CE3' ' A' ' 8' ' ' TRP . 1.3 pttt 12.46 98.94 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.001 1 O-C-N 129.45 4.218 . . . . 10.0 111.859 -177.201 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.72 157.58 17.5 Favored 'General case' 0 N--CA 1.441 -0.878 0 O-C-N 118.087 -2.883 . . . . 10.0 116.058 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.421 ' HA ' HD22 ' A' ' 11' ' ' LEU . 0.2 OUTLIER -111.89 -51.01 2.88 Favored 'General case' 0 C--O 1.245 0.859 0 CA-C-N 112.703 -2.044 . . . . 10.0 107.311 -179.692 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.1 p -146.45 -172.9 4.06 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 115.51 1.67 . . . . 10.0 115.51 179.765 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -169.16 133.84 1.48 Allowed 'General case' 0 C--O 1.22 -0.497 0 O-C-N 126.92 2.638 . . . . 10.0 106.961 -179.621 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -155.39 159.4 39.86 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-O 122.38 1.086 . . . . 10.0 111.497 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.453 ' HB3' ' HA ' ' A' ' 126' ' ' CYS . 0.9 OUTLIER 72.16 5.7 5.37 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 116.103 1.89 . . . . 10.0 116.103 179.983 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -57.58 -23.75 52.48 Favored 'General case' 0 CA--C 1.551 0.991 0 N-CA-C 115.054 1.501 . . . . 10.0 115.054 179.577 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -79.54 -41.54 27.07 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-O 123.979 1.847 . . . . 10.0 110.762 -179.757 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.99 -27.2 63.53 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 122.486 1.136 . . . . 10.0 110.343 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -67.84 -58.11 5.14 Favored 'General case' 0 C--O 1.242 0.706 0 C-N-CA 124.521 1.128 . . . . 10.0 108.951 -179.795 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.444 HD13 ' HB2' ' A' ' 30' ' ' ARG . 0.3 OUTLIER -67.59 -22.49 65.37 Favored 'General case' 0 C--O 1.211 -0.93 0 O-C-N 120.034 -1.666 . . . . 10.0 111.491 179.573 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.7 ttm-85 -75.4 -35.0 61.11 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 106.866 -1.531 . . . . 10.0 106.866 -179.802 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.14 -44.67 91.45 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 127.123 2.764 . . . . 10.0 112.435 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 26.5 mt -78.33 -34.15 48.75 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 125.493 1.517 . . . . 10.0 112.02 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 80.64 48.33 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.108 0 O-C-N 127.011 2.694 . . . . 10.0 113.529 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 27.9 m -82.85 164.46 2.77 Favored 'Isoleucine or valine' 0 C--O 1.242 0.71 0 O-C-N 124.996 1.435 . . . . 10.0 107.141 -179.658 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 9.0 m-20 -36.71 148.37 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.436 0 O-C-N 125.778 1.923 . . . . 10.0 115.213 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -70.63 -35.68 62.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 116.412 2.005 . . . . 10.0 116.412 -179.67 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -72.53 -21.06 61.23 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 123.517 1.627 . . . . 10.0 110.851 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.89 -41.96 77.59 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 119.31 -2.119 . . . . 10.0 111.733 179.632 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.444 ' HB2' HD13 ' A' ' 20' ' ' LEU . 15.8 ttp180 -56.5 -36.41 69.12 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 127.016 2.126 . . . . 10.0 113.51 179.695 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.8 tmtp? -68.53 -38.79 81.14 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 112.855 -1.975 . . . . 10.0 111.234 179.664 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 66.8 mt -75.36 -58.84 3.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 114.035 -1.439 . . . . 10.0 109.94 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -48.98 -31.97 8.35 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 116.335 1.976 . . . . 10.0 116.335 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -65.68 -18.24 65.18 Favored 'General case' 0 CA--C 1.516 -0.332 0 O-C-N 125.084 1.49 . . . . 10.0 110.888 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 53.1 mt -105.96 -7.38 18.17 Favored 'General case' 0 N--CA 1.448 -0.552 0 O-C-N 125.358 1.661 . . . . 10.0 113.44 -179.544 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -96.26 154.69 17.12 Favored 'General case' 0 C--O 1.219 -0.525 0 N-CA-C 114.203 1.186 . . . . 10.0 114.203 179.754 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 3.6 mtmt -139.93 100.32 7.29 Favored Pre-proline 0 C--N 1.327 -0.413 0 N-CA-C 104.717 -2.327 . . . . 10.0 104.717 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_exo -70.02 167.47 24.7 Favored 'Trans proline' 0 C--O 1.24 0.6 1 C-N-CA 125.74 4.293 . . . . 10.0 116.322 -179.711 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.622 ' HB3' ' CZ3' ' A' ' 8' ' ' TRP . 2.9 p30 -124.71 166.72 15.66 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 106.207 -1.775 . . . . 10.0 106.207 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.94 90.04 1.43 Allowed 'General case' 0 N--CA 1.434 -1.254 0 CA-C-O 122.93 1.348 . . . . 10.0 112.848 179.903 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.405 ' HA ' ' CD1' ' A' ' 8' ' ' TRP . 15.4 tt0 -85.72 103.94 14.97 Favored 'General case' 0 N--CA 1.442 -0.859 0 N-CA-C 105.232 -2.136 . . . . 10.0 105.232 179.825 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 10.2 mt -91.28 146.56 6.08 Favored 'Isoleucine or valine' 0 C--O 1.248 0.979 0 CA-C-N 113.691 -1.595 . . . . 10.0 109.384 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -151.44 121.53 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.817 0 CA-C-O 123.875 1.798 . . . . 10.0 109.466 -179.849 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.11 147.42 40.24 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 119.31 -2.119 . . . . 10.0 110.969 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -131.74 73.74 1.55 Allowed 'General case' 0 C--O 1.225 -0.217 0 CA-C-O 124.387 2.041 . . . . 10.0 106.375 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 88.81 -117.1 4.79 Favored Glycine 0 CA--C 1.533 1.189 0 N-CA-C 107.381 -2.288 . . . . 10.0 107.381 179.596 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -91.83 -13.83 30.77 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 118.142 -1.423 . . . . 10.0 108.062 -179.898 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -81.01 138.38 36.04 Favored 'General case' 0 CA--C 1.518 -0.272 0 O-C-N 120.831 -1.168 . . . . 10.0 108.262 179.641 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 3.1 ttt -134.78 142.1 46.61 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.45 1.094 . . . . 10.0 110.923 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 8.8 mt -127.02 124.48 64.61 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.682 0 N-CA-C 106.573 -1.64 . . . . 10.0 106.573 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.438 ' CD1' ' N ' ' A' ' 51' ' ' ILE . 0.3 OUTLIER -106.84 100.17 10.11 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.901 0 N-CA-C 106.939 -1.504 . . . . 10.0 106.939 179.686 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.693 ' HG2' HD12 ' A' ' 61' ' ' ILE . 0.0 OUTLIER -93.58 127.55 39.3 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-O 122.136 0.969 . . . . 10.0 111.107 -179.868 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 57.5 m -106.69 121.43 44.33 Favored 'General case' 0 C--O 1.219 -0.507 0 N-CA-C 102.789 -3.041 . . . . 10.0 102.789 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.42 ' HB2' ' CG ' ' A' ' 39' ' ' ASP . 5.2 mp -104.1 58.05 0.72 Allowed 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 119.57 3.174 . . . . 10.0 119.57 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.8 t -83.36 172.53 12.41 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 104.475 -2.417 . . . . 10.0 104.475 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 9.6 t -106.09 -39.4 5.98 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.874 0.845 . . . . 10.0 109.648 179.873 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 48.1 m-85 -72.38 -21.8 61.23 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 116.949 -1.501 . . . . 10.0 108.12 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.448 ' NE ' HD11 ' A' ' 77' ' ' ILE . 18.7 ptt-85 -151.7 -170.84 3.76 Favored 'General case' 0 C--N 1.328 -0.361 0 O-C-N 126.678 2.486 . . . . 10.0 111.698 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -179.51 82.21 0.01 OUTLIER 'General case' 0 C--O 1.243 0.733 0 CA-C-N 114.479 -1.237 . . . . 10.0 111.257 -179.624 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.413 ' CD1' ' O ' ' A' ' 60' ' ' TYR . 0.1 OUTLIER -93.22 127.84 38.95 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 124.991 2.329 . . . . 10.0 106.797 -179.702 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.693 HD12 ' HG2' ' A' ' 52' ' ' ARG . 17.9 mm -108.67 137.69 39.29 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.818 0 O-C-N 118.201 -2.812 . . . . 10.0 111.001 -179.746 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 20.4 mtm -110.66 162.83 14.36 Favored 'General case' 0 CA--C 1.515 -0.37 0 O-C-N 126.411 2.32 . . . . 10.0 108.983 179.842 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -144.48 78.3 1.57 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 102.126 -3.287 . . . . 10.0 102.126 179.736 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 1.9 m-30 -85.53 125.11 32.82 Favored 'General case' 0 N--CA 1.445 -0.699 0 O-C-N 126.045 2.091 . . . . 10.0 114.657 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 25.8 tt0 -105.72 139.55 40.14 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 111.94 -2.391 . . . . 10.0 105.703 -179.821 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.574 HG21 ' CD1' ' A' ' 88' ' ' TRP . 0.3 OUTLIER -93.85 121.25 44.34 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-O 123.726 1.727 . . . . 10.0 108.67 -179.79 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 97.56 -12.74 64.62 Favored Glycine 0 C--O 1.213 -1.212 0 O-C-N 120.422 -1.423 . . . . 10.0 113.993 179.776 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.77 138.98 41.06 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 115.948 1.832 . . . . 10.0 115.948 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -80.16 135.95 36.4 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-O 122.317 1.056 . . . . 10.0 110.579 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -116.12 167.63 10.82 Favored 'General case' 0 C--O 1.248 1.0 0 CA-C-O 118.256 -0.878 . . . . 10.0 110.263 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 19.8 tt0 -137.44 82.63 1.94 Allowed 'General case' 0 C--N 1.317 -0.828 0 O-C-N 125.89 1.994 . . . . 10.0 108.443 -179.951 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -73.18 133.59 44.1 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 116.677 2.103 . . . . 10.0 116.677 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -104.46 -13.8 15.93 Favored 'General case' 0 C--O 1.221 -0.414 0 N-CA-C 106.372 -1.714 . . . . 10.0 106.372 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.43 HD12 ' HA ' ' A' ' 74' ' ' LEU . 0.9 OUTLIER 61.09 -84.36 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 118.812 -0.613 . . . . 10.0 112.066 -179.984 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 29.4 m 55.05 60.8 3.24 Favored 'General case' 0 C--N 1.32 -0.704 0 O-C-N 126.169 2.168 . . . . 10.0 108.682 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 172.26 137.47 2.35 Favored Glycine 0 N--CA 1.44 -1.056 0 O-C-N 126.886 2.616 . . . . 10.0 108.123 -179.816 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.448 HD11 ' NE ' ' A' ' 58' ' ' ARG . 11.3 mt 72.46 -64.91 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 N-CA-C 104.21 -2.515 . . . . 10.0 104.21 179.902 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -107.52 -80.05 0.57 Allowed 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 117.017 -1.468 . . . . 10.0 112.186 -179.885 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 21.1 p-10 122.39 28.83 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.699 0 O-C-N 128.203 3.439 . . . . 10.0 117.779 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.95 164.48 13.63 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 123.081 1.419 . . . . 10.0 111.096 179.614 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 38.3 mttt -114.74 179.16 4.03 Favored 'General case' 0 CA--C 1.509 -0.606 0 O-C-N 119.72 -1.862 . . . . 10.0 107.805 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 5.6 p 175.79 170.67 0.37 Allowed 'General case' 0 CA--C 1.503 -0.848 0 CA-C-O 123.288 1.518 . . . . 10.0 110.475 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -117.55 108.72 15.83 Favored 'General case' 0 N--CA 1.443 -0.824 0 N-CA-C 100.692 -3.818 . . . . 10.0 100.692 179.629 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 3.0 m -115.1 150.25 36.26 Favored 'General case' 0 CA--C 1.499 -1.019 0 N-CA-C 118.608 2.818 . . . . 10.0 118.608 -179.348 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 2.8 m -142.5 114.4 8.12 Favored 'General case' 0 CA--C 1.5 -0.967 0 CA-C-N 114.249 -1.341 . . . . 10.0 108.613 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 5.6 t -89.22 136.08 24.37 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 N-CA-C 101.591 -3.485 . . . . 10.0 101.591 -179.797 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 46.9 t -134.48 176.24 8.8 Favored 'General case' 0 N--CA 1.444 -0.728 0 O-C-N 124.989 1.43 . . . . 10.0 109.358 -179.772 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' TRP . . . . . 0.574 ' CD1' HG21 ' A' ' 66' ' ' VAL . 0.0 OUTLIER -125.96 92.13 3.53 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 104.495 -2.409 . . . . 10.0 104.495 -179.995 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -87.52 83.56 7.25 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 100.885 -3.746 . . . . 10.0 100.885 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 62.9 -105.62 1.06 Allowed Glycine 0 C--O 1.237 0.3 0 N-CA-C 106.456 -2.658 . . . . 10.0 106.456 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.415 ' HB3' HG21 ' A' ' 2' ' ' VAL . 17.1 m-20 -114.33 60.62 0.67 Allowed 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 114.123 -1.038 . . . . 10.0 112.133 -179.762 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 7.3 mtmt -158.83 139.08 12.27 Favored 'General case' 0 C--O 1.24 0.595 0 O-C-N 120.441 -1.412 . . . . 10.0 110.191 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.468 HD12 ' CE1' ' A' ' 4' ' ' PHE . 0.2 OUTLIER -95.47 94.58 7.88 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 105.931 -1.877 . . . . 10.0 105.931 179.91 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -104.03 137.81 41.46 Favored 'General case' 0 CA--C 1.506 -0.741 0 O-C-N 126.215 2.197 . . . . 10.0 110.519 179.737 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 19.1 m -142.89 129.16 19.89 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 126.655 2.472 . . . . 10.0 113.678 -179.896 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 96.2 t -116.28 122.98 70.91 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 N-CA-C 105.583 -2.006 . . . . 10.0 105.583 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -105.6 107.72 18.87 Favored 'General case' 0 C--O 1.238 0.452 0 O-C-N 125.783 1.927 . . . . 10.0 107.994 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 40.3 tttt -87.22 120.74 28.82 Favored 'General case' 0 C--O 1.221 -0.419 0 C-N-CA 120.088 -0.645 . . . . 10.0 112.453 179.666 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -143.22 -151.28 5.45 Favored Glycine 0 N--CA 1.447 -0.577 0 CA-C-O 123.252 1.473 . . . . 10.0 110.302 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -81.22 -1.49 45.02 Favored 'General case' 0 C--O 1.243 0.723 0 O-C-N 119.917 -1.931 . . . . 10.0 114.576 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.415 ' HB2' ' HG2' ' A' ' 104' ' ' ARG . 14.2 mttp -93.37 -166.72 1.57 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 124.599 2.142 . . . . 10.0 113.486 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -132.96 30.97 3.94 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 114.015 -1.448 . . . . 10.0 112.074 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 177.51 33.63 0.05 OUTLIER Glycine 0 N--CA 1.443 -0.861 0 CA-C-O 116.835 -2.092 . . . . 10.0 118.118 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.415 ' HG2' ' HB2' ' A' ' 101' ' ' LYS . 0.0 OUTLIER -95.37 135.86 36.46 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 119.168 1.484 . . . . 10.0 109.304 179.732 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 148.17 148.16 4.69 Favored Glycine 0 N--CA 1.446 -0.686 0 N-CA-C 109.25 -1.54 . . . . 10.0 109.25 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -116.03 -178.67 3.46 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 117.538 0.669 . . . . 10.0 110.057 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.1 m -158.49 126.92 5.35 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 105.068 -2.197 . . . . 10.0 105.068 179.763 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.658 ' CD ' HD21 ' A' ' 115' ' ' LEU . 0.8 OUTLIER -110.35 127.97 55.33 Favored 'General case' 0 C--O 1.219 -0.503 0 O-C-N 125.908 2.005 . . . . 10.0 110.306 -179.839 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 1.6 t-105 -135.54 146.39 48.0 Favored 'General case' 0 C--O 1.214 -0.801 0 N-CA-C 107.465 -1.309 . . . . 10.0 107.465 -179.847 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 17.7 mt -113.81 116.89 53.92 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 N-CA-C 117.662 2.468 . . . . 10.0 117.662 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -81.72 179.17 7.94 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 112.595 -2.093 . . . . 10.0 106.321 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -52.51 99.57 0.04 OUTLIER Glycine 0 C--O 1.221 -0.715 0 N-CA-C 108.375 -1.89 . . . . 10.0 108.375 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 53.75 30.64 11.52 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 123.62 1.676 . . . . 10.0 112.848 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -146.77 109.96 4.76 Favored 'General case' 0 CA--C 1.502 -0.894 0 CA-C-O 124.925 2.297 . . . . 10.0 113.409 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.658 HD21 ' CD ' ' A' ' 108' ' ' GLN . 2.6 tm? -74.92 131.19 40.51 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 104.315 -2.476 . . . . 10.0 104.315 -179.849 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 9.3 t-160 -128.41 91.11 3.18 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 107.725 -1.213 . . . . 10.0 107.725 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.612 ' C ' HD23 ' A' ' 117' ' ' LEU . 6.5 tt -95.19 142.77 27.24 Favored 'General case' 0 N--CA 1.44 -0.953 0 O-C-N 124.759 1.287 . . . . 10.0 111.498 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.574 ' N ' HD23 ' A' ' 117' ' ' LEU . 16.2 pm0 -128.56 133.91 48.5 Favored 'General case' 0 C--O 1.216 -0.708 0 N-CA-C 108.011 -1.107 . . . . 10.0 108.011 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 48.1 mtt -112.62 162.02 16.16 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-O 123.366 1.555 . . . . 10.0 108.164 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 2.7 mtm180 -158.65 148.5 19.47 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 113.952 -1.476 . . . . 10.0 109.49 179.84 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' ALA . . . . . 0.635 ' O ' HG22 ' A' ' 124' ' ' VAL . . . -171.17 122.34 0.56 Allowed 'General case' 0 CA--C 1.504 -0.801 0 O-C-N 123.588 0.555 . . . . 10.0 109.766 179.595 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 61.34 31.6 19.25 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 126.306 1.843 . . . . 10.0 114.486 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 97.9 -15.38 61.77 Favored Glycine 0 CA--C 1.536 1.404 0 CA-C-O 117.032 -1.982 . . . . 10.0 116.792 -179.702 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.635 HG22 ' O ' ' A' ' 121' ' ' ALA . 19.8 m -94.73 -179.78 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 CA-C-N 119.171 1.485 . . . . 10.0 111.003 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 1.1 m -149.93 133.89 16.99 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 122.19 0.995 . . . . 10.0 113.213 179.819 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' CYS . . . . . 0.453 ' HA ' ' HB3' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -123.12 142.39 50.93 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 105.126 -2.176 . . . . 10.0 105.126 179.911 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.26 145.86 36.09 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 114.176 1.176 . . . . 10.0 114.176 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.09 109.19 10.29 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 113.951 -1.477 . . . . 10.0 111.984 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 84.8 t -72.27 123.06 26.04 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 N-CA-C 105.142 -2.17 . . . . 10.0 105.142 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 130' ' ' PHE . . . . . 0.441 ' HB2' HD12 ' A' ' 115' ' ' LEU . 2.7 m-85 -103.25 161.97 13.37 Favored 'General case' 0 C--N 1.316 -0.866 0 C-N-CA 124.685 1.194 . . . . 10.0 108.73 -179.656 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -137.61 102.71 4.83 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 122.449 1.118 . . . . 10.0 108.217 -179.734 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.27 128.22 35.47 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-O 122.155 0.979 . . . . 10.0 110.253 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 1.3 t -101.38 -21.65 5.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 C-N-CA 124.641 1.176 . . . . 10.0 109.486 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 54.7 t60 . . . . . 0 C--O 1.251 1.164 0 O-C-N 124.746 1.279 . . . . 10.0 114.11 -179.985 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . 0.272 72.8 Cg_exo . . . . . 0 C--O 1.237 0.442 0 CA-C-O 123.665 1.444 . . . . 10.0 111.137 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -138.31 41.43 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 114.364 -1.289 . . . . 10.0 110.862 179.702 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -44.12 130.6 6.11 Favored 'General case' 0 C--O 1.24 0.571 0 C-N-CA 124.715 1.206 . . . . 10.0 111.033 -179.785 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -98.19 -20.77 17.09 Favored 'General case' 0 C--O 1.24 0.602 0 N-CA-C 115.687 1.736 . . . . 10.0 115.687 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -56.3 116.77 3.25 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 117.061 -1.447 . . . . 10.0 112.03 -179.816 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -132.22 -158.78 9.09 Favored Glycine 0 CA--C 1.534 1.227 0 CA-C-O 123.193 1.441 . . . . 10.0 115.681 -179.842 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.692 ' O ' HG12 ' A' ' 133' ' ' VAL . 0.3 OUTLIER -160.57 82.76 0.68 Allowed 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 100.377 -3.934 . . . . 10.0 100.377 179.97 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.649 ' CG ' ' N ' ' A' ' 9' ' ' LYS 0.284 0.2 OUTLIER -61.32 -160.09 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 127.106 2.163 . . . . 10.0 111.941 -179.706 . . . . . . . . 4 4 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.649 ' N ' ' CG ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER 153.09 74.4 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.611 0 O-C-N 126.295 2.247 . . . . 10.0 106.174 176.539 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 27.9 ttm -36.26 139.89 0.15 Allowed 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 112.179 -2.282 . . . . 10.0 115.379 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.3 tp -95.09 -38.66 10.52 Favored 'General case' 0 C--N 1.317 -0.832 0 O-C-N 126.708 2.505 . . . . 10.0 106.424 -179.776 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -178.22 162.0 1.51 Allowed 'General case' 0 C--N 1.345 0.412 0 CA-C-O 123.528 1.632 . . . . 10.0 112.977 179.776 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -121.04 165.79 14.79 Favored 'General case' 0 CA--C 1.51 -0.569 0 CA-C-N 112.651 -2.068 . . . . 10.0 106.326 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -157.91 129.89 6.97 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.823 -0.626 . . . . 10.0 111.046 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 69.73 44.1 0.9 Allowed 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 125.443 1.497 . . . . 10.0 113.469 -179.813 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -76.92 -39.92 49.09 Favored 'General case' 0 CA--C 1.55 0.96 0 O-C-N 125.453 1.721 . . . . 10.0 109.231 179.771 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -71.14 -36.89 72.25 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 114.306 -1.315 . . . . 10.0 112.118 179.904 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.602 ' HB3' HG11 ' A' ' 124' ' ' VAL . 3.2 mt-10 -70.29 -33.18 71.26 Favored 'General case' 0 N--CA 1.442 -0.865 0 O-C-N 125.588 1.805 . . . . 10.0 108.948 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.424 ' O ' ' HB3' ' A' ' 22' ' ' ALA . 1.1 t80 -71.97 -38.22 69.77 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 113.758 -1.565 . . . . 10.0 110.439 179.851 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 80.4 mt -71.59 -25.8 62.34 Favored 'General case' 0 C--O 1.213 -0.832 0 O-C-N 121.645 -0.659 . . . . 10.0 110.583 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.26 -29.29 60.12 Favored 'General case' 0 C--O 1.243 0.714 0 CA-C-O 123.143 1.449 . . . . 10.0 107.775 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.424 ' HB3' ' O ' ' A' ' 19' ' ' TYR . . . -62.36 -28.41 69.74 Favored 'General case' 0 C--O 1.212 -0.872 0 C-N-CA 125.463 1.505 . . . . 10.0 112.722 179.725 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 22.3 mt -104.92 -6.19 20.36 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.631 1.172 . . . . 10.0 111.124 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 42.9 m-20 48.71 58.97 4.72 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 125.897 1.679 . . . . 10.0 114.177 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 26.2 m -93.39 161.29 2.58 Favored 'Isoleucine or valine' 0 C--O 1.243 0.754 0 N-CA-C 106.555 -1.646 . . . . 10.0 106.555 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -41.59 142.15 0.66 Allowed 'General case' 0 CA--C 1.544 0.745 0 CA-C-O 123.817 1.77 . . . . 10.0 113.452 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 52.9 t -67.07 -26.26 36.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 N-CA-C 115.875 1.805 . . . . 10.0 115.875 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.546 ' O ' HD13 ' A' ' 32' ' ' ILE . . . -73.89 -26.9 60.79 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 119.673 -0.811 . . . . 10.0 111.697 179.881 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.8 -44.3 73.86 Favored 'General case' 0 C--N 1.317 -0.813 0 O-C-N 125.774 1.921 . . . . 10.0 114.646 179.743 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.07 -31.28 69.92 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-O 123.864 1.792 . . . . 10.0 112.065 -179.49 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 14.8 mttt -77.3 -33.64 55.65 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 113.465 -1.698 . . . . 10.0 110.86 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.546 HD13 ' O ' ' A' ' 28' ' ' ALA . 1.4 mp -77.26 -39.77 28.78 Favored 'Isoleucine or valine' 0 C--O 1.243 0.759 0 CA-C-N 114.922 -1.036 . . . . 10.0 111.032 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -81.5 -19.35 42.44 Favored 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 116.069 1.877 . . . . 10.0 116.069 -179.711 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 -76.37 -14.86 60.06 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 122.551 1.167 . . . . 10.0 110.63 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.413 ' HA ' HD23 ' A' ' 35' ' ' LEU . 14.6 mt -83.21 -9.67 59.02 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 123.793 0.837 . . . . 10.0 113.066 -179.64 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 21.0 mt -116.52 165.38 13.3 Favored 'General case' 0 CA--C 1.507 -0.675 0 CA-C-O 122.588 1.185 . . . . 10.0 109.066 -179.788 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.53 99.17 8.71 Favored Pre-proline 0 N--CA 1.481 1.099 0 N-CA-C 103.163 -2.902 . . . . 10.0 103.163 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_exo -51.16 -174.95 0.01 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.382 0 C-N-CA 124.693 3.596 . . . . 10.0 115.521 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.5 ' HB2' ' CZ2' ' A' ' 8' ' ' TRP . 0.5 OUTLIER -139.54 -174.77 3.98 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-N 113.096 -1.866 . . . . 10.0 108.222 -179.929 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.7 mttm -173.63 122.79 0.35 Allowed 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 119.109 0.868 . . . . 10.0 111.01 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -121.19 121.0 36.82 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 119.82 1.191 . . . . 10.0 108.424 179.388 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 2.4 mt -97.07 142.01 14.78 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.923 0 O-C-N 124.861 1.351 . . . . 10.0 111.223 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 56.1 t -147.28 138.14 17.73 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.998 0 N-CA-C 104.964 -2.235 . . . . 10.0 104.964 -179.918 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -143.29 126.08 16.1 Favored 'General case' 0 C--O 1.211 -0.93 0 N-CA-C 106.058 -1.83 . . . . 10.0 106.058 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -104.24 23.87 12.4 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-O 122.965 1.364 . . . . 10.0 107.568 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 87.83 106.27 0.94 Allowed Glycine 0 C--N 1.336 0.539 0 N-CA-C 110.138 -1.185 . . . . 10.0 110.138 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 57.27 31.58 20.33 Favored 'General case' 0 C--N 1.321 -0.654 0 O-C-N 124.829 0.958 . . . . 10.0 110.088 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -162.36 92.99 0.84 Allowed 'General case' 0 C--O 1.213 -0.818 0 N-CA-C 103.189 -2.893 . . . . 10.0 103.189 179.832 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.496 ' SD ' HD11 ' A' ' 51' ' ' ILE . 4.9 ttm -105.34 142.64 34.74 Favored 'General case' 0 C--N 1.316 -0.875 0 O-C-N 126.389 2.306 . . . . 10.0 116.588 -179.592 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 6.0 mm -128.28 130.91 69.5 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.732 0 N-CA-C 106.273 -1.751 . . . . 10.0 106.273 -179.751 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.496 HD11 ' SD ' ' A' ' 49' ' ' MET . 1.3 mp -121.58 113.61 39.89 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.07 0 O-C-N 126.87 2.607 . . . . 10.0 106.059 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.8 mtp180 -111.61 98.75 7.65 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 113.924 1.083 . . . . 10.0 113.924 -179.799 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 32.4 m -96.25 89.3 5.06 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 104.736 -2.32 . . . . 10.0 104.736 -179.814 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.73 44.43 0.01 OUTLIER 'General case' 0 C--N 1.315 -0.905 1 N-CA-C 122.824 4.379 . . . . 10.0 122.824 -179.709 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 36.1 t -64.95 138.56 58.44 Favored 'General case' 0 C--O 1.242 0.695 0 N-CA-C 103.622 -2.733 . . . . 10.0 103.622 -179.735 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 15.9 p -87.39 -37.27 17.21 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 121.389 1.904 . . . . 10.0 108.401 179.789 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 22.0 t80 -53.46 -35.81 60.92 Favored 'General case' 0 C--O 1.242 0.688 0 O-C-N 125.979 2.049 . . . . 10.0 110.076 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -174.82 90.04 0.06 Allowed 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 115.577 -0.738 . . . . 10.0 112.243 -179.845 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -46.16 144.58 1.91 Allowed 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.61 1.194 . . . . 10.0 113.554 179.775 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -122.72 89.19 3.07 Favored 'General case' 0 CA--C 1.503 -0.859 0 N-CA-C 103.236 -2.876 . . . . 10.0 103.236 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 19.7 mm -90.13 128.38 42.1 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 O-C-N 120.217 -1.552 . . . . 10.0 110.943 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 1.7 mtm -125.65 142.6 51.43 Favored 'General case' 0 C--N 1.341 0.226 0 N-CA-C 105.303 -2.11 . . . . 10.0 105.303 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -140.95 96.56 3.02 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 100.73 -3.804 . . . . 10.0 100.73 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 1.5 m-30 -110.86 167.27 10.36 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 117.623 2.453 . . . . 10.0 117.623 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -126.68 99.9 5.98 Favored 'General case' 0 C--O 1.241 0.624 0 CA-C-N 111.389 -2.642 . . . . 10.0 104.223 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 33.3 t -43.8 112.4 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 CA-C-N 114.225 -1.352 . . . . 10.0 112.424 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.99 30.9 60.55 Favored Glycine 0 CA--C 1.528 0.901 0 O-C-N 126.63 2.456 . . . . 10.0 115.758 -179.887 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.6 tmmm? -107.79 2.38 23.56 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 115.783 1.772 . . . . 10.0 115.783 -179.693 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 59.6 tt0 61.84 138.04 0.01 OUTLIER 'General case' 0 C--N 1.311 -1.074 0 O-C-N 128.354 3.534 . . . . 10.0 113.526 179.505 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 56.4 m-85 -141.26 143.89 34.37 Favored 'General case' 0 C--N 1.319 -0.721 0 O-C-N 121.046 -1.034 . . . . 10.0 110.47 -179.776 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -109.93 90.33 3.28 Favored 'General case' 0 C--N 1.321 -0.638 0 O-C-N 126.057 2.098 . . . . 10.0 110.23 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -78.89 134.98 36.87 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 113.982 -1.463 . . . . 10.0 114.672 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -129.82 95.23 3.91 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 106.205 -1.776 . . . . 10.0 106.205 179.779 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.406 ' HB3' ' HA ' ' A' ' 79' ' ' ASP . 1.0 OUTLIER -68.56 -167.23 0.09 Allowed 'General case' 0 C--N 1.322 -0.607 0 O-C-N 125.0 1.438 . . . . 10.0 112.718 -179.98 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -158.61 -70.55 0.09 Allowed 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 107.809 -1.182 . . . . 10.0 107.809 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -92.28 -173.41 41.88 Favored Glycine 0 N--CA 1.434 -1.448 0 O-C-N 126.965 2.666 . . . . 10.0 111.579 -179.796 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 78.5 mt 75.03 -92.03 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 O-C-N 126.225 1.779 . . . . 10.0 107.704 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -115.7 -48.58 2.76 Favored 'General case' 0 C--N 1.318 -0.775 0 C-N-CA 124.287 1.035 . . . . 10.0 109.967 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.406 ' HA ' ' HB3' ' A' ' 74' ' ' LEU . 0.0 OUTLIER 75.9 128.25 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 118.171 2.656 . . . . 10.0 118.171 179.785 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 6.4 ttm105 -177.81 144.49 0.36 Allowed 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 114.544 -1.207 . . . . 10.0 110.742 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 1.8 mtpp -96.18 148.78 22.35 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 104.327 -2.472 . . . . 10.0 104.327 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 1.8 p -168.23 168.72 11.39 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 107.224 -1.399 . . . . 10.0 107.224 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 7.0 mtt -115.29 92.12 3.82 Favored 'General case' 0 C--O 1.245 0.818 0 N-CA-C 102.051 -3.314 . . . . 10.0 102.051 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.2 m -88.37 115.57 25.96 Favored 'General case' 0 CA--C 1.504 -0.814 0 O-C-N 119.498 -2.001 . . . . 10.0 113.38 179.825 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 11.2 m -119.8 111.35 17.88 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-N 114.594 -1.184 . . . . 10.0 108.857 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 1.3 t -84.79 119.86 34.36 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 N-CA-C 101.296 -3.594 . . . . 10.0 101.296 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.4 p -145.03 141.93 29.32 Favored 'General case' 0 C--O 1.217 -0.621 0 CA-C-O 124.407 2.051 . . . . 10.0 114.82 -179.496 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -72.39 137.96 46.89 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 113.368 -1.742 . . . . 10.0 109.488 179.339 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.436 ' CB ' HE22 ' A' ' 94' ' ' GLN . 8.6 t0 -97.94 8.94 43.93 Favored 'General case' 0 CA--C 1.506 -0.716 0 N-CA-C 103.401 -2.815 . . . . 10.0 103.401 179.854 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 129.66 -29.8 3.72 Favored Glycine 0 CA--C 1.497 -1.062 0 N-CA-C 103.392 -3.883 . . . . 10.0 103.392 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -157.6 -51.28 0.07 Allowed 'General case' 0 C--O 1.24 0.563 0 CA-C-N 118.011 0.906 . . . . 10.0 109.857 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -61.39 160.92 10.04 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-O 117.396 -1.288 . . . . 10.0 110.442 -179.915 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 49.0 tp -104.26 116.06 31.51 Favored 'General case' 0 N--CA 1.442 -0.851 0 N-CA-C 104.757 -2.312 . . . . 10.0 104.757 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' GLN . . . . . 0.436 HE22 ' CB ' ' A' ' 89' ' ' ASP . 10.4 mp0 -124.45 142.52 51.25 Favored 'General case' 0 CA--C 1.501 -0.942 0 N-CA-C 115.799 1.777 . . . . 10.0 115.799 -179.753 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -134.81 157.69 46.12 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 116.851 -1.547 . . . . 10.0 107.653 179.849 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 8.3 t -130.56 -67.1 0.58 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.755 0 C-N-CA 118.329 -1.348 . . . . 10.0 110.924 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 72.86 116.18 0.05 Allowed 'General case' 0 C--O 1.245 0.849 0 N-CA-C 105.506 -2.035 . . . . 10.0 105.506 -179.504 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 5.2 ptpp? -107.47 170.74 7.79 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 114.88 1.437 . . . . 10.0 114.88 -179.527 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 176.86 -124.14 0.94 Allowed Glycine 0 N--CA 1.447 -0.568 0 O-C-N 124.723 1.264 . . . . 10.0 110.653 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -130.31 22.07 5.21 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 114.977 1.473 . . . . 10.0 114.977 179.882 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -110.7 177.2 4.75 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 116.084 1.883 . . . . 10.0 116.084 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -90.9 120.6 32.05 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 128.625 2.77 . . . . 10.0 108.959 179.651 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 86.49 -97.49 2.24 Favored Glycine 0 C--O 1.22 -0.72 0 O-C-N 119.808 -1.807 . . . . 10.0 115.214 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 21.3 mtm-85 59.82 165.76 0.06 Allowed 'General case' 0 N--CA 1.441 -0.876 0 N-CA-C 114.896 1.443 . . . . 10.0 114.896 -179.699 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 74.43 166.52 15.59 Favored Glycine 0 N--CA 1.444 -0.792 0 CA-C-N 112.036 -2.347 . . . . 10.0 112.903 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -112.46 -173.81 2.33 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 124.565 1.146 . . . . 10.0 109.757 -179.793 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 55.9 m -162.35 123.34 2.57 Favored 'General case' 0 C--O 1.214 -0.814 0 CA-C-O 118.304 -0.855 . . . . 10.0 110.259 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 10.0 mt-30 -120.17 124.9 46.87 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 118.258 -0.877 . . . . 10.0 112.462 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -134.15 164.64 26.9 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 106.519 -1.66 . . . . 10.0 106.519 179.704 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 37.5 mt -129.28 136.21 59.99 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 N-CA-C 116.282 1.956 . . . . 10.0 116.282 -179.822 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -109.24 -162.17 0.8 Allowed 'General case' 0 CA--C 1.522 -0.117 0 C-N-CA 125.869 1.668 . . . . 10.0 107.356 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -77.48 103.11 1.8 Allowed Glycine 0 CA--C 1.528 0.868 0 O-C-N 125.741 1.901 . . . . 10.0 108.833 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 9.6 t70 50.07 17.41 0.3 Allowed 'General case' 0 C--N 1.324 -0.504 0 O-C-N 127.151 2.324 . . . . 10.0 111.812 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -137.28 88.8 2.38 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 120.5 1.5 . . . . 10.0 110.716 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.795 HD12 ' N ' ' A' ' 116' ' ' HIS . 0.9 OUTLIER -60.48 134.06 56.7 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 105.198 -2.149 . . . . 10.0 105.198 -179.946 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 116' ' ' HIS . . . . . 0.795 ' N ' HD12 ' A' ' 115' ' ' LEU . 3.6 t60 -119.2 99.05 6.47 Favored 'General case' 0 C--O 1.213 -0.859 0 O-C-N 118.96 -2.337 . . . . 10.0 109.156 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.29 149.15 21.99 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 114.449 -1.25 . . . . 10.0 111.197 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -146.01 128.56 16.05 Favored 'General case' 0 CA--C 1.505 -0.757 0 O-C-N 125.205 1.566 . . . . 10.0 108.621 179.716 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -113.51 125.73 54.53 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 114.117 -1.402 . . . . 10.0 108.026 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.416 ' HD3' ' N ' ' A' ' 120' ' ' ARG . 0.0 OUTLIER -121.43 160.8 23.38 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-O 125.584 2.611 . . . . 10.0 115.534 -179.943 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -179.03 137.49 0.14 Allowed 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 112.698 -2.046 . . . . 10.0 110.579 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 46.85 31.54 1.5 Allowed 'General case' 0 C--O 1.246 0.896 0 CA-C-N 113.596 -1.638 . . . . 10.0 114.5 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 93.61 -15.38 63.17 Favored Glycine 0 N--CA 1.444 -0.78 0 C-N-CA 124.36 0.981 . . . . 10.0 115.533 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.602 HG11 ' HB3' ' A' ' 18' ' ' GLU . 3.0 t -94.04 131.32 41.27 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 CA-C-N 119.589 1.695 . . . . 10.0 109.983 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 36.4 m -115.43 118.84 34.34 Favored 'General case' 0 N--CA 1.445 -0.709 0 O-C-N 125.991 2.057 . . . . 10.0 113.21 179.457 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -99.58 155.02 17.81 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 105.195 -2.15 . . . . 10.0 105.195 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 25.0 mtmt -145.54 159.29 43.32 Favored 'General case' 0 CA--C 1.507 -0.677 0 O-C-N 120.999 -1.063 . . . . 10.0 110.88 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -140.19 125.36 18.68 Favored 'General case' 0 C--N 1.321 -0.636 0 O-C-N 125.45 1.719 . . . . 10.0 108.235 -179.67 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 2.5 t -85.66 108.31 17.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 N-CA-C 105.873 -1.899 . . . . 10.0 105.873 179.561 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 130' ' ' PHE . . . . . 0.422 ' HB2' ' HB3' ' A' ' 115' ' ' LEU . 3.9 m-85 -86.06 151.98 23.26 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 115.631 -0.713 . . . . 10.0 110.781 -179.741 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 17.6 tptt -130.31 85.72 2.32 Favored 'General case' 0 C--N 1.321 -0.651 0 O-C-N 126.854 2.596 . . . . 10.0 108.991 -179.768 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.47 104.54 0.13 Allowed 'General case' 0 C--O 1.235 0.341 0 O-C-N 125.723 1.889 . . . . 10.0 109.837 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 133' ' ' VAL . . . . . 0.692 HG12 ' O ' ' A' ' 7' ' ' TYR . 1.4 p -73.88 -24.67 19.76 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.492 0 C-N-CA 118.593 -1.243 . . . . 10.0 110.662 179.599 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 35.1 t-80 . . . . . 0 N--CA 1.441 -0.913 0 CA-C-O 115.871 -2.014 . . . . 10.0 110.814 -179.853 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo . . . . . 0 N--CA 1.485 0.986 0 CA-C-O 122.851 1.105 . . . . 10.0 113.769 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -137.26 169.49 19.41 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 O-C-N 119.46 -2.025 . . . . 10.0 109.773 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.06 -73.01 0.15 Allowed 'General case' 0 N--CA 1.443 -0.793 0 N-CA-C 112.742 0.645 . . . . 10.0 112.742 -179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 62.8 -73.2 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 O-C-N 125.469 1.73 . . . . 10.0 111.99 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -35.32 111.17 0.12 Allowed 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.457 1.503 . . . . 10.0 113.04 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -157.23 -140.7 3.0 Favored Glycine 0 N--CA 1.445 -0.7 0 C-N-CA 118.861 -1.638 . . . . 10.0 114.069 179.56 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 93.1 m-85 -160.36 65.8 0.33 Allowed 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 104.499 -2.408 . . . . 10.0 104.499 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.589 ' CD2' ' CD1' ' A' ' 115' ' ' LEU . 8.5 m0 -68.03 105.95 2.2 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 118.34 -1.344 . . . . 10.0 108.464 179.715 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.403 ' HG2' ' HB ' ' A' ' 133' ' ' VAL . 4.5 pttp -81.93 12.27 4.25 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 117.196 -1.383 . . . . 10.0 110.666 -179.763 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.477 ' HG2' ' N ' ' A' ' 11' ' ' LEU . 0.0 OUTLIER 62.94 140.26 0.02 OUTLIER 'General case' 0 C--N 1.311 -1.084 0 CA-C-O 124.199 1.952 . . . . 10.0 116.15 179.58 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.574 HD12 ' HB2' ' A' ' 131' ' ' LYS . 4.1 tt -108.83 -50.15 3.05 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 120.306 -1.496 . . . . 10.0 108.967 -179.847 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -174.15 157.6 2.87 Favored 'General case' 0 C--O 1.241 0.632 0 C-N-CA 119.544 -0.863 . . . . 10.0 112.773 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -116.2 161.0 19.61 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 127.205 2.202 . . . . 10.0 107.402 -179.711 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 -123.39 -89.39 0.59 Allowed 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 114.218 1.192 . . . . 10.0 114.218 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -80.61 46.82 0.89 Allowed 'General case' 0 N--CA 1.469 0.512 0 O-C-N 124.572 1.17 . . . . 10.0 113.271 -179.701 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -66.36 -36.76 83.69 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 113.85 1.056 . . . . 10.0 113.85 179.555 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -76.55 -32.93 58.5 Favored 'General case' 0 CA--C 1.515 -0.397 0 O-C-N 118.783 -2.448 . . . . 10.0 111.423 179.81 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -79.61 -24.74 41.76 Favored 'General case' 0 C--O 1.219 -0.502 0 N-CA-C 107.165 -1.421 . . . . 10.0 107.165 179.796 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.575 ' HA ' HG11 ' A' ' 124' ' ' VAL . 42.4 t80 -68.16 -41.12 82.0 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-O 117.44 -1.267 . . . . 10.0 110.848 -179.82 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.421 HD12 ' HG2' ' A' ' 30' ' ' ARG . 84.5 mt -78.35 -21.89 48.8 Favored 'General case' 0 C--O 1.214 -0.769 0 CA-C-O 123.69 1.71 . . . . 10.0 112.747 -179.909 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.411 ' CZ ' ' HA ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -66.25 -42.61 88.31 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 113.66 -1.609 . . . . 10.0 108.415 -179.774 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.57 -21.54 65.43 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 126.17 1.788 . . . . 10.0 110.795 -179.861 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.512 HD21 ' NH2' ' A' ' 104' ' ' ARG . 35.3 mt -95.78 -9.55 31.39 Favored 'General case' 0 C--O 1.241 0.622 0 C-N-CA 124.746 1.218 . . . . 10.0 108.981 179.79 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 62.59 38.57 12.21 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-O 116.697 -1.62 . . . . 10.0 112.086 179.866 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.935 HG11 HD22 ' A' ' 29' ' ' LEU . 2.1 t -91.18 154.33 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.82 0 N-CA-C 107.421 -1.326 . . . . 10.0 107.421 179.547 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.26 0.0 OUTLIER -58.08 163.17 2.96 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 127.071 2.732 . . . . 10.0 116.948 -179.687 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 68.9 t -71.97 -26.32 25.21 Favored 'Isoleucine or valine' 0 C--O 1.236 0.372 0 N-CA-C 113.964 1.098 . . . . 10.0 113.964 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.88 -38.16 76.29 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 123.615 0.766 . . . . 10.0 111.105 179.394 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.935 HD22 HG11 ' A' ' 25' ' ' VAL . 8.1 tt -79.32 -24.17 42.98 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 122.373 1.082 . . . . 10.0 108.562 179.448 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.421 ' HG2' HD12 ' A' ' 20' ' ' LEU . 0.2 OUTLIER -78.78 -41.92 29.27 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 114.837 -1.074 . . . . 10.0 108.881 179.787 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.4 tttt -63.76 -48.31 77.49 Favored 'General case' 0 N--CA 1.442 -0.865 0 C-N-CA 125.135 1.374 . . . . 10.0 113.504 -179.524 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 11.8 mm -72.37 -38.06 59.85 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.575 0 O-C-N 119.707 -1.871 . . . . 10.0 113.783 -179.872 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -68.15 -37.52 81.14 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 115.835 1.791 . . . . 10.0 115.835 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -57.98 -31.38 66.86 Favored 'General case' 0 C--O 1.216 -0.71 0 N-CA-C 115.075 1.509 . . . . 10.0 115.075 -179.806 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 40.4 mt -81.31 -25.32 36.56 Favored 'General case' 0 C--O 1.217 -0.647 0 CA-C-O 122.172 0.987 . . . . 10.0 113.553 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 11.6 mt -96.58 157.79 15.74 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.572 -0.74 . . . . 10.0 112.866 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 30.1 mttm -145.74 146.02 27.58 Favored Pre-proline 0 N--CA 1.48 1.039 0 N-CA-C 102.422 -3.177 . . . . 10.0 102.422 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 0.1 OUTLIER -100.46 -172.24 0.11 Allowed 'Trans proline' 0 CA--C 1.543 0.952 0 C-N-CA 122.636 2.224 . . . . 10.0 117.427 -179.785 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -142.96 136.69 28.78 Favored 'General case' 0 C--N 1.315 -0.921 0 O-C-N 127.54 3.025 . . . . 10.0 104.329 179.57 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.518 ' HB2' ' CE2' ' A' ' 130' ' ' PHE . 0.1 OUTLIER -119.58 112.13 18.95 Favored 'General case' 0 N--CA 1.438 -1.051 0 C-N-CA 119.417 -0.913 . . . . 10.0 112.503 -179.933 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -105.4 132.04 52.08 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 102.162 -3.273 . . . . 10.0 102.162 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.527 HG13 ' CH2' ' A' ' 8' ' ' TRP . 0.9 OUTLIER -115.01 161.97 13.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 118.554 0.616 . . . . 10.0 110.274 -179.918 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.607 HG12 HD12 ' A' ' 50' ' ' ILE . 2.6 t -144.5 123.17 6.33 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.854 0 N-CA-C 105.412 -2.07 . . . . 10.0 105.412 179.958 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 12.0 tt0 -119.9 104.2 9.98 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 122.739 1.257 . . . . 10.0 111.584 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -99.69 86.16 3.27 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 104.498 -2.408 . . . . 10.0 104.498 -179.85 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 70.03 -112.41 4.37 Favored Glycine 0 C--N 1.34 0.803 0 N-CA-C 106.684 -2.566 . . . . 10.0 106.684 -179.684 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -107.17 -12.35 15.41 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 119.811 -0.756 . . . . 10.0 110.154 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 13.2 m170 -74.42 109.48 7.93 Favored 'General case' 0 N--CA 1.445 -0.723 0 O-C-N 120.88 -1.137 . . . . 10.0 109.043 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.539 ' HG2' HD13 ' A' ' 51' ' ' ILE . 2.8 ttt -87.84 140.02 29.93 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 114.395 1.257 . . . . 10.0 114.395 -179.876 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.607 HD12 HG12 ' A' ' 43' ' ' VAL . 6.9 mt -134.99 110.8 12.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 N-CA-C 102.913 -2.995 . . . . 10.0 102.913 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.539 HD13 ' HG2' ' A' ' 49' ' ' MET . 0.3 OUTLIER -100.69 132.96 45.37 Favored 'Isoleucine or valine' 0 C--O 1.241 0.612 0 N-CA-C 106.472 -1.677 . . . . 10.0 106.472 179.98 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.427 ' CZ ' ' HB3' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -135.16 88.44 2.42 Favored 'General case' 0 N--CA 1.438 -1.025 0 O-C-N 125.377 1.673 . . . . 10.0 110.426 179.695 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 24.3 m -80.2 112.75 17.82 Favored 'General case' 0 C--N 1.318 -0.78 1 N-CA-C 99.913 -4.106 . . . . 10.0 99.913 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.1 mt -78.85 61.91 3.2 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 117.317 2.34 . . . . 10.0 117.317 -179.863 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.7 m -90.61 84.6 5.93 Favored 'General case' 0 C--O 1.242 0.698 0 CA-C-N 112.143 -2.299 . . . . 10.0 106.044 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -66.36 111.03 3.31 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 106.248 -1.76 . . . . 10.0 106.248 179.814 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 68.8 t80 153.89 -62.34 0.0 OUTLIER 'General case' 0 C--O 1.241 0.646 0 O-C-N 128.06 3.35 . . . . 10.0 105.14 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 10.2 tpp180 -152.52 75.52 1.11 Allowed 'General case' 0 N--CA 1.444 -0.727 0 O-C-N 125.195 1.559 . . . . 10.0 110.072 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -63.13 177.84 0.56 Allowed 'General case' 0 CA--C 1.541 0.606 0 O-C-N 126.162 2.163 . . . . 10.0 114.053 -179.759 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 49.6 m-85 -102.25 -132.76 0.29 Allowed 'General case' 0 C--N 1.308 -1.196 0 O-C-N 128.613 3.696 . . . . 10.0 101.24 179.349 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 6.7 mt 108.56 122.33 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.3 -1.561 0 O-C-N 128.48 3.612 . . . . 10.0 111.306 179.548 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.409 ' CE ' ' HG2' ' A' ' 72' ' ' GLU . 4.6 mmt -150.69 170.07 20.09 Favored 'General case' 0 CA--C 1.532 0.275 0 O-C-N 127.555 3.034 . . . . 10.0 104.376 -179.567 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -134.62 63.85 1.61 Allowed 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 101.459 -3.534 . . . . 10.0 101.459 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.403 ' O ' ' N ' ' A' ' 49' ' ' MET . 1.5 m-30 -65.11 165.68 10.82 Favored 'General case' 0 C--N 1.342 0.256 0 N-CA-C 116.908 2.188 . . . . 10.0 116.908 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 63.3 mt-30 -136.06 125.01 24.18 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 106.208 -1.775 . . . . 10.0 106.208 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.458 ' HA ' ' CG1' ' A' ' 86' ' ' VAL . 0.9 OUTLIER -69.41 134.9 29.38 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 CA-C-O 123.092 1.425 . . . . 10.0 112.291 -179.644 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.58 -16.33 41.16 Favored Glycine 0 N--CA 1.439 -1.135 0 O-C-N 120.002 -1.686 . . . . 10.0 114.307 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 4.1 mttp -91.42 132.33 36.29 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 122.433 1.111 . . . . 10.0 111.815 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -74.55 125.26 28.24 Favored 'General case' 0 CA--C 1.53 0.179 0 O-C-N 120.977 -1.077 . . . . 10.0 109.689 -179.877 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -121.0 -167.11 1.43 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.187 -0.46 . . . . 10.0 110.83 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -156.75 116.41 3.49 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-O 121.877 0.846 . . . . 10.0 109.408 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.409 ' HG2' ' CE ' ' A' ' 62' ' ' MET . 32.8 mt-10 -79.01 108.37 12.45 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 118.146 -1.421 . . . . 10.0 114.446 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -61.37 -29.7 70.07 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 124.889 1.368 . . . . 10.0 111.404 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 68.43 -78.38 0.04 OUTLIER 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 116.022 1.86 . . . . 10.0 116.022 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 1.7 m 15.68 82.65 0.01 OUTLIER 'General case' 0 C--N 1.313 -0.993 1 O-C-N 129.704 4.377 . . . . 10.0 111.601 -179.649 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 179.78 -57.38 0.08 OUTLIER Glycine 0 N--CA 1.438 -1.204 0 CA-C-O 117.122 -1.932 . . . . 10.0 110.37 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.1 mt -118.34 106.4 19.61 Favored 'Isoleucine or valine' 0 C--O 1.242 0.683 0 N-CA-C 104.135 -2.543 . . . . 10.0 104.135 -179.819 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.47 ' HB2' HG23 ' A' ' 25' ' ' VAL . 0.0 OUTLIER 82.33 -51.08 0.21 Allowed 'General case' 0 CA--C 1.54 0.573 0 O-C-N 125.734 1.896 . . . . 10.0 112.293 179.881 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 74.55 102.43 0.07 Allowed 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 116.09 1.885 . . . . 10.0 116.09 179.857 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 18.0 ttp85 -163.64 121.93 1.92 Allowed 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 122.159 0.98 . . . . 10.0 109.818 179.739 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.16 152.39 30.75 Favored 'General case' 0 CA--C 1.508 -0.665 0 N-CA-C 103.424 -2.806 . . . . 10.0 103.424 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 2.8 m -143.17 -168.55 2.83 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 124.145 0.978 . . . . 10.0 108.593 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 9.1 mmm -133.14 97.56 4.03 Favored 'General case' 0 C--N 1.315 -0.9 1 N-CA-C 98.333 -4.691 . . . . 10.0 98.333 179.674 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.2 m -108.93 131.71 54.77 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 116.937 2.199 . . . . 10.0 116.937 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 3.2 m -123.85 131.49 53.59 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 104.76 -2.311 . . . . 10.0 104.76 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.507 HG22 HD11 ' A' ' 93' ' ' LEU . 0.3 OUTLIER -98.86 150.35 5.03 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.999 0 N-CA-C 101.379 -3.563 . . . . 10.0 101.379 179.778 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.411 ' O ' HD22 ' A' ' 93' ' ' LEU . 3.3 m -157.4 160.23 38.18 Favored 'General case' 0 C--N 1.319 -0.75 0 O-C-N 125.564 1.79 . . . . 10.0 114.798 -179.82 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 7.6 p90 -118.3 136.23 53.82 Favored 'General case' 0 N--CA 1.465 0.311 0 O-C-N 124.083 0.864 . . . . 10.0 109.097 -179.69 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -101.33 -57.9 1.99 Allowed 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 103.075 -2.935 . . . . 10.0 103.075 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -155.3 -120.84 0.72 Allowed Glycine 0 N--CA 1.434 -1.441 0 N-CA-C 105.18 -3.168 . . . . 10.0 105.18 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -70.42 -18.37 63.01 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 118.971 1.386 . . . . 10.0 110.565 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.404 ' HB2' ' HE3' ' A' ' 92' ' ' LYS . 9.0 mtmt -88.41 -174.36 4.57 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 106.796 -1.557 . . . . 10.0 106.796 -179.802 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.507 HD11 HG22 ' A' ' 86' ' ' VAL . 1.2 tm? -151.18 124.83 9.03 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 104.698 -2.334 . . . . 10.0 104.698 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' GLN . . . . . 0.427 ' N ' HD13 ' A' ' 93' ' ' LEU . 8.9 mm-40 -111.52 160.68 16.93 Favored 'General case' 0 CA--C 1.502 -0.872 0 CA-C-N 113.51 -1.677 . . . . 10.0 113.914 -179.797 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 4.2 t -140.78 135.45 31.5 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 118.29 -0.862 . . . . 10.0 109.453 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 44.3 t -119.92 91.34 1.8 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.74 0 O-C-N 126.941 2.651 . . . . 10.0 106.919 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -91.94 72.24 5.61 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 123.901 1.81 . . . . 10.0 112.306 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 31.1 tttp -71.82 90.96 1.12 Allowed 'General case' 0 C--O 1.225 -0.23 0 O-C-N 120.194 -1.566 . . . . 10.0 109.409 179.588 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -139.83 82.17 0.25 Allowed Glycine 0 C--O 1.226 -0.396 0 N-CA-C 108.258 -1.937 . . . . 10.0 108.258 -179.703 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 59.12 178.36 0.08 Allowed 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 114.791 1.404 . . . . 10.0 114.791 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 37.5 mttt 55.26 175.24 0.03 OUTLIER 'General case' 0 C--O 1.24 0.563 0 N-CA-C 116.241 1.941 . . . . 10.0 116.241 179.813 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -107.12 116.65 32.29 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 126.383 1.873 . . . . 10.0 108.493 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 90.32 66.48 1.2 Allowed Glycine 0 C--O 1.224 -0.495 0 N-CA-C 116.22 1.248 . . . . 10.0 116.22 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.512 ' NH2' HD21 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -130.78 136.43 48.71 Favored 'General case' 0 N--CA 1.444 -0.749 0 O-C-N 124.356 0.68 . . . . 10.0 111.489 -179.895 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 143.66 163.31 9.8 Favored Glycine 0 N--CA 1.441 -0.972 0 O-C-N 126.411 2.32 . . . . 10.0 108.636 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 32.0 m0 -119.81 174.37 6.48 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 119.053 1.426 . . . . 10.0 112.43 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' THR . . . . . 0.498 ' O ' HD12 ' A' ' 117' ' ' LEU . 16.0 m -151.64 128.33 10.84 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 109.561 -0.533 . . . . 10.0 109.561 179.894 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.551 ' NE2' HD13 ' A' ' 117' ' ' LEU . 59.8 mm-40 -106.44 156.6 18.37 Favored 'General case' 0 C--N 1.319 -0.729 0 O-C-N 125.95 2.031 . . . . 10.0 111.346 -179.897 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 1.5 t90 -171.98 119.3 0.42 Allowed 'General case' 0 N--CA 1.478 0.953 0 CA-C-O 123.297 1.523 . . . . 10.0 106.978 -179.875 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 60.6 mt -98.7 152.06 4.43 Favored 'Isoleucine or valine' 0 C--O 1.241 0.647 0 N-CA-C 117.367 2.358 . . . . 10.0 117.367 -179.752 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -130.15 -168.67 2.0 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 103.391 -2.818 . . . . 10.0 103.391 -179.78 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -68.0 -59.15 6.67 Favored Glycine 0 N--CA 1.469 0.856 0 O-C-N 120.678 -1.264 . . . . 10.0 110.035 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.429 ' HA ' ' HG2' ' A' ' 132' ' ' LYS . 0.1 OUTLIER -117.8 9.63 13.01 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 119.655 1.727 . . . . 10.0 113.292 179.719 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -128.53 -159.75 0.97 Allowed 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 115.618 1.71 . . . . 10.0 115.618 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.589 ' CD1' ' CD2' ' A' ' 8' ' ' TRP . 0.4 OUTLIER -171.86 134.53 0.79 Allowed 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 106.451 -1.685 . . . . 10.0 106.451 179.904 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -117.38 86.64 2.55 Favored 'General case' 0 C--O 1.236 0.372 0 O-C-N 125.044 1.465 . . . . 10.0 109.41 -179.913 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.551 HD13 ' NE2' ' A' ' 108' ' ' GLN . 1.5 tp -95.26 148.0 22.87 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.059 -1.089 . . . . 10.0 108.059 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -127.12 157.22 40.27 Favored 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 106.924 -1.51 . . . . 10.0 106.924 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 18.9 mtm -142.68 114.42 8.07 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 123.715 1.721 . . . . 10.0 108.694 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 5.9 ttp180 -104.64 129.8 52.74 Favored 'General case' 0 CA--C 1.506 -0.734 0 CA-C-O 122.37 1.081 . . . . 10.0 112.9 179.405 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -148.39 118.87 7.4 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 114.423 -1.262 . . . . 10.0 107.799 -179.709 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 37.68 47.45 0.82 Allowed 'General case' 0 C--O 1.243 0.76 0 O-C-N 126.626 2.454 . . . . 10.0 117.344 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 91.06 -4.26 81.15 Favored Glycine 0 C--N 1.337 0.585 0 C-N-CA 119.022 -1.561 . . . . 10.0 114.011 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.575 HG11 ' HA ' ' A' ' 19' ' ' TYR . 0.3 OUTLIER -96.95 151.62 4.11 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.514 0 N-CA-C 107.624 -1.25 . . . . 10.0 107.624 179.695 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 2.9 m -134.66 102.54 5.32 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 113.954 -1.475 . . . . 10.0 111.875 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -115.1 134.41 55.19 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 105.844 -1.91 . . . . 10.0 105.844 179.892 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 14.0 mtmm -127.3 125.13 40.31 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 115.444 1.646 . . . . 10.0 115.444 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 1.2 mm100 -99.21 113.52 25.83 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-N 114.389 -1.278 . . . . 10.0 109.697 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 8.0 t -96.74 127.25 49.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 N-CA-C 104.666 -2.346 . . . . 10.0 104.666 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 130' ' ' PHE . . . . . 0.518 ' CE2' ' HB2' ' A' ' 40' ' ' LYS . 8.1 m-30 -110.25 144.67 38.59 Favored 'General case' 0 N--CA 1.441 -0.891 0 C-N-CA 124.188 0.995 . . . . 10.0 112.678 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.574 ' HB2' HD12 ' A' ' 11' ' ' LEU . 6.3 tptm -127.72 92.4 3.48 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 105.765 -1.939 . . . . 10.0 105.765 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 132' ' ' LYS . . . . . 0.429 ' HG2' ' HA ' ' A' ' 113' ' ' ASP . 11.0 ptpt -53.38 129.85 33.33 Favored 'General case' 0 CA--C 1.503 -0.83 0 CA-C-O 125.736 2.684 . . . . 10.0 111.259 -179.714 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 133' ' ' VAL . . . . . 0.413 ' O ' HG13 ' A' ' 133' ' ' VAL . 0.3 OUTLIER -83.7 -3.0 7.27 Favored 'Isoleucine or valine' 0 C--O 1.236 0.342 0 O-C-N 120.041 -1.662 . . . . 10.0 111.69 -179.92 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 . . . . . 0 C--N 1.314 -0.937 0 O-C-N 125.47 1.731 . . . . 10.0 110.684 179.928 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo . . . . . 0 N--CA 1.482 0.81 0 CA-C-O 117.03 -1.321 . . . . 10.0 112.307 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.534 HG22 ' O ' ' A' ' 2' ' ' VAL . 5.2 p 23.97 59.64 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 O-C-N 127.828 3.205 . . . . 10.0 113.503 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 43.1 p-10 -117.85 55.66 0.87 Allowed 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 124.26 1.981 . . . . 10.0 109.286 -179.842 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 41.9 m-85 -54.05 -13.51 0.82 Allowed 'General case' 0 C--O 1.242 0.662 0 CA-C-O 116.616 -1.659 . . . . 10.0 114.568 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -53.92 131.32 39.92 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-O 124.34 2.019 . . . . 10.0 113.793 179.623 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 155.14 165.0 13.58 Favored Glycine 0 CA--C 1.528 0.902 0 O-C-N 119.778 -1.826 . . . . 10.0 114.002 179.809 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.505 ' HA ' ' HA ' ' A' ' 41' ' ' GLU . 1.9 m-30 -104.73 121.78 44.31 Favored 'General case' 0 C--O 1.243 0.755 0 CA-C-O 116.565 -1.683 . . . . 10.0 106.756 179.61 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.769 ' CE2' ' HB2' ' A' ' 40' ' ' LYS . 1.1 p-90 -113.59 145.88 40.58 Favored 'General case' 0 N--CA 1.44 -0.955 0 CA-C-O 123.37 1.557 . . . . 10.0 115.042 179.601 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.5 ptpp? -121.85 120.0 33.24 Favored 'General case' 0 N--CA 1.437 -1.097 0 N-CA-C 105.16 -2.163 . . . . 10.0 105.16 -179.422 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.517 ' HB3' ' CZ3' ' A' ' 8' ' ' TRP . 6.7 ptm -68.66 142.14 55.16 Favored 'General case' 0 CA--C 1.506 -0.727 0 O-C-N 118.834 -2.416 . . . . 10.0 115.697 -179.596 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 12.1 tp -97.75 -33.88 11.11 Favored 'General case' 0 CA--C 1.508 -0.652 0 O-C-N 120.303 -1.498 . . . . 10.0 109.609 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -152.57 152.08 31.42 Favored 'General case' 0 CA--C 1.515 -0.399 0 N-CA-C 115.388 1.625 . . . . 10.0 115.388 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -134.9 132.6 38.7 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 106.807 -1.553 . . . . 10.0 106.807 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -132.29 162.59 30.63 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 119.249 0.931 . . . . 10.0 113.023 179.693 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 2.7 m120 37.65 25.81 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.472 0 O-C-N 126.918 2.636 . . . . 10.0 116.851 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -65.35 -31.99 73.4 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 118.862 -2.399 . . . . 10.0 114.218 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -65.77 -41.82 91.59 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 115.437 1.643 . . . . 10.0 115.437 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -79.82 -22.08 43.46 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 107.007 -1.479 . . . . 10.0 107.007 179.666 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.561 ' CZ ' HD11 ' A' ' 23' ' ' LEU . 2.9 t80 -66.84 -36.94 83.49 Favored 'General case' 0 CA--C 1.55 0.958 0 O-C-N 121.023 -1.048 . . . . 10.0 111.137 -179.582 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 20.5 mt -71.69 -39.18 70.38 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 125.356 1.462 . . . . 10.0 111.015 179.82 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 22.4 ttp180 -71.84 -28.18 63.38 Favored 'General case' 0 C--O 1.244 0.806 0 O-C-N 124.859 1.349 . . . . 10.0 110.704 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.36 -42.97 95.94 Favored 'General case' 0 C--O 1.212 -0.873 0 C-N-CA 124.266 1.026 . . . . 10.0 113.652 -179.814 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.561 HD11 ' CZ ' ' A' ' 19' ' ' TYR . 0.3 OUTLIER -91.84 -22.97 19.83 Favored 'General case' 0 C--N 1.345 0.374 0 CA-C-O 122.216 1.008 . . . . 10.0 113.461 -179.966 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.6 t0 66.29 70.55 0.41 Allowed 'General case' 0 N--CA 1.481 1.078 0 O-C-N 119.644 -1.91 . . . . 10.0 112.173 179.423 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.502 HG21 HD22 ' A' ' 29' ' ' LEU . 0.2 OUTLIER -93.34 -51.35 11.31 Favored 'Isoleucine or valine' 0 C--O 1.242 0.675 0 N-CA-C 106.337 -1.727 . . . . 10.0 106.337 -179.822 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 177.92 152.26 0.27 Allowed 'General case' 0 C--O 1.243 0.749 0 N-CA-C 116.788 2.144 . . . . 10.0 116.788 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.41 ' CG1' ' N ' ' A' ' 28' ' ' ALA . 0.3 OUTLIER -74.53 -37.76 44.62 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 C-N-CA 125.464 1.505 . . . . 10.0 113.75 -179.601 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.41 ' N ' ' CG1' ' A' ' 27' ' ' VAL . . . -76.4 -31.79 58.16 Favored 'General case' 0 C--N 1.319 -0.729 0 O-C-N 126.147 2.154 . . . . 10.0 112.959 179.896 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.502 HD22 HG21 ' A' ' 25' ' ' VAL . 2.1 tp -68.28 -29.57 68.39 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.9 0.704 . . . . 10.0 112.9 179.794 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.41 -30.5 70.28 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 113.307 0.855 . . . . 10.0 113.307 -179.803 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.62 -37.89 41.12 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 113.242 -1.799 . . . . 10.0 110.289 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.543 HD13 ' CZ ' ' A' ' 57' ' ' PHE . 48.1 mt -77.37 -48.38 24.63 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 O-C-N 119.746 -1.846 . . . . 10.0 112.821 -179.387 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -55.8 -33.91 64.84 Favored 'General case' 0 C--O 1.216 -0.692 0 CA-C-O 117.699 -1.143 . . . . 10.0 113.799 179.8 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 22.3 m-20 -69.39 -9.57 54.11 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 115.078 1.51 . . . . 10.0 115.078 179.892 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.5 mt -104.57 14.17 30.39 Favored 'General case' 0 C--N 1.315 -0.907 0 O-C-N 124.973 1.421 . . . . 10.0 111.188 179.825 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -128.85 147.76 50.84 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.095 0.958 . . . . 10.0 110.572 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 4.6 mttt -129.88 73.35 81.51 Favored Pre-proline 0 C--O 1.218 -0.562 0 N-CA-C 106.27 -1.752 . . . . 10.0 106.27 -179.816 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 9.0 Cg_endo -52.93 128.52 29.15 Favored 'Trans proline' 0 N--CA 1.451 -1.004 0 O-C-N 125.418 2.272 . . . . 10.0 116.104 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -106.48 142.53 35.99 Favored 'General case' 0 C--N 1.316 -0.854 0 O-C-N 128.458 3.599 . . . . 10.0 104.724 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.769 ' HB2' ' CE2' ' A' ' 8' ' ' TRP . 1.4 ttmt -112.6 177.79 4.51 Favored 'General case' 0 C--O 1.21 -0.991 0 O-C-N 124.796 1.31 . . . . 10.0 112.262 -179.601 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.505 ' HA ' ' HA ' ' A' ' 7' ' ' TYR . 2.2 tt0 -158.26 120.7 3.71 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 104.887 -2.264 . . . . 10.0 104.887 -179.479 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 19.0 mm -103.14 152.6 5.89 Favored 'Isoleucine or valine' 0 C--O 1.242 0.69 0 O-C-N 125.555 1.785 . . . . 10.0 112.622 179.648 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 62.4 t -154.25 98.72 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 CA-C-N 113.369 -1.741 . . . . 10.0 108.538 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -98.61 118.61 35.7 Favored 'General case' 0 C--N 1.311 -1.068 0 C-N-CA 125.056 1.342 . . . . 10.0 107.532 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -93.58 18.76 9.46 Favored 'General case' 0 C--O 1.24 0.587 0 CA-C-O 117.429 -1.272 . . . . 10.0 108.032 -179.82 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 113.77 -100.28 1.04 Allowed Glycine 0 CA--C 1.523 0.536 0 N-CA-C 107.634 -2.187 . . . . 10.0 107.634 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.423 ' HA ' HG12 ' A' ' 66' ' ' VAL . 0.0 OUTLIER -86.1 -29.04 23.65 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 121.493 -1.004 . . . . 10.0 109.322 179.854 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -95.78 121.79 37.88 Favored 'General case' 0 CA--C 1.509 -0.609 0 N-CA-C 107.777 -1.194 . . . . 10.0 107.777 179.834 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 9.0 ttt -114.64 124.2 51.22 Favored 'General case' 0 CA--C 1.504 -0.827 0 CA-C-O 123.102 1.43 . . . . 10.0 112.285 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.484 ' C ' HD13 ' A' ' 51' ' ' ILE . 30.7 mm -108.81 122.05 62.83 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.29 0 N-CA-C 107.393 -1.336 . . . . 10.0 107.393 -179.764 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.53 ' N ' HD13 ' A' ' 51' ' ' ILE . 1.5 mm -107.87 135.97 44.78 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 N-CA-C 105.253 -2.129 . . . . 10.0 105.253 179.881 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 12.7 mtm-85 -133.7 122.58 23.6 Favored 'General case' 0 CA--C 1.51 -0.582 0 C-N-CA 119.978 -0.689 . . . . 10.0 112.361 -179.833 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 58.3 m -98.42 129.38 45.05 Favored 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 102.492 -3.151 . . . . 10.0 102.492 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 8.8 mt -117.71 54.24 0.91 Allowed 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 119.398 3.111 . . . . 10.0 119.398 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 60.6 p -73.54 -172.75 1.27 Allowed 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 103.864 -2.643 . . . . 10.0 103.864 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 8.0 p -120.56 -13.42 8.78 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-O 118.667 -0.682 . . . . 10.0 111.973 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.543 ' CZ ' HD13 ' A' ' 32' ' ' ILE . 19.5 t80 -81.16 -46.38 14.97 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.36 -0.978 . . . . 10.0 108.36 -179.928 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.37 143.21 16.25 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-O 123.906 1.813 . . . . 10.0 112.879 -179.856 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -87.82 142.84 27.49 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 114.067 -1.424 . . . . 10.0 107.964 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.404 ' C ' HD13 ' A' ' 61' ' ' ILE . 1.9 t80 -149.87 118.48 6.54 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 126.689 2.493 . . . . 10.0 105.206 -179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.445 HG22 ' H ' ' A' ' 62' ' ' MET . 0.0 OUTLIER -109.44 -175.13 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.313 -1.006 0 O-C-N 124.943 1.402 . . . . 10.0 112.598 179.92 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.445 ' H ' HG22 ' A' ' 61' ' ' ILE . 2.3 mtm -143.21 -179.58 6.48 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 106.931 -1.507 . . . . 10.0 106.931 -179.772 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 64.7 t0 -162.12 80.92 0.55 Allowed 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 102.889 -3.004 . . . . 10.0 102.889 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 2.0 m-30 -88.67 166.15 14.29 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 125.2 1.562 . . . . 10.0 112.207 179.865 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.409 ' O ' HG13 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -144.25 126.0 15.17 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 103.8 -2.667 . . . . 10.0 103.8 179.988 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.423 HG12 ' HA ' ' A' ' 47' ' ' ASP . 2.0 p -89.88 133.8 30.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 O-C-N 124.658 1.224 . . . . 10.0 108.453 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 91.1 -12.3 69.56 Favored Glycine 0 C--O 1.219 -0.811 0 C-N-CA 120.168 -1.015 . . . . 10.0 115.251 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.2 mttm -109.3 -173.19 2.21 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 117.44 0.62 . . . . 10.0 112.359 179.844 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -131.32 139.93 49.65 Favored 'General case' 0 C--N 1.314 -0.94 0 O-C-N 125.223 1.577 . . . . 10.0 107.533 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 10.5 p90 -154.5 135.33 13.68 Favored 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 118.597 -1.241 . . . . 10.0 110.173 179.877 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.13 155.86 22.4 Favored 'General case' 0 C--O 1.222 -0.393 0 N-CA-C 106.316 -1.735 . . . . 10.0 106.316 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -156.24 116.76 3.71 Favored 'General case' 0 N--CA 1.438 -1.071 0 N-CA-C 117.614 2.45 . . . . 10.0 117.614 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 -83.29 91.65 7.34 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 105.236 -2.135 . . . . 10.0 105.236 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 13.0 mt -62.15 3.43 0.17 Allowed 'General case' 0 N--CA 1.438 -1.068 0 N-CA-C 117.88 2.548 . . . . 10.0 117.88 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.408 HG23 ' H ' ' A' ' 75' ' ' THR . 50.8 p -41.97 109.65 0.14 Allowed 'General case' 0 C--O 1.24 0.575 0 O-C-N 125.76 1.913 . . . . 10.0 108.98 179.699 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' GLY . . . . . 0.728 ' C ' HD13 ' A' ' 77' ' ' ILE . . . 134.9 -30.25 2.86 Favored Glycine 0 CA--C 1.525 0.706 0 CA-C-N 113.21 -1.813 . . . . 10.0 109.8 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.728 HD13 ' C ' ' A' ' 76' ' ' GLY . 2.5 mm -128.3 -17.1 2.36 Favored 'Isoleucine or valine' 0 C--O 1.247 0.938 0 CA-C-N 117.774 0.787 . . . . 10.0 111.43 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -144.44 -40.49 0.27 Allowed 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 117.641 -1.171 . . . . 10.0 113.195 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 93.53 -23.22 0.06 Allowed 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 126.987 2.115 . . . . 10.0 113.651 -179.824 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -94.7 166.71 11.87 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 117.367 -1.301 . . . . 10.0 112.932 -179.758 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.86 168.57 12.59 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 103.143 -2.91 . . . . 10.0 103.143 -179.919 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -153.06 -170.83 3.74 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 113.914 -1.494 . . . . 10.0 110.282 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.6 mmt -119.98 49.36 1.41 Allowed 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 101.387 -3.56 . . . . 10.0 101.387 179.772 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 42.3 m -44.93 104.23 0.04 OUTLIER 'General case' 0 N--CA 1.439 -1.003 0 N-CA-C 119.243 3.053 . . . . 10.0 119.243 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 22.7 m -102.34 133.99 46.37 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 105.359 -2.089 . . . . 10.0 105.359 -179.92 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.409 HG13 ' O ' ' A' ' 65' ' ' GLN . 0.2 OUTLIER -117.57 109.87 28.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 102.956 -2.979 . . . . 10.0 102.956 -179.828 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 17.3 m -104.05 166.42 10.42 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 115.888 -0.596 . . . . 10.0 111.484 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 11.5 p-90 -126.61 55.09 1.55 Allowed 'General case' 0 CA--C 1.511 -0.544 0 CA-C-O 125.027 2.346 . . . . 10.0 109.991 -179.744 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -66.4 109.25 2.65 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 101.343 -3.577 . . . . 10.0 101.343 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 81.93 -154.4 33.78 Favored Glycine 0 N--CA 1.446 -0.696 0 N-CA-C 108.273 -1.931 . . . . 10.0 108.273 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -103.46 42.42 1.17 Allowed 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 123.073 1.416 . . . . 10.0 109.846 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 7.2 mtmt -122.27 -166.16 1.37 Allowed 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 113.195 -1.821 . . . . 10.0 108.228 179.82 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 5.2 tt -141.33 102.57 4.25 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 105.573 -2.01 . . . . 10.0 105.573 -179.835 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -113.77 118.99 35.83 Favored 'General case' 0 CA--C 1.507 -0.674 0 O-C-N 120.81 -1.181 . . . . 10.0 112.84 179.9 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 19.9 p -127.51 148.41 50.32 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 112.828 0.677 . . . . 10.0 112.828 179.901 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 88.9 t -126.33 125.75 68.09 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.75 0 N-CA-C 106.399 -1.704 . . . . 10.0 106.399 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 59.3 mt-30 -107.84 57.96 0.62 Allowed 'General case' 0 C--N 1.317 -0.822 0 O-C-N 126.654 2.471 . . . . 10.0 110.997 -179.833 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 1.5 mmmm -9.41 -92.23 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.602 0 O-C-N 128.032 3.333 . . . . 10.0 115.754 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 43.73 38.06 4.16 Favored Glycine 0 N--CA 1.44 -1.044 0 CA-C-O 118.025 -1.431 . . . . 10.0 113.054 179.551 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 68.03 -141.01 0.11 Allowed 'General case' 0 C--N 1.32 -0.698 0 O-C-N 125.723 1.484 . . . . 10.0 111.09 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 2.1 mmmm 57.32 174.1 0.05 OUTLIER 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 117.293 2.331 . . . . 10.0 117.293 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 45.8 mm-40 -82.06 -44.26 16.82 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 126.589 1.956 . . . . 10.0 109.423 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -113.26 -102.33 2.55 Favored Glycine 0 N--CA 1.444 -0.812 0 CA-C-O 122.641 1.134 . . . . 10.0 115.776 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 2.4 mtt180 63.19 91.83 0.07 Allowed 'General case' 0 CA--C 1.535 0.383 0 O-C-N 120.765 -1.432 . . . . 10.0 114.166 179.815 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 166.3 155.68 9.01 Favored Glycine 0 N--CA 1.447 -0.631 0 O-C-N 126.284 2.24 . . . . 10.0 108.163 -179.796 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 1.6 m0 -114.43 169.29 9.15 Favored 'General case' 0 CA--C 1.505 -0.75 0 O-C-N 125.314 1.244 . . . . 10.0 109.969 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 2.2 m -149.65 118.38 6.6 Favored 'General case' 0 CA--C 1.506 -0.728 0 N-CA-C 107.577 -1.268 . . . . 10.0 107.577 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -112.55 117.07 31.31 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.986 -179.719 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 1.5 p90 -137.07 140.59 42.1 Favored 'General case' 0 C--O 1.217 -0.607 0 N-CA-C 107.201 -1.407 . . . . 10.0 107.201 179.864 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 60.7 mt -96.18 159.76 2.92 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.004 0 N-CA-C 114.506 1.299 . . . . 10.0 114.506 179.609 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -166.97 113.32 0.79 Allowed 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 116.939 -1.505 . . . . 10.0 107.208 -179.73 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 53.51 40.78 62.9 Favored Glycine 0 N--CA 1.464 0.544 0 N-CA-C 106.447 -2.661 . . . . 10.0 106.447 179.889 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 64.0 9.41 4.59 Favored 'General case' 0 CA--C 1.552 1.054 0 CA-C-O 117.396 -1.287 . . . . 10.0 111.035 179.792 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -100.27 90.61 4.4 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 124.06 0.85 . . . . 10.0 110.184 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.417 ' HB3' ' HB2' ' A' ' 130' ' ' PHE . 12.1 tp -57.83 118.96 5.87 Favored 'General case' 0 N--CA 1.444 -0.764 0 N-CA-C 106.887 -1.523 . . . . 10.0 106.887 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 116' ' ' HIS . . . . . 0.421 ' CD2' HG12 ' A' ' 129' ' ' VAL . 25.2 m170 -112.83 103.22 11.21 Favored 'General case' 0 CA--C 1.5 -0.968 0 O-C-N 125.772 1.92 . . . . 10.0 107.401 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 42.4 tp -93.55 143.9 25.87 Favored 'General case' 0 C--O 1.241 0.615 0 O-C-N 119.282 -2.136 . . . . 10.0 113.385 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 66.6 tt0 -130.32 123.57 30.29 Favored 'General case' 0 C--O 1.217 -0.607 0 CA-C-O 117.636 -1.173 . . . . 10.0 109.661 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 6.5 mtt -116.63 153.45 32.26 Favored 'General case' 0 C--O 1.239 0.546 0 O-C-N 124.295 0.997 . . . . 10.0 110.599 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 1.1 mmm-85 -147.6 139.99 24.52 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 117.935 -1.031 . . . . 10.0 110.644 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -153.98 117.09 4.52 Favored 'General case' 0 N--CA 1.443 -0.805 0 O-C-N 124.527 1.142 . . . . 10.0 111.342 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 56.28 39.88 30.05 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 116.953 2.205 . . . . 10.0 116.953 179.789 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 87.79 -6.43 83.47 Favored Glycine 0 CA--C 1.539 1.546 0 CA-C-O 118.663 -1.076 . . . . 10.0 112.272 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 2.0 t -98.9 131.92 45.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 125.213 1.405 . . . . 10.0 108.206 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 94.3 m -111.67 140.2 46.5 Favored 'General case' 0 N--CA 1.446 -0.642 0 O-C-N 125.724 1.89 . . . . 10.0 110.822 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -129.16 145.46 51.31 Favored 'General case' 0 C--O 1.221 -0.417 0 N-CA-C 106.043 -1.836 . . . . 10.0 106.043 -179.911 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 2.2 mtmm -137.44 141.83 41.61 Favored 'General case' 0 C--N 1.328 -0.343 0 O-C-N 120.431 -1.418 . . . . 10.0 114.141 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -132.99 130.46 39.52 Favored 'General case' 0 CA--C 1.503 -0.854 0 O-C-N 125.209 1.568 . . . . 10.0 109.815 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.421 HG12 ' CD2' ' A' ' 116' ' ' HIS . 0.0 OUTLIER -106.15 96.33 4.52 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.379 0 C-N-CA 124.005 0.922 . . . . 10.0 110.543 179.92 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 130' ' ' PHE . . . . . 0.488 ' CZ ' ' CZ2' ' A' ' 8' ' ' TRP . 5.5 m-85 -83.86 175.98 9.23 Favored 'General case' 0 C--N 1.321 -0.631 0 O-C-N 126.637 2.461 . . . . 10.0 109.054 -179.766 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 23.4 tptp -148.27 98.39 2.91 Favored 'General case' 0 N--CA 1.44 -0.935 0 N-CA-C 106.852 -1.536 . . . . 10.0 106.852 179.754 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 7.7 ttpt -63.5 122.9 17.41 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 125.636 1.835 . . . . 10.0 108.795 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 24.6 t -102.45 -57.3 4.57 Favored 'Isoleucine or valine' 0 C--O 1.244 0.809 0 N-CA-C 113.911 1.078 . . . . 10.0 113.911 179.665 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 3.3 t-80 . . . . . 0 C--O 1.244 0.8 0 C-N-CA 118.086 -1.446 . . . . 10.0 113.828 179.824 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo . . . . . 0 CA--C 1.533 0.455 0 CA-C-O 117.174 -1.261 . . . . 10.0 109.459 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.402 ' O ' HG12 ' A' ' 2' ' ' VAL . 21.5 t -6.23 69.69 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.243 0.73 0 O-C-N 128.787 3.804 . . . . 10.0 114.118 -179.789 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -75.69 129.6 37.37 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 114.734 -1.121 . . . . 10.0 108.654 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 2.8 m-30 -72.41 -28.18 62.82 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 115.999 1.851 . . . . 10.0 115.999 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.4 p30 -68.13 139.32 56.16 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-N 120.921 1.691 . . . . 10.0 114.389 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -156.5 -93.12 0.09 OUTLIER Glycine 0 C--O 1.216 -1.006 0 N-CA-C 119.114 2.406 . . . . 10.0 119.114 -179.744 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.499 ' HA ' ' CE3' ' A' ' 8' ' ' TRP . 0.8 OUTLIER 172.7 170.91 0.12 Allowed 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 103.501 -2.778 . . . . 10.0 103.501 179.362 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.733 ' HA ' ' HB3' ' A' ' 132' ' ' LYS 0.331 32.0 p90 -152.05 159.25 43.75 Favored 'General case' 0 N--CA 1.441 -0.899 0 N-CA-C 115.459 1.651 . . . . 10.0 115.459 -178.116 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.519 ' HD3' ' CG ' ' A' ' 132' ' ' LYS . 2.3 pttp -167.28 88.38 0.3 Allowed 'General case' 0 C--O 1.216 -0.709 0 O-C-N 127.879 3.237 . . . . 10.0 108.313 175.844 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.538 ' HE1' ' HD2' ' A' ' 38' ' ' PRO . 2.1 ttp -54.49 140.12 35.44 Favored 'General case' 0 CA--C 1.509 -0.616 0 N-CA-C 116.521 2.045 . . . . 10.0 116.521 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.8 tp -101.73 -42.95 6.0 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 114.448 -1.251 . . . . 10.0 108.07 179.85 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -162.0 161.71 28.62 Favored 'General case' 0 C--O 1.244 0.792 0 O-C-N 125.377 1.673 . . . . 10.0 115.446 179.663 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -135.43 173.25 11.93 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 105.247 -2.131 . . . . 10.0 105.247 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -162.19 151.84 16.17 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 119.889 -1.757 . . . . 10.0 115.497 179.616 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 57.51 27.46 14.07 Favored 'General case' 0 C--N 1.324 -0.541 0 O-C-N 127.084 2.74 . . . . 10.0 115.582 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.4 ' CD1' ' N ' ' A' ' 16' ' ' PHE . 0.0 OUTLIER -56.55 -29.56 62.09 Favored 'General case' 0 C--O 1.244 0.784 0 C-N-CA 126.045 1.738 . . . . 10.0 114.932 179.931 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -78.66 -43.43 26.15 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 120.414 1.461 . . . . 10.0 109.169 179.186 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.08 -21.95 63.1 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-O 117.834 -1.079 . . . . 10.0 110.884 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -72.76 -36.04 67.59 Favored 'General case' 0 CA--C 1.552 1.052 0 O-C-N 124.79 1.306 . . . . 10.0 109.783 -179.911 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.625 HD22 HG11 ' A' ' 25' ' ' VAL . 75.0 mt -74.17 -27.96 61.07 Favored 'General case' 0 C--O 1.22 -0.454 0 CA-C-N 114.022 -1.444 . . . . 10.0 111.207 -179.83 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.5 ttt180 -73.47 -23.48 60.08 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 114.099 -1.409 . . . . 10.0 110.057 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.24 -24.62 62.22 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 122.258 1.028 . . . . 10.0 112.205 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.5 mt -109.71 -1.28 18.1 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 114.222 -1.354 . . . . 10.0 114.444 -179.784 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 55.68 72.06 0.51 Allowed 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 118.884 0.766 . . . . 10.0 111.415 179.717 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.625 HG11 HD22 ' A' ' 20' ' ' LEU . 2.2 p -94.58 -109.94 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.24 0.563 0 CA-C-O 117.084 -1.436 . . . . 10.0 107.416 179.965 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.58 ' N ' HG22 ' A' ' 25' ' ' VAL . 0.9 OUTLIER -148.37 161.99 40.46 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-N 120.437 1.471 . . . . 10.0 113.582 179.761 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -77.25 -20.0 14.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 O-C-N 125.876 1.985 . . . . 10.0 114.017 -179.6 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -77.32 -34.18 55.39 Favored 'General case' 0 C--O 1.242 0.677 0 O-C-N 125.274 1.609 . . . . 10.0 109.326 179.784 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.492 HD23 HG21 ' A' ' 25' ' ' VAL . 44.8 tp -77.91 -40.01 41.14 Favored 'General case' 0 C--O 1.222 -0.392 0 C-N-CA 118.393 -1.323 . . . . 10.0 113.487 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 8.8 mtm-85 -59.09 -23.26 61.92 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 125.65 1.58 . . . . 10.0 114.163 179.714 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.7 ttpp -76.53 -43.25 40.07 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 117.844 -1.074 . . . . 10.0 109.971 179.784 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.404 HD12 ' CE1' ' A' ' 57' ' ' PHE . 0.8 OUTLIER -79.52 -40.94 21.91 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 O-C-N 125.709 1.881 . . . . 10.0 109.807 -179.835 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -55.4 -58.6 7.06 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-O 121.83 0.824 . . . . 10.0 112.094 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -64.89 82.28 0.04 OUTLIER 'General case' 0 C--N 1.342 0.265 0 CA-C-N 113.775 -1.557 . . . . 10.0 110.247 179.746 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 162.77 -32.59 0.0 OUTLIER 'General case' 0 N--CA 1.444 -0.77 0 O-C-N 126.112 2.132 . . . . 10.0 111.144 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.5 mt -88.98 155.38 19.53 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 124.372 1.045 . . . . 10.0 111.096 179.562 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.1 pttt -138.35 105.64 7.82 Favored Pre-proline 0 C--N 1.319 -0.723 0 N-CA-C 103.911 -2.625 . . . . 10.0 103.911 179.638 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.538 ' HD2' ' HE1' ' A' ' 10' ' ' MET . 95.8 Cg_exo -51.15 -166.68 0.0 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.327 0 C-N-CA 125.04 3.827 . . . . 10.0 119.123 179.785 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.601 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 4.7 p30 -153.22 167.79 28.13 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 112.724 -2.035 . . . . 10.0 106.522 -179.555 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.45 ' HB2' ' CZ ' ' A' ' 130' ' ' PHE . 0.3 OUTLIER -149.97 121.07 7.74 Favored 'General case' 0 CA--C 1.497 -1.085 0 C-N-CA 116.994 -1.882 . . . . 10.0 112.819 -179.433 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.626 ' HA ' ' CE3' ' A' ' 8' ' ' TRP . 2.4 tt0 -110.36 103.12 11.73 Favored 'General case' 0 CA--C 1.509 -0.611 0 O-C-N 119.95 -1.719 . . . . 10.0 106.91 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 67.6 mt -93.44 130.13 42.89 Favored 'Isoleucine or valine' 0 C--O 1.243 0.737 0 CA-C-N 115.115 -0.948 . . . . 10.0 108.906 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -119.13 122.65 69.76 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.934 0 N-CA-C 107.04 -1.467 . . . . 10.0 107.04 -179.885 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -143.78 107.05 4.54 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 105.921 -1.881 . . . . 10.0 105.921 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -81.03 -51.44 8.5 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 123.281 1.515 . . . . 10.0 107.822 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -155.15 -83.93 0.04 OUTLIER Glycine 0 C--N 1.345 1.06 0 N-CA-C 108.916 -1.674 . . . . 10.0 108.916 -179.84 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -111.27 -1.61 16.01 Favored 'General case' 0 N--CA 1.443 -0.817 0 O-C-N 121.124 -1.221 . . . . 10.0 109.658 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 65.9 m170 -107.5 102.87 12.1 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 109.085 -0.709 . . . . 10.0 109.085 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 2.5 ttt -95.15 151.13 19.47 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 116.495 2.035 . . . . 10.0 116.495 -179.843 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 19.4 mt -145.64 127.42 8.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 105.939 -1.874 . . . . 10.0 105.939 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.4 mp -112.2 123.66 68.15 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 CA-C-N 114.664 -1.153 . . . . 10.0 108.328 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 4.9 tpt180 -114.34 86.6 2.46 Favored 'General case' 0 C--N 1.319 -0.744 0 C-N-CA 124.714 1.206 . . . . 10.0 111.581 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 93.7 m -87.63 131.47 34.42 Favored 'General case' 0 N--CA 1.444 -0.728 0 N-CA-C 103.033 -2.951 . . . . 10.0 103.033 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 3.9 mt -105.51 66.56 0.74 Allowed 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 120.497 3.517 . . . . 10.0 120.497 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 43.8 m -76.84 116.57 17.62 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 102.706 -3.072 . . . . 10.0 102.706 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -57.58 -17.87 16.6 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 108.043 -1.095 . . . . 10.0 108.043 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.404 ' CE1' HD12 ' A' ' 32' ' ' ILE . 0.3 OUTLIER -117.93 105.7 12.18 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 106.86 -1.533 . . . . 10.0 106.86 179.914 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 6.0 mmt-85 61.52 92.14 0.05 Allowed 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 114.385 -1.279 . . . . 10.0 112.816 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -40.85 150.21 0.07 Allowed 'General case' 0 CA--C 1.532 0.277 0 O-C-N 126.707 2.504 . . . . 10.0 113.067 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -132.33 98.0 4.27 Favored 'General case' 0 C--N 1.311 -1.072 0 N-CA-C 103.012 -2.958 . . . . 10.0 103.012 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.4 ' CG2' ' N ' ' A' ' 62' ' ' MET . 1.7 mp -135.18 146.84 29.61 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.055 0 N-CA-C 115.164 1.542 . . . . 10.0 115.164 179.785 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.4 ' N ' ' CG2' ' A' ' 61' ' ' ILE . 0.0 OUTLIER -147.09 -171.49 3.79 Favored 'General case' 0 C--O 1.216 -0.689 0 N-CA-C 106.318 -1.734 . . . . 10.0 106.318 179.905 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -167.64 123.79 1.09 Allowed 'General case' 0 C--O 1.223 -0.312 0 N-CA-C 100.923 -3.732 . . . . 10.0 100.923 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.449 ' CE1' ' CE1' ' A' ' 70' ' ' PHE . 12.7 m-85 -123.42 -175.0 3.09 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 115.144 1.535 . . . . 10.0 115.144 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -133.71 95.3 3.44 Favored 'General case' 0 N--CA 1.443 -0.782 0 N-CA-C 103.729 -2.693 . . . . 10.0 103.729 179.798 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 9.4 t -53.27 137.68 13.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 O-C-N 124.971 1.419 . . . . 10.0 109.046 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 76.64 15.44 81.56 Favored Glycine 0 N--CA 1.443 -0.877 0 CA-C-O 117.462 -1.744 . . . . 10.0 113.113 -179.78 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 3.8 tppt? -139.41 132.32 29.33 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 125.308 1.443 . . . . 10.0 112.116 -179.693 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -69.83 148.95 48.42 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 118.153 -0.927 . . . . 10.0 109.474 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.449 ' CE1' ' CE1' ' A' ' 64' ' ' PHE . 3.6 p90 -155.17 161.59 41.18 Favored 'General case' 0 C--O 1.245 0.841 0 O-C-N 124.894 1.372 . . . . 10.0 107.813 -179.787 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -100.6 123.32 44.65 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.518 -0.919 . . . . 10.0 108.518 179.868 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -75.01 78.03 2.2 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 114.696 -1.138 . . . . 10.0 113.639 -179.829 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -60.92 133.56 56.22 Favored 'General case' 0 C--N 1.316 -0.891 0 C-N-CA 119.126 -1.03 . . . . 10.0 108.247 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.0 tp -147.58 99.57 3.13 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 117.67 -1.157 . . . . 10.0 113.071 179.875 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.499 HG23 ' O ' ' A' ' 75' ' ' THR . 3.4 t -127.5 78.78 1.84 Allowed 'General case' 0 N--CA 1.443 -0.797 0 O-C-N 124.723 1.265 . . . . 10.0 108.837 -179.888 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 153.25 110.94 0.43 Allowed Glycine 0 C--O 1.244 0.775 0 C-N-CA 120.006 -1.092 . . . . 10.0 110.671 179.852 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.6 mt 69.71 106.22 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 N-CA-C 107.527 -1.286 . . . . 10.0 107.527 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 87.64 -33.95 0.03 OUTLIER 'General case' 0 C--O 1.242 0.662 0 O-C-N 127.492 2.995 . . . . 10.0 114.319 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.2 p30 35.04 97.62 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.808 0 C-N-CA 126.956 2.103 . . . . 10.0 116.286 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.479 ' HD2' ' CZ ' ' A' ' 104' ' ' ARG . 13.6 ttp180 -124.8 -65.62 1.02 Allowed 'General case' 0 CA--C 1.512 -0.493 0 O-C-N 119.629 -1.919 . . . . 10.0 115.196 -179.902 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 76.02 120.95 0.05 OUTLIER 'General case' 0 N--CA 1.439 -1.017 0 N-CA-C 103.882 -2.636 . . . . 10.0 103.882 179.658 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -155.63 -174.46 4.98 Favored 'General case' 0 CA--C 1.512 -0.486 0 N-CA-C 108.953 -0.758 . . . . 10.0 108.953 179.898 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 4.0 ptm -121.76 148.33 44.79 Favored 'General case' 0 N--CA 1.438 -1.028 0 N-CA-C 100.237 -3.986 . . . . 10.0 100.237 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.437 HG21 ' NE2' ' A' ' 97' ' ' GLN . 1.2 m -155.68 150.29 26.12 Favored 'General case' 0 CA--C 1.501 -0.914 0 N-CA-C 114.611 1.337 . . . . 10.0 114.611 179.95 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 16.4 m -133.69 106.71 7.51 Favored 'General case' 0 N--CA 1.438 -1.052 0 O-C-N 120.965 -1.085 . . . . 10.0 109.059 -179.779 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.8 m -90.01 147.06 5.46 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.61 0 N-CA-C 103.205 -2.887 . . . . 10.0 103.205 179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -163.83 169.51 18.16 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 126.479 2.362 . . . . 10.0 114.207 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 2.6 m-90 -97.83 122.86 41.44 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 124.096 0.958 . . . . 10.0 110.467 179.693 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -99.49 -63.21 1.15 Allowed 'General case' 0 C--O 1.247 0.944 0 N-CA-C 101.93 -3.359 . . . . 10.0 101.93 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -160.53 92.92 0.12 Allowed Glycine 0 CA--C 1.498 -1.011 0 N-CA-C 108.34 -1.904 . . . . 10.0 108.34 179.769 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 57.53 30.69 19.12 Favored 'General case' 0 C--N 1.318 -0.773 0 O-C-N 124.951 1.03 . . . . 10.0 113.054 -179.683 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.4 mtpt -148.42 166.15 28.99 Favored 'General case' 0 C--O 1.238 0.49 0 N-CA-C 109.282 -0.636 . . . . 10.0 109.282 -179.963 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.2 tt -117.57 116.65 27.52 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 105.032 -2.211 . . . . 10.0 105.032 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 25.0 mm100 -106.9 156.86 18.24 Favored 'General case' 0 N--CA 1.445 -0.724 0 O-C-N 118.411 -2.681 . . . . 10.0 111.429 179.759 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -148.02 142.48 26.39 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 118.946 -1.101 . . . . 10.0 112.126 -179.676 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 57.6 t -131.68 106.92 12.42 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 CA-C-N 114.128 -1.397 . . . . 10.0 109.133 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.437 ' NE2' HG21 ' A' ' 84' ' ' THR . 3.2 mp0 -91.72 114.92 27.59 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 106.144 -1.799 . . . . 10.0 106.144 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.01 -85.37 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 116.651 -1.642 . . . . 10.0 113.734 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 40.66 -142.92 0.69 Allowed Glycine 0 CA--C 1.528 0.887 0 O-C-N 125.284 1.615 . . . . 10.0 112.475 -179.683 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.47 ' H ' ' NH1' ' A' ' 104' ' ' ARG . 3.1 mm-40 -105.19 -159.27 0.7 Allowed 'General case' 0 C--N 1.315 -0.929 0 O-C-N 126.785 2.109 . . . . 10.0 110.461 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 68.22 -166.22 0.19 Allowed 'General case' 0 C--N 1.316 -0.855 0 O-C-N 126.333 2.271 . . . . 10.0 113.636 179.875 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -135.18 12.33 3.56 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 125.249 1.419 . . . . 10.0 114.445 -179.854 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -149.76 41.7 0.81 Allowed Glycine 0 N--CA 1.467 0.701 0 N-CA-C 116.151 1.22 . . . . 10.0 116.151 179.749 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.479 ' CZ ' ' HD2' ' A' ' 80' ' ' ARG . 70.2 mtt180 -91.73 129.4 37.71 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 113.829 1.048 . . . . 10.0 113.829 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 148.41 159.72 8.64 Favored Glycine 0 N--CA 1.462 0.379 0 C-N-CA 117.369 -2.348 . . . . 10.0 110.668 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 16.2 m0 -123.41 171.19 9.63 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 124.818 1.247 . . . . 10.0 109.75 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 3.4 m -153.35 112.98 3.85 Favored 'General case' 0 C--O 1.212 -0.91 0 N-CA-C 106.466 -1.679 . . . . 10.0 106.466 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -93.81 170.64 9.41 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 122.252 1.025 . . . . 10.0 112.567 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 2.0 t90 -176.37 108.56 0.08 Allowed 'General case' 0 C--O 1.219 -0.525 0 N-CA-C 106.935 -1.506 . . . . 10.0 106.935 179.936 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 54.1 mt -92.6 129.63 42.9 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 CA-C-O 124.275 1.988 . . . . 10.0 111.294 -179.827 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -110.48 -164.26 0.91 Allowed 'General case' 0 C--O 1.242 0.659 0 N-CA-C 106.803 -1.554 . . . . 10.0 106.803 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -96.78 108.06 3.61 Favored Glycine 0 CA--C 1.522 0.506 0 N-CA-C 107.541 -2.224 . . . . 10.0 107.541 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 78.25 12.29 1.7 Allowed 'General case' 0 C--O 1.214 -0.774 0 N-CA-C 108.461 -0.94 . . . . 10.0 108.461 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -149.79 149.88 31.18 Favored 'General case' 0 CA--C 1.509 -0.632 0 CA-C-O 123.195 1.474 . . . . 10.0 110.849 179.747 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.529 ' HB3' ' HB2' ' A' ' 130' ' ' PHE . 11.9 tp -116.83 121.27 41.03 Favored 'General case' 0 C--O 1.241 0.611 0 N-CA-C 104.3 -2.481 . . . . 10.0 104.3 -179.744 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 59.7 t-80 -114.13 117.14 30.38 Favored 'General case' 0 C--O 1.213 -0.849 0 N-CA-C 106.881 -1.526 . . . . 10.0 106.881 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.526 HD21 ' HG3' ' A' ' 119' ' ' MET . 0.6 OUTLIER -128.62 154.26 46.41 Favored 'General case' 0 CA--C 1.51 -0.567 0 O-C-N 126.0 2.063 . . . . 10.0 110.704 -179.987 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -143.36 126.48 16.46 Favored 'General case' 0 CA--C 1.495 -1.161 0 N-CA-C 106.747 -1.575 . . . . 10.0 106.747 179.647 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.526 ' HG3' HD21 ' A' ' 117' ' ' LEU . 28.7 mtp -107.97 126.75 53.08 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 113.68 -1.6 . . . . 10.0 113.006 179.929 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.611 ' HG3' HG23 ' A' ' 125' ' ' THR . 0.0 OUTLIER -125.82 142.38 51.54 Favored 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 118.725 -1.19 . . . . 10.0 110.17 -179.931 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -158.49 127.55 5.58 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.42 -0.956 . . . . 10.0 108.42 179.898 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 34.86 56.84 0.75 Allowed 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 117.881 2.548 . . . . 10.0 117.881 179.903 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 77.09 11.32 85.67 Favored Glycine 0 C--N 1.317 -0.482 0 N-CA-C 116.763 1.465 . . . . 10.0 116.763 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 22.5 t -124.26 130.81 73.55 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.335 0 N-CA-C 108.124 -1.065 . . . . 10.0 108.124 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' THR . . . . . 0.611 HG23 ' HG3' ' A' ' 120' ' ' ARG . 1.6 m -119.23 108.53 14.76 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 126.553 2.408 . . . . 10.0 114.152 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.51 144.59 25.45 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 106.331 -1.729 . . . . 10.0 106.331 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -144.55 179.49 7.25 Favored 'General case' 0 C--O 1.22 -0.454 0 O-C-N 125.414 1.696 . . . . 10.0 112.477 -179.947 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -169.76 145.25 3.0 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-N 114.45 -1.25 . . . . 10.0 108.402 -179.718 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -111.96 98.59 7.24 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 O-C-N 124.687 1.242 . . . . 10.0 108.007 179.769 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 130' ' ' PHE . . . . . 0.529 ' HB2' ' HB3' ' A' ' 115' ' ' LEU . 5.6 m-85 -74.0 169.67 17.01 Favored 'General case' 0 C--O 1.214 -0.767 0 O-C-N 125.734 1.896 . . . . 10.0 107.435 179.894 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.491 ' HD2' ' C ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -145.15 57.72 1.27 Allowed 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 122.999 1.38 . . . . 10.0 111.068 -179.76 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 132' ' ' LYS . . . . . 0.733 ' HB3' ' HA ' ' A' ' 8' ' ' TRP . 0.9 OUTLIER -162.14 -144.86 0.1 Allowed 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 104.728 -2.323 . . . . 10.0 104.728 179.588 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 133' ' ' VAL . . . . . 0.553 ' O ' HG13 ' A' ' 133' ' ' VAL . 0.4 OUTLIER 97.01 30.12 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.308 -1.201 0 O-C-N 127.708 3.13 . . . . 10.0 109.284 -179.911 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 51.1 t-80 . . . . . 0 N--CA 1.441 -0.879 0 CA-C-N 112.446 -2.161 . . . . 10.0 109.831 179.666 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo . . . . . 0 C--O 1.243 0.774 0 CA-C-O 120.884 0.285 . . . . 10.0 112.286 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.475 HG12 ' CD1' ' A' ' 4' ' ' PHE . 22.1 t -116.27 99.99 9.49 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 CA-C-N 114.566 -1.197 . . . . 10.0 107.956 -179.827 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -96.4 104.66 16.64 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 124.927 1.392 . . . . 10.0 108.885 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.517 ' CZ ' HD12 ' A' ' 110' ' ' ILE . 3.4 m-30 -89.99 -16.9 28.89 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 117.211 2.3 . . . . 10.0 117.211 -179.905 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -39.28 146.27 0.09 Allowed 'General case' 0 C--O 1.244 0.787 0 O-C-N 126.358 2.287 . . . . 10.0 113.433 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -179.53 -138.02 3.17 Favored Glycine 0 C--O 1.227 -0.323 0 N-CA-C 118.573 2.189 . . . . 10.0 118.573 -179.902 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.433 ' CB ' HG12 ' A' ' 133' ' ' VAL . 50.0 m-85 -144.9 -175.88 4.85 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 119.604 -2.116 . . . . 10.0 106.616 -179.655 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.64 ' CE3' ' HB3' ' A' ' 39' ' ' ASP 0.287 11.5 p-90 -158.97 -177.32 6.42 Favored 'General case' 0 C--O 1.214 -0.766 0 N-CA-C 113.883 1.068 . . . . 10.0 113.883 -179.262 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.484 ' HD3' ' HB ' ' A' ' 133' ' ' VAL . 11.5 ptmt 157.3 97.67 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.557 0 O-C-N 127.663 3.102 . . . . 10.0 107.167 178.454 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.448 ' CE ' ' HB2' ' A' ' 13' ' ' ASN . 3.8 ppp? -61.01 139.32 58.08 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-O 117.711 -1.138 . . . . 10.0 112.29 -179.536 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.405 ' O ' HD23 ' A' ' 11' ' ' LEU . 1.1 tt -96.97 -38.27 9.86 Favored 'General case' 0 C--N 1.32 -0.68 0 O-C-N 125.876 1.985 . . . . 10.0 108.289 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -163.27 136.05 5.45 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 116.724 2.12 . . . . 10.0 116.724 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.448 ' HB2' ' CE ' ' A' ' 10' ' ' MET . 29.6 t30 -134.03 152.42 51.84 Favored 'General case' 0 C--O 1.239 0.538 0 O-C-N 125.888 1.992 . . . . 10.0 107.712 -179.795 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -173.76 170.66 3.93 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 118.612 -0.709 . . . . 10.0 112.372 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.463 ' HB2' ' HA ' ' A' ' 126' ' ' CYS . 6.0 m-20 66.95 20.6 10.48 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 127.644 2.377 . . . . 10.0 113.725 179.347 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -67.04 -30.72 70.88 Favored 'General case' 0 CA--C 1.548 0.876 0 CA-C-N 114.62 -1.173 . . . . 10.0 112.418 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -71.24 -42.46 68.82 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-O 122.395 1.093 . . . . 10.0 111.891 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -75.17 -25.14 58.08 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 114.108 -1.406 . . . . 10.0 107.262 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 10.2 t80 -75.5 -43.39 49.36 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 118.335 -0.84 . . . . 10.0 111.016 -179.669 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.475 HD22 HG21 ' A' ' 25' ' ' VAL . 50.6 mt -72.2 -21.84 61.36 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 113.02 0.748 . . . . 10.0 113.02 -179.621 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.4 ttm-85 -74.4 -24.68 59.15 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 114.49 -1.232 . . . . 10.0 108.833 179.809 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.16 -32.53 69.04 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 122.587 1.184 . . . . 10.0 110.607 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 51.5 mt -100.5 -7.92 23.67 Favored 'General case' 0 C--O 1.236 0.379 0 O-C-N 119.669 -1.894 . . . . 10.0 110.668 179.785 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.403 ' OD1' ' N ' ' A' ' 24' ' ' ASP . 0.3 OUTLIER 51.35 62.85 2.5 Favored 'General case' 0 C--O 1.245 0.864 0 O-C-N 124.085 0.865 . . . . 10.0 111.935 179.854 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.527 HG12 ' HB2' ' A' ' 78' ' ' ASP . 20.8 m -94.29 39.71 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 N-CA-C 104.054 -2.572 . . . . 10.0 104.054 179.959 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 65.55 154.63 0.08 Allowed 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 115.719 1.748 . . . . 10.0 115.719 -179.814 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 15.5 m -72.11 -22.07 20.91 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.656 0 N-CA-C 114.886 1.439 . . . . 10.0 114.886 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -73.65 -27.08 61.06 Favored 'General case' 0 C--O 1.234 0.28 0 O-C-N 124.838 1.336 . . . . 10.0 111.468 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.458 HD22 ' CG2' ' A' ' 25' ' ' VAL . 0.2 OUTLIER -76.27 -30.56 57.87 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 119.556 -0.858 . . . . 10.0 112.96 179.833 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.72 -22.89 61.56 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-O 124.189 1.947 . . . . 10.0 110.214 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.33 -41.51 33.42 Favored 'General case' 0 N--CA 1.444 -0.728 0 N-CA-C 107.384 -1.339 . . . . 10.0 107.384 -179.733 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.2 mp -72.58 -35.5 51.0 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.512 0 O-C-N 127.315 2.884 . . . . 10.0 110.499 -179.742 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.32 -31.05 43.09 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 113.18 -1.827 . . . . 10.0 113.22 179.804 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -56.97 -30.57 64.2 Favored 'General case' 0 C--N 1.318 -0.765 0 O-C-N 119.753 -1.842 . . . . 10.0 115.213 179.672 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -110.81 40.59 1.98 Allowed 'General case' 0 C--N 1.322 -0.596 0 O-C-N 124.563 1.164 . . . . 10.0 109.511 179.877 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -117.08 131.56 56.89 Favored 'General case' 0 CA--C 1.515 -0.396 0 C-N-CA 124.386 1.074 . . . . 10.0 109.686 179.952 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -143.97 100.79 4.96 Favored Pre-proline 0 N--CA 1.47 0.546 0 N-CA-C 106.776 -1.564 . . . . 10.0 106.776 179.821 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -98.94 168.47 0.56 Allowed 'Trans proline' 0 N--CA 1.447 -1.247 0 C-N-CA 124.606 3.537 . . . . 10.0 116.458 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.64 ' HB3' ' CE3' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -121.87 -174.29 2.84 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 105.723 -1.955 . . . . 10.0 105.723 -179.725 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.449 ' HB2' ' CE2' ' A' ' 130' ' ' PHE . 2.5 mttt -156.48 105.56 2.27 Favored 'General case' 0 CA--C 1.501 -0.923 0 C-N-CA 118.475 -1.29 . . . . 10.0 112.833 -179.944 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -97.64 107.86 20.45 Favored 'General case' 0 C--N 1.341 0.234 0 N-CA-C 102.682 -3.081 . . . . 10.0 102.682 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.522 HG23 HD12 ' A' ' 51' ' ' ILE . 86.0 mt -89.27 141.68 13.95 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.022 0 CA-C-O 118.845 -0.598 . . . . 10.0 110.511 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -134.8 158.97 41.79 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 O-C-N 124.727 1.267 . . . . 10.0 107.677 -179.883 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.445 ' HG3' ' CB ' ' A' ' 48' ' ' HIS . 0.0 OUTLIER -129.41 136.93 50.57 Favored 'General case' 0 C--N 1.323 -0.584 0 O-C-N 125.961 2.038 . . . . 10.0 111.566 -179.653 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -133.8 -143.94 0.22 Allowed 'General case' 0 C--O 1.243 0.739 0 CA-C-O 114.776 -2.535 . . . . 10.0 107.791 -179.723 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -42.1 138.28 2.59 Favored Glycine 0 CA--C 1.534 1.237 0 N-CA-C 104.587 -3.405 . . . . 10.0 104.587 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.54 ' CB ' ' HB3' ' A' ' 65' ' ' GLN . 11.3 m-20 59.19 -115.2 0.76 Allowed 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 102.595 -3.113 . . . . 10.0 102.595 -176.82 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' HIS . . . . . 0.529 ' CE1' ' HB ' ' A' ' 66' ' ' VAL . 0.0 OUTLIER 164.27 85.04 0.0 OUTLIER 'General case' 0 CA--C 1.5 -0.97 0 O-C-N 126.487 2.367 . . . . 10.0 112.611 175.31 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.7 ' HE2' HD21 ' A' ' 93' ' ' LEU . 36.4 ttm -169.38 83.07 0.13 Allowed 'General case' 0 N--CA 1.435 -1.22 0 N-CA-C 115.771 1.767 . . . . 10.0 115.771 175.416 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.566 HD12 ' C ' ' A' ' 49' ' ' MET . 1.3 mp -117.46 107.22 21.64 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.172 0 N-CA-C 102.208 -3.256 . . . . 10.0 102.208 179.533 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.522 HD12 HG23 ' A' ' 42' ' ' ILE . 0.2 OUTLIER -106.3 108.12 24.35 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.952 0 N-CA-C 109.243 -0.651 . . . . 10.0 109.243 -179.999 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.461 ' HG3' HD13 ' A' ' 61' ' ' ILE . 19.9 ttp180 -101.55 110.24 22.2 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.694 -1.139 . . . . 10.0 113.519 -179.94 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 20.7 m -97.77 122.93 41.45 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 102.24 -3.244 . . . . 10.0 102.24 -179.819 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -125.83 61.62 1.25 Allowed 'General case' 0 C--N 1.324 -0.51 1 N-CA-C 121.917 4.043 . . . . 10.0 121.917 -179.795 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.0 m -65.5 -175.94 0.3 Allowed 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 125.908 1.683 . . . . 10.0 107.976 -179.755 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 58.7 p -105.15 -20.93 13.36 Favored 'General case' 0 C--O 1.242 0.69 0 CA-C-O 117.388 -1.291 . . . . 10.0 109.927 179.698 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -73.48 -56.64 4.78 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 122.892 1.329 . . . . 10.0 108.609 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.42 -165.06 1.9 Allowed 'General case' 0 C--O 1.244 0.814 0 CA-C-N 114.183 -1.371 . . . . 10.0 110.089 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -156.84 133.28 9.94 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-O 123.965 1.841 . . . . 10.0 111.849 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -109.9 125.48 52.85 Favored 'General case' 0 CA--C 1.501 -0.929 0 N-CA-C 102.398 -3.186 . . . . 10.0 102.398 179.751 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.461 HD13 ' HG3' ' A' ' 52' ' ' ARG . 1.1 mt -132.73 158.46 43.28 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.706 0 O-C-N 118.237 -2.789 . . . . 10.0 116.102 -179.663 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -141.23 155.23 46.05 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 104.406 -2.442 . . . . 10.0 104.406 -179.911 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -131.67 69.61 1.47 Allowed 'General case' 0 C--N 1.311 -1.066 1 N-CA-C 99.436 -4.283 . . . . 10.0 99.436 179.884 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.467 ' HB3' ' HB3' ' A' ' 49' ' ' MET . 2.2 m-85 -69.78 -172.91 0.55 Allowed 'General case' 0 C--O 1.241 0.657 0 CA-C-N 113.383 -1.735 . . . . 10.0 113.546 179.772 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.54 ' HB3' ' CB ' ' A' ' 47' ' ' ASP . 7.8 mt-30 -171.58 121.32 0.5 Allowed 'General case' 0 C--N 1.317 -0.838 0 C-N-CA 128.001 2.52 . . . . 10.0 107.092 -179.404 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.529 ' HB ' ' CE1' ' A' ' 48' ' ' HIS . 24.8 t -58.89 156.32 2.29 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 C-N-CA 125.961 1.704 . . . . 10.0 113.231 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.453 ' N ' ' CG1' ' A' ' 66' ' ' VAL . . . 63.58 11.26 41.02 Favored Glycine 0 C--O 1.218 -0.889 0 N-CA-C 118.38 2.112 . . . . 10.0 118.38 179.791 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 9.0 tttp -124.26 148.63 47.23 Favored 'General case' 0 C--O 1.22 -0.459 0 CA-C-N 118.105 0.953 . . . . 10.0 112.241 179.901 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 53.4 tt0 -91.12 136.58 32.99 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 125.402 1.688 . . . . 10.0 109.076 -179.807 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -122.53 179.02 4.74 Favored 'General case' 0 C--N 1.318 -0.797 0 C-N-CA 124.566 1.146 . . . . 10.0 108.358 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -154.03 67.98 0.75 Allowed 'General case' 0 C--N 1.317 -0.811 0 O-C-N 127.205 2.815 . . . . 10.0 111.198 -179.754 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -51.71 126.7 18.52 Favored 'General case' 0 N--CA 1.442 -0.847 0 N-CA-C 112.355 0.502 . . . . 10.0 112.355 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.41 ' OD2' HD12 ' A' ' 74' ' ' LEU . 5.3 p-10 -70.68 -20.02 62.73 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.785 0.802 . . . . 10.0 110.227 179.959 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.74 HD13 ' O ' ' A' ' 74' ' ' LEU . 0.0 OUTLIER -156.75 127.46 6.69 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 116.395 1.998 . . . . 10.0 116.395 -179.959 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.592 ' N ' ' HA ' ' A' ' 79' ' ' ASP . 18.3 m -96.43 123.59 40.14 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-O 124.116 1.913 . . . . 10.0 111.194 -179.591 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 52.48 -133.22 39.05 Favored Glycine 0 N--CA 1.441 -0.994 0 N-CA-C 107.172 -2.371 . . . . 10.0 107.172 179.797 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.803 ' O ' HD12 ' A' ' 77' ' ' ILE . 0.9 OUTLIER -107.38 -11.85 10.48 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 N-CA-C 106.843 -1.54 . . . . 10.0 106.843 179.374 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.527 ' HB2' HG12 ' A' ' 25' ' ' VAL . 0.2 OUTLIER -82.17 -4.97 58.09 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-N 113.67 -1.604 . . . . 10.0 109.262 179.848 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.592 ' HA ' ' N ' ' A' ' 75' ' ' THR . 4.0 m-20 39.68 -128.15 0.35 Allowed 'General case' 0 C--N 1.316 -0.88 0 C-N-CA 128.314 2.646 . . . . 10.0 115.953 -179.596 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 16.9 ttt85 84.8 114.37 0.05 Allowed 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 120.481 1.491 . . . . 10.0 107.231 -179.432 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 5.4 mmtp -57.19 141.84 44.96 Favored 'General case' 0 C--N 1.316 -0.873 0 O-C-N 127.156 2.785 . . . . 10.0 105.583 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 72.8 m -152.12 149.66 29.04 Favored 'General case' 0 C--O 1.213 -0.86 0 O-C-N 125.412 1.695 . . . . 10.0 109.601 -179.866 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.6 mtm -100.69 114.54 28.36 Favored 'General case' 0 C--O 1.241 0.617 1 N-CA-C 100.163 -4.014 . . . . 10.0 100.163 179.869 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 98.8 m -112.12 135.53 52.66 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 115.844 1.794 . . . . 10.0 115.844 179.734 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -131.3 145.22 51.79 Favored 'General case' 0 C--N 1.343 0.287 0 N-CA-C 108.134 -1.061 . . . . 10.0 108.134 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.489 HG11 ' HE3' ' A' ' 49' ' ' MET . 1.2 t -113.23 172.88 3.1 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.986 0 N-CA-C 104.02 -2.585 . . . . 10.0 104.02 179.887 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -169.49 169.11 9.05 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 120.526 1.512 . . . . 10.0 113.96 179.783 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -106.81 122.62 46.76 Favored 'General case' 0 C--O 1.224 -0.24 0 O-C-N 125.844 1.965 . . . . 10.0 106.905 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.424 ' HB3' ' HB2' ' A' ' 92' ' ' LYS . 24.5 t0 -107.69 3.89 25.15 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 101.381 -3.563 . . . . 10.0 101.381 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 111.47 -96.46 0.88 Allowed Glycine 0 C--O 1.24 0.51 0 N-CA-C 104.066 -3.614 . . . . 10.0 104.066 -179.719 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 8.9 p30 -84.83 -35.78 22.06 Favored 'General case' 0 C--O 1.222 -0.373 0 C-N-CA 119.641 -0.824 . . . . 10.0 109.657 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.424 ' HB2' ' HB3' ' A' ' 89' ' ' ASP . 1.6 mtmm -82.17 142.6 32.07 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 124.009 0.924 . . . . 10.0 111.843 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.7 HD21 ' HE2' ' A' ' 49' ' ' MET . 9.8 tp -119.22 100.72 7.5 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 104.254 -2.499 . . . . 10.0 104.254 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' GLN . . . . . 0.444 ' HB3' HG23 ' A' ' 107' ' ' THR . 10.6 pt20 -123.92 168.07 13.28 Favored 'General case' 0 CA--C 1.497 -1.073 0 N-CA-C 114.985 1.476 . . . . 10.0 114.985 179.836 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 19.9 p -131.67 -173.03 3.01 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-N 113.547 -1.66 . . . . 10.0 110.026 179.692 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.4 HG12 ' N ' ' A' ' 97' ' ' GLN . 7.0 t -134.76 -74.08 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.744 0 C-N-CA 125.062 1.345 . . . . 10.0 109.475 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.4 ' N ' HG12 ' A' ' 96' ' ' VAL . 21.7 mt-30 87.78 118.45 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.569 0 O-C-N 127.273 2.858 . . . . 10.0 110.423 179.908 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.8 mmtt -88.96 114.2 25.32 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 125.386 1.474 . . . . 10.0 114.247 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' GLY . . . . . 0.505 ' N ' HH22 ' A' ' 104' ' ' ARG . . . -153.32 -160.05 9.47 Favored Glycine 0 CA--C 1.523 0.573 0 N-CA-C 108.753 -1.739 . . . . 10.0 108.753 -179.911 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 14.4 tm-20 -86.63 -14.51 42.5 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 116.645 2.091 . . . . 10.0 116.645 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 15.3 mmtt -81.78 178.44 8.32 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 113.273 0.842 . . . . 10.0 113.273 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 3.7 pm0 -121.71 28.89 7.42 Favored 'General case' 0 CA--C 1.509 -0.6 0 C-N-CA 125.933 1.693 . . . . 10.0 110.517 179.92 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -159.19 -18.4 0.03 OUTLIER Glycine 0 N--CA 1.462 0.383 0 CA-C-O 116.554 -2.248 . . . . 10.0 118.481 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.505 HH22 ' N ' ' A' ' 99' ' ' GLY . 24.0 mtm-85 -47.4 144.82 2.75 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 120.209 2.004 . . . . 10.0 109.017 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 129.65 152.11 7.47 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 107.592 -2.203 . . . . 10.0 107.592 -179.786 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -124.95 -170.97 2.26 Favored 'General case' 0 C--O 1.239 0.531 0 C-N-CA 125.223 1.409 . . . . 10.0 109.916 179.713 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 107' ' ' THR . . . . . 0.444 HG23 ' HB3' ' A' ' 94' ' ' GLN . 3.1 m -161.39 117.75 2.18 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-O 117.307 -1.33 . . . . 10.0 109.55 179.724 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 -93.45 128.17 39.42 Favored 'General case' 0 C--N 1.318 -0.772 0 O-C-N 126.796 2.56 . . . . 10.0 107.287 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 4.5 t90 -139.55 101.47 4.23 Favored 'General case' 0 CA--C 1.511 -0.521 0 O-C-N 120.505 -1.372 . . . . 10.0 112.271 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.517 HD12 ' CZ ' ' A' ' 4' ' ' PHE . 72.2 mt -85.64 119.4 34.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 O-C-N 126.405 2.316 . . . . 10.0 114.069 179.689 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -132.25 148.09 52.44 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 104.301 -2.481 . . . . 10.0 104.301 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 26.73 -103.16 0.01 OUTLIER Glycine 0 N--CA 1.445 -0.737 0 O-C-N 128.161 3.413 . . . . 10.0 111.926 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -116.05 24.77 11.19 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 125.766 1.509 . . . . 10.0 112.251 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.485 ' C ' HD23 ' A' ' 115' ' ' LEU . 0.1 OUTLIER -139.99 163.19 33.33 Favored 'General case' 0 CA--C 1.501 -0.912 0 CA-C-O 123.502 1.62 . . . . 10.0 114.13 -179.995 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.485 HD23 ' C ' ' A' ' 114' ' ' GLU . 4.5 mt -124.6 108.78 12.42 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 104.781 -2.303 . . . . 10.0 104.781 -179.959 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -94.85 73.95 3.57 Favored 'General case' 0 C--N 1.313 -1.006 0 C-N-CA 119.332 -0.947 . . . . 10.0 109.33 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.525 HD22 ' HB2' ' A' ' 128' ' ' GLN . 8.9 tt -66.89 153.68 42.88 Favored 'General case' 0 N--CA 1.45 -0.456 0 O-C-N 126.355 2.285 . . . . 10.0 112.71 179.79 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -141.51 138.49 32.81 Favored 'General case' 0 C--O 1.214 -0.807 0 O-C-N 125.037 1.461 . . . . 10.0 109.986 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -136.21 121.44 19.12 Favored 'General case' 0 C--N 1.322 -0.596 0 O-C-N 124.738 1.274 . . . . 10.0 111.013 179.781 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -123.19 152.99 40.69 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 114.842 -1.072 . . . . 10.0 111.161 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -165.07 130.38 2.62 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 104.829 -2.286 . . . . 10.0 104.829 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 47.22 30.27 1.4 Allowed 'General case' 0 C--N 1.321 -0.672 0 O-C-N 125.345 1.653 . . . . 10.0 111.977 -179.884 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 86.58 -8.41 75.21 Favored Glycine 0 CA--C 1.535 1.335 0 C-N-CA 119.604 -1.284 . . . . 10.0 114.497 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 22.1 t -86.08 124.24 40.12 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 CA-C-N 118.723 1.262 . . . . 10.0 108.517 -179.787 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 5.4 m -103.42 120.6 41.14 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-O 123.943 1.83 . . . . 10.0 114.39 -179.813 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 126' ' ' CYS . . . . . 0.463 ' HA ' ' HB2' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -124.92 129.4 50.29 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 112.443 -2.162 . . . . 10.0 105.272 179.996 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -115.46 173.77 6.35 Favored 'General case' 0 C--O 1.24 0.597 0 N-CA-C 115.319 1.6 . . . . 10.0 115.319 179.784 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 128' ' ' GLN . . . . . 0.525 ' HB2' HD22 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -151.87 88.71 1.41 Allowed 'General case' 0 CA--C 1.512 -0.519 0 CA-C-N 113.012 -1.904 . . . . 10.0 110.3 179.832 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 38.5 t -70.17 119.13 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 N-CA-C 104.874 -2.269 . . . . 10.0 104.874 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 130' ' ' PHE . . . . . 0.449 ' CE2' ' HB2' ' A' ' 40' ' ' LYS . 0.3 OUTLIER -101.03 174.86 5.81 Favored 'General case' 0 C--O 1.218 -0.562 0 CA-C-O 123.687 1.708 . . . . 10.0 108.94 179.758 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 2.3 tptm -143.22 88.88 2.05 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 113.578 -1.646 . . . . 10.0 106.616 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 22.9 ttpt -65.08 98.0 0.28 Allowed 'General case' 0 CA--C 1.504 -0.796 0 C-N-CA 118.008 -1.477 . . . . 10.0 107.709 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 133' ' ' VAL . . . . . 0.495 HG13 ' N ' ' A' ' 134' ' ' HIS . 7.1 p -53.66 -37.25 31.0 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.353 0 CA-C-N 114.417 -1.265 . . . . 10.0 110.209 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 134' ' ' HIS . . . . . 0.495 ' N ' HG13 ' A' ' 133' ' ' VAL . 1.9 t-160 . . . . . 0 N--CA 1.438 -1.064 0 O-C-N 126.049 2.093 . . . . 10.0 111.511 -179.981 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.246 0.915 0 N-CA-C 114.778 1.03 . . . . 10.0 114.778 . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.58 -13.82 14.99 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 O-C-N 124.409 1.068 . . . . 10.0 111.811 -179.886 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -46.71 129.47 11.32 Favored 'General case' 0 C--O 1.217 -0.611 0 CA-C-N 114.456 -1.247 . . . . 10.0 111.751 179.993 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.412 ' CE2' ' CD1' ' A' ' 93' ' ' LEU . 19.8 m-30 -90.11 -9.67 47.49 Favored 'General case' 0 C--N 1.319 -0.74 0 O-C-N 127.881 3.238 . . . . 10.0 116.326 -179.906 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 71.8 m-20 -43.57 143.8 0.9 Allowed 'General case' 0 N--CA 1.471 0.619 0 O-C-N 127.253 2.845 . . . . 10.0 111.905 179.97 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.429 ' HA2' ' HA ' ' A' ' 134' ' ' HIS . . . -146.58 -177.49 21.23 Favored Glycine 0 C--N 1.346 1.12 0 N-CA-C 119.669 2.628 . . . . 10.0 119.669 -179.569 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -151.48 46.44 0.8 Allowed 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 103.839 -2.652 . . . . 10.0 103.839 -179.582 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.618 ' CZ3' ' CB ' ' A' ' 39' ' ' ASP 0.397 30.2 p-90 -37.61 169.61 0.0 OUTLIER 'General case' 0 C--O 1.211 -0.931 0 C-N-CA 127.19 2.196 . . . . 10.0 115.272 179.331 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.509 ' HE3' ' HB2' ' A' ' 132' ' ' LYS . 0.0 OUTLIER -157.55 150.49 23.26 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 111.633 -2.531 . . . . 10.0 104.473 174.976 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.3 ppp? -106.4 168.37 9.2 Favored 'General case' 0 C--O 1.24 0.561 0 O-C-N 119.834 -1.791 . . . . 10.0 112.67 -179.777 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -137.3 -59.9 0.68 Allowed 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 105.719 -1.956 . . . . 10.0 105.719 -179.902 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 61.8 p -161.85 173.68 14.21 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 124.689 2.185 . . . . 10.0 112.623 179.771 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.42 ' OD1' ' N ' ' A' ' 13' ' ' ASN . 3.1 p-10 -126.16 161.35 27.87 Favored 'General case' 0 CA--C 1.513 -0.481 0 CA-C-N 112.67 -2.059 . . . . 10.0 108.088 -179.597 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 35.9 tp10 -149.0 134.8 18.86 Favored 'General case' 0 C--O 1.215 -0.722 0 O-C-N 119.539 -1.975 . . . . 10.0 113.519 179.676 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 61.25 27.84 17.49 Favored 'General case' 0 C--O 1.244 0.78 0 C-N-CA 125.015 1.326 . . . . 10.0 111.846 -179.958 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.497 ' CD2' HD11 ' A' ' 20' ' ' LEU . 40.2 t80 -69.16 -27.62 65.69 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 114.797 1.406 . . . . 10.0 114.797 -179.399 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -76.61 -29.07 56.37 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 120.205 -1.559 . . . . 10.0 112.778 179.916 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -79.37 -28.18 41.94 Favored 'General case' 0 C--O 1.219 -0.505 0 CA-C-N 114.512 -1.222 . . . . 10.0 109.445 -179.948 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.6 ' CE1' HD11 ' A' ' 23' ' ' LEU . 0.2 OUTLIER -65.9 -43.67 87.55 Favored 'General case' 0 CA--C 1.555 1.172 0 O-C-N 125.489 1.743 . . . . 10.0 108.978 -179.998 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.503 ' CD1' ' HG3' ' A' ' 30' ' ' ARG . 0.7 OUTLIER -76.82 -23.22 52.8 Favored 'General case' 0 C--O 1.22 -0.462 0 O-C-N 126.146 2.154 . . . . 10.0 112.609 179.707 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.89 -26.01 40.39 Favored 'General case' 0 C--N 1.321 -0.662 0 O-C-N 126.224 2.202 . . . . 10.0 108.816 179.531 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.403 ' HB1' ' HB3' ' A' ' 122' ' ' GLU . . . -69.89 -27.64 64.97 Favored 'General case' 0 C--O 1.218 -0.57 0 C-N-CA 125.976 1.711 . . . . 10.0 112.984 179.781 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.6 HD11 ' CE1' ' A' ' 19' ' ' TYR . 0.0 OUTLIER -113.27 9.64 18.37 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 114.197 -1.365 . . . . 10.0 109.886 179.567 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 38.41 72.19 0.14 Allowed 'General case' 0 C--N 1.322 -0.6 0 O-C-N 126.697 2.498 . . . . 10.0 114.957 179.466 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 3.8 m -88.78 170.05 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-O 117.027 -1.463 . . . . 10.0 108.841 -179.661 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 9.0 m120 -53.98 152.63 5.58 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 117.913 -1.042 . . . . 10.0 111.502 179.48 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 2.5 p -71.6 -23.1 22.29 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.855 0 N-CA-C 117.284 2.327 . . . . 10.0 117.284 -179.632 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -79.82 -32.04 40.67 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 114.43 -1.259 . . . . 10.0 109.919 -179.806 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 54.3 tp -70.75 -44.72 66.18 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 114.64 1.348 . . . . 10.0 114.64 -179.732 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.503 ' HG3' ' CD1' ' A' ' 20' ' ' LEU . 18.4 ttp180 -56.86 -36.72 70.37 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 126.254 1.822 . . . . 10.0 114.377 179.813 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.87 -32.66 61.93 Favored 'General case' 0 C--O 1.218 -0.585 0 O-C-N 126.274 2.234 . . . . 10.0 110.588 179.806 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 20.7 mm -77.41 -41.04 29.52 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.453 0 O-C-N 125.489 1.743 . . . . 10.0 109.261 -179.739 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -80.35 -6.25 57.69 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.785 -0.643 . . . . 10.0 112.399 179.828 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -93.46 -30.42 15.06 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 115.294 1.59 . . . . 10.0 115.294 -179.785 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -92.33 -14.06 29.32 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 120.017 1.281 . . . . 10.0 110.456 179.893 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.4 HD11 ' HB3' ' A' ' 57' ' ' PHE . 0.0 OUTLIER -80.42 118.26 21.89 Favored 'General case' 0 CA--C 1.514 -0.423 0 C-N-CA 125.677 1.591 . . . . 10.0 109.468 -179.735 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.7 135.75 19.7 Favored Pre-proline 0 C--N 1.318 -0.783 0 N-CA-C 106.495 -1.668 . . . . 10.0 106.495 -179.975 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_exo -90.7 179.18 1.83 Allowed 'Trans proline' 0 N--CA 1.447 -1.258 0 C-N-CA 124.268 3.312 . . . . 10.0 119.545 -179.443 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.618 ' CB ' ' CZ3' ' A' ' 8' ' ' TRP . 0.3 OUTLIER -149.39 143.84 26.0 Favored 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 127.636 2.375 . . . . 10.0 104.724 179.72 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.573 ' C ' ' CD1' ' A' ' 8' ' ' TRP . 1.2 tptt -97.56 -143.22 0.3 Allowed 'General case' 0 C--N 1.305 -1.335 0 CA-C-O 114.672 -2.585 . . . . 10.0 106.905 -179.42 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.544 ' HA ' ' CD1' ' A' ' 8' ' ' TRP . 0.2 OUTLIER 152.92 117.32 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.938 0 O-C-N 127.728 3.143 . . . . 10.0 102.77 178.586 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 6.3 mm -121.86 145.76 28.01 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.981 0 O-C-N 124.701 1.251 . . . . 10.0 113.602 179.451 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 67.0 t -147.48 100.36 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 O-C-N 125.911 2.007 . . . . 10.0 106.35 179.898 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -112.01 116.91 31.33 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 124.668 1.187 . . . . 10.0 108.665 179.862 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -118.86 125.73 50.18 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 104.799 -2.297 . . . . 10.0 104.799 -179.942 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 61.32 -115.29 7.68 Favored Glycine 0 C--O 1.223 -0.532 0 N-CA-C 108.951 -1.66 . . . . 10.0 108.951 -179.723 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -112.58 -20.84 11.57 Favored 'General case' 0 C--N 1.321 -0.652 0 O-C-N 121.693 -0.887 . . . . 10.0 110.609 -179.854 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 46.1 m170 -82.45 119.08 23.74 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 107.802 -1.184 . . . . 10.0 107.802 -179.954 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 17.5 ttp -104.21 155.18 18.95 Favored 'General case' 0 C--N 1.32 -0.684 0 O-C-N 126.664 2.478 . . . . 10.0 114.454 179.961 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 4.8 mt -145.7 122.8 4.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 106.419 -1.697 . . . . 10.0 106.419 -179.937 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.5 mp -119.23 131.41 72.0 Favored 'Isoleucine or valine' 0 C--O 1.242 0.699 0 N-CA-C 104.683 -2.34 . . . . 10.0 104.683 179.823 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.84 98.66 6.01 Favored 'General case' 0 N--CA 1.442 -0.872 0 CA-C-N 114.971 -1.013 . . . . 10.0 111.571 -179.76 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 89.2 m -72.33 139.88 48.2 Favored 'General case' 0 C--O 1.219 -0.538 0 N-CA-C 101.784 -3.413 . . . . 10.0 101.784 179.983 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.2 mt -113.11 54.74 0.72 Allowed 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 119.902 3.297 . . . . 10.0 119.902 -179.886 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 64.8 m -93.38 131.01 38.95 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 104.04 -2.578 . . . . 10.0 104.04 -179.757 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -69.51 -13.34 62.29 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 123.236 1.493 . . . . 10.0 107.727 -179.848 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.4 ' HB3' HD11 ' A' ' 36' ' ' LEU . 28.5 t80 -95.22 84.17 4.02 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 106.799 -1.556 . . . . 10.0 106.799 179.954 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.42 ' CZ ' ' HB3' ' A' ' 58' ' ' ARG . 0.0 OUTLIER 50.95 80.11 0.08 Allowed 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 114.471 1.286 . . . . 10.0 114.471 -179.822 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 59' ' ' ASN . . . . . 0.401 ' OD1' ' N ' ' A' ' 59' ' ' ASN . 4.8 p-10 -71.94 90.62 1.15 Allowed 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 113.747 -1.57 . . . . 10.0 112.206 179.787 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 25.6 p90 -75.32 130.1 38.5 Favored 'General case' 0 C--N 1.321 -0.648 0 O-C-N 126.638 2.461 . . . . 10.0 105.483 -179.854 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.471 HG22 ' N ' ' A' ' 62' ' ' MET . 6.2 mm -104.34 164.28 3.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 O-C-N 121.409 -0.807 . . . . 10.0 111.277 -179.716 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.471 ' N ' HG22 ' A' ' 61' ' ' ILE . 27.7 mmm -144.78 150.98 38.13 Favored 'General case' 0 N--CA 1.442 -0.827 0 N-CA-C 107.291 -1.374 . . . . 10.0 107.291 179.992 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -133.52 88.5 2.49 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 103.684 -2.71 . . . . 10.0 103.684 179.953 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -76.34 178.47 6.49 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 119.619 -1.926 . . . . 10.0 114.474 179.961 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 10.5 mt-30 -147.35 113.98 6.03 Favored 'General case' 0 C--N 1.315 -0.893 0 O-C-N 128.764 3.79 . . . . 10.0 103.187 -179.86 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -62.05 137.52 23.88 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 O-C-N 124.38 1.05 . . . . 10.0 113.721 -179.846 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.99 -25.16 0.67 Allowed Glycine 0 C--O 1.218 -0.869 0 CA-C-O 117.025 -1.986 . . . . 10.0 116.281 179.804 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 15.2 mttp -91.78 160.33 15.38 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 120.492 2.146 . . . . 10.0 116.7 -179.777 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -69.05 158.74 34.2 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 107.947 -1.131 . . . . 10.0 107.947 -179.955 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 45.9 t80 -165.95 113.11 0.91 Allowed 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 113.994 -1.457 . . . . 10.0 113.24 -179.583 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -79.73 145.84 32.7 Favored 'General case' 0 C--N 1.314 -0.955 0 O-C-N 125.181 1.551 . . . . 10.0 107.525 -179.79 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.646 ' OE2' HD23 ' A' ' 74' ' ' LEU . 13.8 tt0 -107.1 -42.24 4.93 Favored 'General case' 0 C--O 1.24 0.591 0 N-CA-C 117.193 2.294 . . . . 10.0 117.193 -179.922 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.434 ' HA ' ' HA ' ' A' ' 81' ' ' LYS . 6.3 t70 53.08 35.95 20.97 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.467 0.651 . . . . 10.0 110.695 179.777 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.646 HD23 ' OE2' ' A' ' 72' ' ' GLU . 0.3 OUTLIER -46.28 117.54 1.61 Allowed 'General case' 0 C--N 1.32 -0.708 0 O-C-N 120.555 -1.341 . . . . 10.0 114.167 179.894 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -129.32 8.24 5.48 Favored 'General case' 0 CA--C 1.514 -0.418 0 O-C-N 121.61 -0.681 . . . . 10.0 109.909 179.956 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 76' ' ' GLY . . . . . 0.439 ' H ' HD13 ' A' ' 74' ' ' LEU . . . -78.94 -43.54 10.95 Favored Glycine 0 CA--C 1.5 -0.902 0 CA-C-O 117.505 -1.719 . . . . 10.0 110.453 -179.749 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.7 pp -142.44 142.2 27.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 CA-C-N 118.775 1.287 . . . . 10.0 107.917 179.848 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 75.34 -59.02 0.55 Allowed 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.639 0.733 . . . . 10.0 111.632 179.709 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 87.06 82.77 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 115.44 1.645 . . . . 10.0 115.44 179.926 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 3.4 ptt85 -155.32 143.29 19.99 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 113.985 -1.462 . . . . 10.0 111.026 179.767 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.434 ' HA ' ' HA ' ' A' ' 73' ' ' ASP . 4.3 ptpp? -95.21 175.81 6.46 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 103.731 -2.692 . . . . 10.0 103.731 179.894 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 6.0 p -177.84 158.72 1.32 Allowed 'General case' 0 C--O 1.213 -0.82 0 N-CA-C 106.344 -1.725 . . . . 10.0 106.344 179.824 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.6 ttm -105.57 117.83 35.01 Favored 'General case' 0 C--N 1.329 -0.323 1 N-CA-C 98.683 -4.562 . . . . 10.0 98.683 179.998 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 43.0 m -121.24 124.09 43.81 Favored 'General case' 0 C--O 1.215 -0.745 0 CA-C-N 112.068 -2.333 . . . . 10.0 117.113 -179.743 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.53 121.52 36.73 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 114.397 -1.274 . . . . 10.0 108.065 179.919 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 13.8 t -98.01 104.89 16.49 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.875 0 N-CA-C 105.488 -2.041 . . . . 10.0 105.488 -179.819 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -110.59 -178.65 3.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 122.238 1.018 . . . . 10.0 113.358 179.956 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 19.0 m0 -111.91 134.24 53.6 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 112.883 -1.962 . . . . 10.0 107.446 179.75 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -102.95 -58.94 1.79 Allowed 'General case' 0 C--O 1.246 0.892 0 N-CA-C 102.879 -3.008 . . . . 10.0 102.879 179.954 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 157.73 90.01 0.07 OUTLIER Glycine 0 CA--C 1.504 -0.614 0 N-CA-C 105.96 -2.856 . . . . 10.0 105.96 179.819 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 65.9 47.0 2.12 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 108.084 -1.08 . . . . 10.0 108.084 -179.904 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 25.6 mtmt -169.37 124.63 0.85 Allowed 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 125.51 1.524 . . . . 10.0 108.724 -179.991 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.412 ' CD1' ' CE2' ' A' ' 4' ' ' PHE . 0.3 OUTLIER -82.71 77.56 9.45 Favored 'General case' 0 CA--C 1.515 -0.394 0 O-C-N 126.451 2.344 . . . . 10.0 107.576 179.934 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.59 105.88 7.91 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 114.561 -1.199 . . . . 10.0 112.487 -179.982 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -108.45 138.48 44.68 Favored 'General case' 0 C--N 1.341 0.23 0 O-C-N 125.129 1.518 . . . . 10.0 112.598 -179.912 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 40.9 t -125.57 131.93 71.52 Favored 'Isoleucine or valine' 0 C--O 1.242 0.67 0 CA-C-O 124.457 2.075 . . . . 10.0 109.367 179.711 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.438 ' CG ' ' HA2' ' A' ' 105' ' ' GLY . 0.0 OUTLIER -134.95 141.2 46.21 Favored 'General case' 0 C--O 1.242 0.678 0 O-C-N 120.231 -1.543 . . . . 10.0 107.159 179.876 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 9.9 pttp -149.33 110.89 4.49 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 122.586 1.184 . . . . 10.0 111.08 179.988 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -163.37 74.49 0.18 Allowed Glycine 0 C--O 1.221 -0.691 0 O-C-N 119.653 -1.904 . . . . 10.0 112.135 -179.958 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 94.6 23.33 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.579 0 O-C-N 127.458 2.505 . . . . 10.0 115.024 179.791 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.427 ' CE ' ' HA ' ' A' ' 101' ' ' LYS . 0.0 OUTLIER -139.33 -155.49 0.6 Allowed 'General case' 0 N--CA 1.471 0.585 0 O-C-N 126.379 2.3 . . . . 10.0 110.982 -179.948 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -136.77 -57.24 0.73 Allowed 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 125.309 1.443 . . . . 10.0 113.564 -179.979 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -109.31 42.5 1.94 Allowed Glycine 0 N--CA 1.449 -0.436 0 N-CA-C 119.333 2.493 . . . . 10.0 119.333 -179.808 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 3.1 mtm180 -88.18 168.02 13.11 Favored 'General case' 0 C--O 1.244 0.805 0 O-C-N 120.71 -1.465 . . . . 10.0 110.805 -179.961 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 105' ' ' GLY . . . . . 0.438 ' HA2' ' CG ' ' A' ' 97' ' ' GLN . . . 120.96 139.02 5.63 Favored Glycine 0 N--CA 1.45 -0.426 0 N-CA-C 108.638 -1.785 . . . . 10.0 108.638 -179.819 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 106' ' ' TRP . . . . . 0.48 ' CD1' ' CG ' ' A' ' 119' ' ' MET . 3.1 m0 -104.93 176.5 5.14 Favored 'General case' 0 C--N 1.316 -0.87 0 O-C-N 119.959 -1.906 . . . . 10.0 109.096 -179.754 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 4.5 m -140.62 120.31 13.38 Favored 'General case' 0 C--O 1.222 -0.347 0 O-C-N 126.69 2.493 . . . . 10.0 107.074 179.915 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -108.65 133.31 52.93 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 114.342 -1.299 . . . . 10.0 109.676 -179.979 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 2.0 t90 -138.8 113.27 8.9 Favored 'General case' 0 CA--C 1.502 -0.882 0 O-C-N 125.783 1.927 . . . . 10.0 109.19 179.645 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -82.97 128.51 38.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 121.994 0.902 . . . . 10.0 111.651 -179.981 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -127.05 88.16 2.77 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 122.883 1.325 . . . . 10.0 108.044 179.991 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 53.27 -103.6 0.15 Allowed Glycine 0 C--N 1.346 1.134 0 O-C-N 119.21 -2.181 . . . . 10.0 111.16 -179.79 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.407 ' N ' ' OD1' ' A' ' 113' ' ' ASP . 0.5 OUTLIER -102.17 28.88 5.47 Favored 'General case' 0 N--CA 1.463 0.199 0 C-N-CA 124.378 1.071 . . . . 10.0 113.692 -179.967 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -146.12 145.21 30.43 Favored 'General case' 0 C--N 1.321 -0.669 0 O-C-N 119.73 -1.856 . . . . 10.0 109.68 179.989 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 1.068 ' HG ' HG11 ' A' ' 133' ' ' VAL . 0.1 OUTLIER -107.75 133.96 51.39 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 104.593 -2.373 . . . . 10.0 104.593 -179.559 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -120.72 95.78 4.85 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 106.022 -1.844 . . . . 10.0 106.022 -179.969 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 5.0 tp -101.29 134.0 45.01 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 113.811 -1.54 . . . . 10.0 108.907 179.929 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -133.61 100.83 4.91 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 105.059 -2.2 . . . . 10.0 105.059 179.685 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.48 ' CG ' ' CD1' ' A' ' 106' ' ' TRP . 2.2 ttm -96.39 139.4 32.57 Favored 'General case' 0 CA--C 1.504 -0.821 0 O-C-N 126.449 2.343 . . . . 10.0 113.435 -179.907 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.409 ' O ' ' HB2' ' A' ' 121' ' ' ALA . 3.2 ptt180 -131.27 177.92 7.1 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 114.004 1.113 . . . . 10.0 114.004 -179.998 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 121' ' ' ALA . . . . . 0.409 ' HB2' ' O ' ' A' ' 120' ' ' ARG . . . 174.19 132.07 0.03 OUTLIER 'General case' 0 C--N 1.319 -0.755 0 O-C-N 124.526 1.142 . . . . 10.0 108.908 179.647 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 122' ' ' GLU . . . . . 0.403 ' HB3' ' HB1' ' A' ' 22' ' ' ALA . 2.6 tm-20 44.97 51.82 8.52 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 116.272 1.953 . . . . 10.0 116.272 -179.918 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 66.19 24.12 71.79 Favored Glycine 0 CA--C 1.534 1.243 0 CA-C-N 114.316 -1.311 . . . . 10.0 114.854 -179.77 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 1.6 t -136.86 118.85 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 CA-C-O 123.796 1.76 . . . . 10.0 107.326 179.962 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 125' ' ' THR . . . . . 0.441 HG22 ' N ' ' A' ' 126' ' ' CYS . 18.7 m -94.55 159.05 15.26 Favored 'General case' 0 C--N 1.314 -0.937 0 C-N-CA 125.507 1.523 . . . . 10.0 110.575 -179.977 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 126' ' ' CYS . . . . . 0.441 ' N ' HG22 ' A' ' 125' ' ' THR . 0.0 OUTLIER -149.52 153.64 37.52 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 127.829 3.206 . . . . 10.0 105.218 -179.816 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 25.3 mttp -151.5 123.44 8.1 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 113.719 1.007 . . . . 10.0 113.719 179.728 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -109.89 118.72 37.23 Favored 'General case' 0 C--N 1.319 -0.747 0 O-C-N 126.658 2.474 . . . . 10.0 109.432 -179.866 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 90.7 t -83.3 118.75 31.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 119.218 -0.993 . . . . 10.0 110.635 -179.741 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 130' ' ' PHE . . . . . 0.448 ' HB3' ' HB2' ' A' ' 115' ' ' LEU . 0.4 OUTLIER -103.3 133.3 48.59 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 114.147 -1.388 . . . . 10.0 109.095 -179.915 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.463 ' HB3' ' HG2' ' A' ' 9' ' ' LYS . 0.0 OUTLIER -110.15 130.68 55.5 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 105.076 -2.194 . . . . 10.0 105.076 179.577 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 132' ' ' LYS . . . . . 0.509 ' HB2' ' HE3' ' A' ' 9' ' ' LYS . 25.7 tptt 74.84 161.18 0.24 Allowed 'General case' 0 C--O 1.211 -0.923 0 CA-C-O 116.743 -1.599 . . . . 10.0 107.03 -178.766 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 133' ' ' VAL . . . . . 1.068 HG11 ' HG ' ' A' ' 115' ' ' LEU . 7.6 p 146.25 57.77 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.31 -1.113 1 O-C-N 130.125 4.641 . . . . 10.0 109.298 -179.529 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 134' ' ' HIS . . . . . 0.429 ' HA ' ' HA2' ' A' ' 6' ' ' GLY . 18.8 t-80 . . . . . 0 C--N 1.314 -0.966 1 O-C-N 129.245 4.091 . . . . 10.0 108.989 179.825 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo . . . . . 0 N--CA 1.485 1.021 0 CA-C-O 122.229 0.845 . . . . 10.0 114.268 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER 153.57 131.0 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 C-N-CA 126.996 2.119 . . . . 10.0 107.78 179.681 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -155.3 121.27 5.13 Favored 'General case' 0 C--N 1.318 -0.779 0 O-C-N 126.578 2.424 . . . . 10.0 111.765 -179.749 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.404 ' CE2' HD12 ' A' ' 110' ' ' ILE . 55.7 m-85 -78.22 -43.57 28.04 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 116.428 2.01 . . . . 10.0 116.428 -179.952 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 10.1 m-20 -43.23 125.18 3.63 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-O 116.954 -1.498 . . . . 10.0 114.796 179.798 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 160.58 -99.25 0.18 Allowed Glycine 0 CA--C 1.531 1.083 0 O-C-N 125.5 1.75 . . . . 10.0 116.899 179.96 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -175.04 128.69 0.29 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 101.579 -3.489 . . . . 10.0 101.579 -179.823 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.615 ' CD2' HD12 ' A' ' 115' ' ' LEU . 82.0 m95 -127.16 114.1 17.25 Favored 'General case' 0 C--N 1.322 -0.608 0 O-C-N 126.78 2.55 . . . . 10.0 111.824 179.727 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.1 175.33 7.78 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 107.306 -1.368 . . . . 10.0 107.306 179.81 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -114.9 149.34 37.35 Favored 'General case' 0 C--O 1.241 0.606 0 N-CA-C 116.306 1.965 . . . . 10.0 116.306 -179.893 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.1 tt -114.84 -0.74 13.39 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 114.212 -1.358 . . . . 10.0 109.582 -179.88 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.1 t 173.83 156.32 0.12 Allowed 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 117.287 2.329 . . . . 10.0 117.287 -179.389 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -146.78 122.31 10.41 Favored 'General case' 0 C--N 1.322 -0.624 0 O-C-N 126.158 2.161 . . . . 10.0 105.289 -179.883 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.2 tt0 -135.81 144.01 45.48 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 115.991 1.849 . . . . 10.0 115.991 179.489 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 62.0 29.36 17.69 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 125.036 1.46 . . . . 10.0 111.799 179.832 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.451 ' CE1' ' HG3' ' A' ' 17' ' ' GLU . 1.7 p90 -76.18 -26.26 56.01 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-O 118.527 -0.749 . . . . 10.0 112.281 179.892 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.451 ' HG3' ' CE1' ' A' ' 16' ' ' PHE . 5.0 mt-10 -71.25 -32.14 68.39 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 122.848 1.308 . . . . 10.0 111.968 179.932 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -78.91 -29.18 44.09 Favored 'General case' 0 C--O 1.215 -0.74 0 CA-C-N 113.37 -1.741 . . . . 10.0 108.103 -179.832 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.43 ' CE1' HD23 ' A' ' 20' ' ' LEU . 0.1 OUTLIER -65.92 -35.81 81.65 Favored 'General case' 0 C--O 1.247 0.956 0 O-C-N 124.213 0.946 . . . . 10.0 110.12 -179.934 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.43 HD23 ' CE1' ' A' ' 19' ' ' TYR . 4.2 mt -77.02 -33.47 57.44 Favored 'General case' 0 C--O 1.22 -0.48 0 CA-C-O 121.692 0.758 . . . . 10.0 109.598 -179.858 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.31 -23.93 60.33 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 107.672 -1.233 . . . . 10.0 107.672 -179.877 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.14 -34.69 66.23 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 126.016 2.073 . . . . 10.0 111.968 -179.699 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -119.28 7.81 11.33 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 119.23 0.923 . . . . 10.0 113.439 179.883 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 t0 55.53 78.16 0.2 Allowed 'General case' 0 N--CA 1.475 0.808 0 O-C-N 124.92 1.387 . . . . 10.0 112.34 -179.831 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.556 HG22 ' O ' ' A' ' 25' ' ' VAL . 2.9 p -118.74 54.29 0.25 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.506 0 CA-C-O 124.057 1.884 . . . . 10.0 107.464 179.737 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 60.14 146.08 0.01 OUTLIER 'General case' 0 C--O 1.225 -0.185 0 N-CA-C 118.655 2.835 . . . . 10.0 118.655 179.328 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 33.7 m -76.04 -30.77 20.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 113.417 -1.719 . . . . 10.0 113.237 179.892 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.27 -28.64 67.38 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 119.885 -1.759 . . . . 10.0 111.576 179.861 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.552 HD22 HG22 ' A' ' 25' ' ' VAL . 7.8 tp -77.87 -32.74 52.13 Favored 'General case' 0 N--CA 1.447 -0.595 0 O-C-N 123.847 0.717 . . . . 10.0 112.486 179.83 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 15.8 ttp85 -64.54 -32.87 74.7 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 124.446 2.07 . . . . 10.0 113.065 179.825 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -74.16 -41.16 61.96 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 113.794 -1.548 . . . . 10.0 111.058 -179.829 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.669 HG21 ' CE2' ' A' ' 57' ' ' PHE . 4.8 mm -74.89 -49.27 29.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 C-N-CA 125.136 1.375 . . . . 10.0 111.488 179.709 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -58.18 -40.51 81.68 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 117.643 -1.17 . . . . 10.0 112.746 -179.906 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.433 ' HA ' ' CZ ' ' A' ' 16' ' ' PHE . 0.1 OUTLIER -52.37 -29.88 26.1 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 120.41 1.459 . . . . 10.0 111.993 -179.486 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -109.0 23.99 13.76 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 119.481 1.037 . . . . 10.0 109.703 -179.777 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 2.3 tt -123.76 132.66 53.85 Favored 'General case' 0 CA--C 1.522 -0.122 0 O-C-N 125.21 1.568 . . . . 10.0 108.925 179.93 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 4.4 mmtp -119.66 106.02 42.62 Favored Pre-proline 0 N--CA 1.477 0.895 0 N-CA-C 104.644 -2.354 . . . . 10.0 104.644 179.66 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -66.6 -145.84 0.02 OUTLIER 'Trans proline' 0 C--N 1.356 0.95 0 C-N-CA 123.962 3.108 . . . . 10.0 117.522 -179.84 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 179.68 113.27 0.04 OUTLIER 'General case' 0 C--O 1.238 0.455 0 N-CA-C 106.236 -1.765 . . . . 10.0 106.236 -179.797 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.6 mmtp -80.08 168.56 18.99 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 117.401 -1.285 . . . . 10.0 111.825 -179.879 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -164.63 149.94 9.98 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 104.796 -2.298 . . . . 10.0 104.796 179.912 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 3.6 mm -133.69 154.58 38.79 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.632 0 N-CA-C 113.343 0.868 . . . . 10.0 113.343 -179.684 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.447 ' CG2' ' HD3' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -148.02 129.66 6.15 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 N-CA-C 105.7 -1.963 . . . . 10.0 105.7 179.576 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.472 ' HG2' ' HA ' ' A' ' 48' ' ' HIS . 0.8 OUTLIER -109.71 122.85 48.42 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-O 122.863 1.316 . . . . 10.0 111.029 -179.93 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -166.04 146.68 6.56 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 116.055 -1.926 . . . . 10.0 108.493 -179.941 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 74.19 -109.54 2.82 Favored Glycine 0 CA--C 1.537 1.417 0 O-C-N 126.119 2.137 . . . . 10.0 109.7 179.946 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.542 ' CB ' ' HB3' ' A' ' 65' ' ' GLN 0.256 2.8 m-20 -96.79 26.03 4.84 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 113.853 -1.174 . . . . 10.0 108.843 179.228 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 48' ' ' HIS . . . . . 0.472 ' HA ' ' HG2' ' A' ' 44' ' ' GLN . 8.3 m-70 77.01 -163.46 0.04 OUTLIER 'General case' 0 N--CA 1.434 -1.24 0 C-N-CA 126.695 1.998 . . . . 10.0 111.409 176.465 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.498 ' HG2' ' CD1' ' A' ' 51' ' ' ILE . 4.9 ttm 10.01 123.06 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.057 0 O-C-N 129.046 3.966 . . . . 10.0 119.261 -177.879 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 11.8 mt -144.53 106.46 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.865 0 N-CA-C 102.408 -3.182 . . . . 10.0 102.408 179.104 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.498 ' CD1' ' HG2' ' A' ' 49' ' ' MET . 1.2 mp -96.08 131.85 41.82 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.054 0 CA-C-O 124.846 2.26 . . . . 10.0 112.123 -178.795 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.606 HH21 HD11 ' A' ' 54' ' ' LEU . 0.0 OUTLIER -120.14 139.86 51.98 Favored 'General case' 0 N--CA 1.43 -1.466 0 CA-C-N 112.392 -2.186 . . . . 10.0 110.139 179.264 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 92.2 m -120.35 145.7 46.88 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 102.501 -3.148 . . . . 10.0 102.501 -179.86 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.606 HD11 HH21 ' A' ' 52' ' ' ARG . 97.0 mt -139.22 150.45 45.55 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 121.256 3.799 . . . . 10.0 121.256 179.909 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 78.4 p -179.27 174.84 0.99 Allowed 'General case' 0 C--O 1.24 0.577 0 CA-C-N 112.714 -2.039 . . . . 10.0 106.128 179.996 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 16.5 p -71.8 -22.02 61.63 Favored 'General case' 0 C--O 1.241 0.615 0 O-C-N 124.414 1.071 . . . . 10.0 109.892 179.308 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.669 ' CE2' HG21 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -86.11 173.96 9.49 Favored 'General case' 0 C--O 1.245 0.865 0 C-N-CA 125.795 1.638 . . . . 10.0 109.908 -179.919 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -47.35 127.14 10.54 Favored 'General case' 0 C--O 1.241 0.653 0 O-C-N 125.9 2.0 . . . . 10.0 114.159 -179.948 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 10.9 p-10 -100.04 177.31 5.13 Favored 'General case' 0 C--O 1.237 0.421 0 O-C-N 125.683 1.864 . . . . 10.0 108.857 179.794 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.466 ' C ' HD13 ' A' ' 61' ' ' ILE . 9.8 p90 -159.24 143.08 14.99 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 103.269 -2.863 . . . . 10.0 103.269 179.732 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.466 HD13 ' C ' ' A' ' 60' ' ' TYR . 0.1 OUTLIER -115.83 153.43 17.42 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.797 0 CA-C-O 123.679 1.704 . . . . 10.0 110.307 -179.87 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -136.09 -178.63 5.23 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 104.195 -2.521 . . . . 10.0 104.195 179.964 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 34.1 t0 -150.33 122.24 8.17 Favored 'General case' 0 N--CA 1.437 -1.125 0 CA-C-N 113.003 -1.908 . . . . 10.0 106.508 179.888 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.873 ' CD2' HG11 ' A' ' 86' ' ' VAL . 4.8 m-85 -93.67 -96.09 0.15 Allowed 'General case' 0 N--CA 1.44 -0.947 0 C-N-CA 125.629 1.572 . . . . 10.0 114.607 179.429 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.542 ' HB3' ' CB ' ' A' ' 47' ' ' ASP . 27.3 mt-30 84.33 114.01 0.05 Allowed 'General case' 0 C--N 1.298 -1.634 1 O-C-N 131.622 5.576 . . . . 10.0 108.393 -179.679 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 3.2 t -53.56 135.13 15.86 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.726 0 CA-C-N 113.023 -1.899 . . . . 10.0 107.369 179.573 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 63.04 70.5 1.03 Allowed Glycine 0 CA--C 1.53 1.014 0 CA-C-O 117.724 -1.598 . . . . 10.0 116.677 -179.756 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 5.6 tttp -179.43 148.45 0.35 Allowed 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 123.724 1.726 . . . . 10.0 113.715 179.617 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -97.18 133.37 41.91 Favored 'General case' 0 C--O 1.24 0.555 0 CA-C-N 113.129 -1.85 . . . . 10.0 109.662 -179.882 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.476 ' CD1' ' N ' ' A' ' 70' ' ' PHE . 1.0 OUTLIER -146.27 103.29 3.69 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 119.205 0.911 . . . . 10.0 111.345 -179.5 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.12 126.09 26.17 Favored 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 106.325 -1.731 . . . . 10.0 106.325 -179.77 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.426 ' OE1' HD12 ' A' ' 74' ' ' LEU . 2.2 mm-40 -109.72 96.07 6.02 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 112.407 0.521 . . . . 10.0 112.407 179.93 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -76.65 81.07 3.3 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 105.48 -2.044 . . . . 10.0 105.48 179.992 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.426 HD12 ' OE1' ' A' ' 72' ' ' GLU . 1.5 mp -67.43 120.94 14.74 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-N 112.479 -2.146 . . . . 10.0 113.248 179.946 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.452 HG23 ' O ' ' A' ' 75' ' ' THR . 1.2 t -159.83 100.18 1.42 Allowed 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 105.619 -1.993 . . . . 10.0 105.619 -179.924 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -167.69 -46.26 0.03 OUTLIER Glycine 0 N--CA 1.443 -0.884 0 O-C-N 127.277 2.86 . . . . 10.0 111.384 179.932 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 16.0 mt -137.97 -71.53 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 N-CA-C 107.517 -1.29 . . . . 10.0 107.517 -179.994 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -76.41 -22.14 55.09 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 125.585 1.803 . . . . 10.0 113.063 -179.981 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 60.16 -162.63 0.26 Allowed 'General case' 0 N--CA 1.478 0.937 0 CA-C-O 116.903 -1.522 . . . . 10.0 112.136 179.984 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 12.4 ttm105 74.89 137.07 0.06 Allowed 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 121.023 1.738 . . . . 10.0 109.394 -179.678 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.51 164.22 12.35 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 107.874 -1.158 . . . . 10.0 107.874 -179.874 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -162.33 159.47 25.48 Favored 'General case' 0 C--O 1.218 -0.581 0 N-CA-C 105.561 -2.014 . . . . 10.0 105.561 -179.984 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 2.6 ttp -122.24 124.92 44.92 Favored 'General case' 0 N--CA 1.448 -0.554 1 N-CA-C 99.066 -4.42 . . . . 10.0 99.066 -179.838 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.459 HG22 ' CZ ' ' A' ' 70' ' ' PHE . 1.1 m -124.77 137.66 54.31 Favored 'General case' 0 C--O 1.214 -0.77 0 N-CA-C 118.828 2.899 . . . . 10.0 118.828 -179.411 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -124.47 143.63 50.54 Favored 'General case' 0 CA--C 1.502 -0.9 0 N-CA-C 104.793 -2.299 . . . . 10.0 104.793 -179.754 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.873 HG11 ' CD2' ' A' ' 64' ' ' PHE . 3.0 m -123.55 146.62 28.66 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 N-CA-C 102.279 -3.23 . . . . 10.0 102.279 179.932 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 6.0 p -143.91 104.24 4.13 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 113.942 -1.481 . . . . 10.0 111.01 179.965 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 13.8 p-90 -61.74 137.75 58.27 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 104.987 -2.227 . . . . 10.0 104.987 -179.876 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -102.63 -54.91 2.55 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 102.624 -3.102 . . . . 10.0 102.624 179.794 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -168.94 -86.2 0.06 OUTLIER Glycine 0 CA--C 1.501 -0.836 0 N-CA-C 107.023 -2.431 . . . . 10.0 107.023 -179.912 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -102.49 14.0 33.08 Favored 'General case' 0 N--CA 1.446 -0.634 0 O-C-N 124.748 0.911 . . . . 10.0 112.566 -179.884 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -136.65 174.29 10.78 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 123.627 1.679 . . . . 10.0 108.633 -179.86 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -144.85 136.75 25.77 Favored 'General case' 0 C--O 1.216 -0.658 0 CA-C-N 114.549 -1.205 . . . . 10.0 107.949 179.847 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -126.18 149.23 49.15 Favored 'General case' 0 C--O 1.212 -0.906 0 CA-C-N 115.446 -0.797 . . . . 10.0 113.101 179.993 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -139.2 122.83 17.43 Favored 'General case' 0 C--N 1.321 -0.658 0 O-C-N 125.594 1.809 . . . . 10.0 113.219 179.85 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 14.1 t -111.68 113.93 45.6 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 N-CA-C 106.212 -1.773 . . . . 10.0 106.212 179.727 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -90.81 79.96 5.91 Favored 'General case' 0 C--O 1.245 0.826 0 O-C-N 125.118 1.511 . . . . 10.0 108.002 -179.949 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 24.5 ttpp -75.94 89.12 2.93 Favored 'General case' 0 CA--C 1.521 -0.159 0 C-N-CA 124.98 1.312 . . . . 10.0 113.352 -179.919 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -119.91 -65.28 0.27 Allowed Glycine 0 N--CA 1.436 -1.304 0 C-N-CA 125.498 1.523 . . . . 10.0 110.881 179.968 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -148.41 -32.18 0.25 Allowed 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 115.693 1.738 . . . . 10.0 115.693 -179.892 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 61.3 mmtt -80.1 -175.82 5.22 Favored 'General case' 0 C--O 1.215 -0.722 0 N-CA-C 115.115 1.524 . . . . 10.0 115.115 -179.856 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -105.88 -29.48 9.97 Favored 'General case' 0 N--CA 1.452 -0.358 0 O-C-N 125.833 1.958 . . . . 10.0 114.628 179.961 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -113.2 -18.62 7.12 Favored Glycine 0 N--CA 1.465 0.63 0 CA-C-O 118.411 -1.216 . . . . 10.0 115.825 -179.911 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -48.16 109.14 0.2 Allowed 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 120.329 2.065 . . . . 10.0 113.216 -179.918 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 177.55 149.13 7.69 Favored Glycine 0 N--CA 1.448 -0.554 0 N-CA-C 109.539 -1.424 . . . . 10.0 109.539 -179.688 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 9.3 m0 -111.21 121.18 44.62 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 118.708 1.254 . . . . 10.0 109.949 -179.987 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 60.2 m -104.59 108.9 20.58 Favored 'General case' 0 CA--C 1.499 -1.005 0 O-C-N 123.924 0.765 . . . . 10.0 109.259 179.586 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 -88.37 156.52 19.1 Favored 'General case' 0 C--O 1.245 0.835 0 C-N-CA 124.909 1.284 . . . . 10.0 108.237 179.719 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 109' ' ' TRP . . . . . 0.428 ' CD1' ' C ' ' A' ' 109' ' ' TRP . 2.4 t90 -175.46 104.65 0.08 Allowed 'General case' 0 C--O 1.215 -0.741 0 O-C-N 121.306 -0.872 . . . . 10.0 109.141 179.771 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.404 HD12 ' CE2' ' A' ' 4' ' ' PHE . 5.1 mt -78.49 146.47 8.08 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 125.799 2.714 . . . . 10.0 114.519 179.79 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -133.68 78.77 1.79 Allowed 'General case' 0 C--O 1.222 -0.366 0 CA-C-N 113.579 -1.646 . . . . 10.0 108.226 -179.779 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 73.62 -101.89 1.23 Allowed Glycine 0 N--CA 1.449 -0.443 0 N-CA-C 108.22 -1.952 . . . . 10.0 108.22 179.889 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -112.88 21.98 14.92 Favored 'General case' 0 C--O 1.214 -0.797 0 O-C-N 124.928 1.016 . . . . 10.0 109.596 179.889 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -127.71 139.92 52.39 Favored 'General case' 0 C--O 1.216 -0.683 0 CA-C-O 122.64 1.209 . . . . 10.0 110.131 -179.829 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.615 HD12 ' CD2' ' A' ' 8' ' ' TRP . 0.2 OUTLIER -105.58 125.18 50.69 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 114.402 -1.272 . . . . 10.0 109.135 -179.988 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 40.1 t-80 -111.44 101.69 10.12 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 106.491 -1.67 . . . . 10.0 106.491 179.684 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.601 ' O ' HD23 ' A' ' 117' ' ' LEU . 2.0 tt -112.7 126.3 55.24 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 122.415 1.102 . . . . 10.0 113.075 179.989 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -112.59 103.75 11.82 Favored 'General case' 0 CA--C 1.505 -0.781 0 O-C-N 119.891 -1.755 . . . . 10.0 108.272 179.951 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 1.4 ttm -94.23 161.29 14.32 Favored 'General case' 0 CA--C 1.509 -0.601 0 N-CA-C 108.184 -1.043 . . . . 10.0 108.184 -179.923 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 49.9 mtm180 -150.13 -177.37 5.89 Favored 'General case' 0 C--N 1.316 -0.874 0 C-N-CA 125.135 1.374 . . . . 10.0 114.348 179.915 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 165.67 129.92 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.493 0 O-C-N 128.141 3.401 . . . . 10.0 107.985 -179.989 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 53.51 36.21 22.7 Favored 'General case' 0 C--O 1.244 0.787 0 N-CA-C 114.813 1.412 . . . . 10.0 114.813 179.853 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 81.3 -6.69 63.01 Favored Glycine 0 CA--C 1.529 0.914 0 CA-C-O 116.052 -2.527 . . . . 10.0 114.671 -179.818 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -82.02 157.08 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 CA-C-N 119.041 1.421 . . . . 10.0 109.573 -179.854 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 3.5 m -127.5 114.17 17.1 Favored 'General case' 0 C--O 1.239 0.522 0 O-C-N 126.367 2.292 . . . . 10.0 113.074 179.781 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -120.57 151.86 38.86 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 105.908 -1.886 . . . . 10.0 105.908 -179.779 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.61 154.87 51.29 Favored 'General case' 0 C--O 1.224 -0.26 0 O-C-N 125.271 1.607 . . . . 10.0 113.114 -179.905 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 128' ' ' GLN . . . . . 0.457 ' HB2' HD22 ' A' ' 117' ' ' LEU . 0.4 OUTLIER -145.63 109.63 4.86 Favored 'General case' 0 C--N 1.323 -0.546 0 O-C-N 126.267 2.229 . . . . 10.0 108.378 179.662 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 16.9 t -91.22 140.37 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 N-CA-C 107.935 -1.135 . . . . 10.0 107.935 -179.613 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -123.84 169.44 11.57 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 119.221 -0.418 . . . . 10.0 111.008 179.721 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -141.48 124.74 16.48 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 105.789 -1.93 . . . . 10.0 105.789 -179.988 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 132' ' ' LYS . . . . . 0.515 ' HB2' ' CZ3' ' A' ' 8' ' ' TRP . 13.7 tttt -78.4 132.0 37.18 Favored 'General case' 0 C--N 1.324 -0.533 0 O-C-N 121.365 -0.834 . . . . 10.0 110.495 -179.893 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 2.2 t -107.31 -54.7 5.78 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 N-CA-C 115.009 1.485 . . . . 10.0 115.009 179.94 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 6.1 t-160 . . . . . 0 C--O 1.252 1.216 0 CA-C-O 117.143 -1.408 . . . . 10.0 113.37 -179.907 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 . . . . . 0 CA--C 1.534 0.341 0 N-CA-C 113.569 0.952 . . . . 10.0 113.569 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 26.5 m-85 -40.14 -22.56 0.01 OUTLIER 'General case' 0 C--O 1.245 0.819 0 N-CA-C 117.844 2.535 . . . . 10.0 117.844 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -49.05 104.77 0.07 Allowed 'General case' 0 N--CA 1.475 0.775 0 O-C-N 125.738 1.899 . . . . 10.0 111.248 179.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -152.21 -163.44 11.57 Favored Glycine 0 N--CA 1.449 -0.458 0 N-CA-C 118.194 2.038 . . . . 10.0 118.194 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -135.31 110.85 9.17 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 100.843 -3.762 . . . . 10.0 100.843 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.604 ' CE2' HD21 ' A' ' 115' ' ' LEU . 46.5 m0 -112.63 116.43 30.17 Favored 'General case' 0 CA--C 1.506 -0.747 0 O-C-N 124.095 0.872 . . . . 10.0 112.373 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.78 148.63 22.42 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 117.658 -1.163 . . . . 10.0 107.946 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 2.6 mtt -86.03 128.66 34.9 Favored 'General case' 0 C--N 1.314 -0.942 0 O-C-N 126.671 2.482 . . . . 10.0 111.411 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.436 HD23 ' HA ' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -104.5 -53.12 2.77 Favored 'General case' 0 C--N 1.317 -0.813 0 O-C-N 124.914 1.384 . . . . 10.0 108.053 179.809 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -118.09 -172.36 2.24 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 113.53 0.937 . . . . 10.0 113.53 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 177.43 104.97 0.02 OUTLIER 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 106.655 -1.609 . . . . 10.0 106.655 179.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -107.2 151.13 25.83 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 116.551 2.056 . . . . 10.0 116.551 -179.793 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 34.03 34.33 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 116.647 2.091 . . . . 10.0 116.647 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -71.04 -29.99 66.05 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 115.554 1.687 . . . . 10.0 115.554 -179.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -75.38 -36.38 60.91 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 121.197 -0.939 . . . . 10.0 111.641 179.721 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -74.49 -23.45 58.86 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 107.785 -1.191 . . . . 10.0 107.785 -179.693 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.443 ' CZ ' HD11 ' A' ' 23' ' ' LEU . 2.4 t80 -69.36 -34.81 75.13 Favored 'General case' 0 CA--C 1.552 1.054 0 N-CA-C 108.492 -0.929 . . . . 10.0 108.492 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 34.6 mt -79.0 -28.84 43.44 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 108.821 -0.807 . . . . 10.0 108.821 179.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.6 ttt180 -73.83 -35.96 64.87 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 114.312 -1.313 . . . . 10.0 108.65 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.29 -33.65 71.81 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 126.695 2.497 . . . . 10.0 110.879 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.443 HD11 ' CZ ' ' A' ' 19' ' ' TYR . 6.7 mt -91.32 5.38 49.46 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 115.179 -0.919 . . . . 10.0 109.124 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 52.72 38.09 25.4 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 116.707 2.114 . . . . 10.0 116.707 -179.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 1.4 m -79.79 179.11 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 N-CA-C 106.036 -1.839 . . . . 10.0 106.036 179.561 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -72.35 159.49 33.94 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 117.462 2.393 . . . . 10.0 117.462 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.0 m -72.64 -35.46 50.61 Favored 'Isoleucine or valine' 0 C--O 1.242 0.668 0 C-N-CA 125.735 1.614 . . . . 10.0 112.836 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.72 -28.19 64.55 Favored 'General case' 0 N--CA 1.445 -0.724 0 O-C-N 120.286 -1.509 . . . . 10.0 111.558 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 22.9 tp -69.32 -45.23 70.02 Favored 'General case' 0 C--O 1.216 -0.705 0 CA-C-N 114.477 -1.238 . . . . 10.0 110.392 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.17 -20.44 61.59 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-N 113.107 -1.86 . . . . 10.0 112.333 179.854 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.75 -47.4 47.14 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 118.894 -2.379 . . . . 10.0 109.534 -179.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.1 mm -78.95 -44.7 24.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 O-C-N 126.803 2.564 . . . . 10.0 111.21 -179.54 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -55.88 -35.16 66.21 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 116.486 2.032 . . . . 10.0 116.486 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -67.51 -55.4 13.68 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 121.845 2.111 . . . . 10.0 115.668 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -54.57 -21.11 9.35 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-O 117.329 -1.319 . . . . 10.0 112.872 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 25.2 mt -90.55 161.32 15.52 Favored 'General case' 0 CA--C 1.503 -0.861 0 CA-C-O 123.204 1.478 . . . . 10.0 114.841 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.1 mttp -154.29 109.79 2.43 Favored Pre-proline 0 N--CA 1.472 0.646 0 N-CA-C 104.408 -2.441 . . . . 10.0 104.408 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.482 ' HB2' HG22 ' A' ' 53' ' ' THR . 72.5 Cg_endo -81.29 136.92 10.29 Favored 'Trans proline' 0 CA--C 1.535 0.568 0 C-N-CA 123.044 2.496 . . . . 10.0 116.802 179.791 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -91.01 121.79 33.12 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 118.019 -1.472 . . . . 10.0 107.701 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.1 ttpt -84.44 158.78 20.95 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-O 118.654 -0.689 . . . . 10.0 110.399 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -153.87 125.2 7.47 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 105.586 -2.005 . . . . 10.0 105.586 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.496 HD11 ' CZ3' ' A' ' 8' ' ' TRP . 7.9 mt -103.88 143.52 15.6 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.013 0 CA-C-N 120.076 1.307 . . . . 10.0 114.099 -179.761 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 35.7 t -136.97 138.16 46.17 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 N-CA-C 104.672 -2.344 . . . . 10.0 104.672 179.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -152.85 117.3 4.97 Favored 'General case' 0 C--N 1.312 -1.052 0 C-N-CA 124.784 1.234 . . . . 10.0 110.13 -179.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.58 -41.56 26.89 Favored 'General case' 0 C--N 1.321 -0.661 0 O-C-N 119.691 -1.881 . . . . 10.0 108.199 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -174.66 -92.11 0.08 OUTLIER Glycine 0 C--O 1.24 0.522 0 N-CA-C 106.76 -2.536 . . . . 10.0 106.76 -179.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -98.33 17.95 17.56 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 119.299 1.549 . . . . 10.0 109.935 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . 0.679 ' HE1' HD11 ' A' ' 50' ' ' ILE . 0.7 OUTLIER -129.15 121.73 28.34 Favored 'General case' 0 C--O 1.214 -0.766 0 N-CA-C 105.439 -2.06 . . . . 10.0 105.439 179.721 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 7.2 ttp -121.03 133.44 55.25 Favored 'General case' 0 N--CA 1.443 -0.8 0 O-C-N 126.033 2.083 . . . . 10.0 112.759 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.679 HD11 ' HE1' ' A' ' 48' ' ' HIS . 19.3 mt -116.3 120.41 64.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 107.661 -1.237 . . . . 10.0 107.661 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -98.28 109.49 23.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 104.75 -2.315 . . . . 10.0 104.75 179.726 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 4.2 mtt180 -106.54 128.95 54.52 Favored 'General case' 0 N--CA 1.434 -1.265 0 C-N-CA 123.397 0.679 . . . . 10.0 112.112 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.482 HG22 ' HB2' ' A' ' 38' ' ' PRO . 0.2 OUTLIER -125.39 137.91 54.02 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 100.563 -3.865 . . . . 10.0 100.563 179.859 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.3 mp -125.92 92.64 3.63 Favored 'General case' 0 N--CA 1.449 -0.482 1 N-CA-C 123.409 4.596 . . . . 10.0 123.409 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 3.4 p -123.19 144.02 49.64 Favored 'General case' 0 C--N 1.315 -0.931 0 O-C-N 125.958 2.036 . . . . 10.0 105.531 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -69.35 -16.48 63.54 Favored 'General case' 0 C--O 1.22 -0.48 0 CA-C-O 123.209 1.48 . . . . 10.0 107.571 179.742 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -93.36 108.79 20.38 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 107.255 -1.387 . . . . 10.0 107.255 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 15.4 tpp180 36.64 91.87 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 O-C-N 126.074 2.109 . . . . 10.0 114.742 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . 0.432 ' HB2' HD11 ' A' ' 61' ' ' ILE . 0.6 OUTLIER -48.79 122.12 5.35 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-O 123.64 1.686 . . . . 10.0 110.631 179.986 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -102.01 78.13 1.76 Allowed 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 112.87 -1.968 . . . . 10.0 107.959 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.432 HD11 ' HB2' ' A' ' 59' ' ' ASN . 1.4 mm -106.77 133.5 51.15 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 C-N-CA 120.424 -0.51 . . . . 10.0 109.993 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -129.99 151.46 50.52 Favored 'General case' 0 C--N 1.317 -0.834 0 C-N-CA 125.742 1.617 . . . . 10.0 108.378 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -127.33 152.81 46.97 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 101.363 -3.569 . . . . 10.0 101.363 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 4.9 m-30 -146.39 167.89 22.49 Favored 'General case' 0 C--O 1.246 0.911 0 N-CA-C 116.062 1.875 . . . . 10.0 116.062 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 40.2 mm-40 -137.01 117.14 13.39 Favored 'General case' 0 N--CA 1.437 -1.118 0 N-CA-C 104.412 -2.44 . . . . 10.0 104.412 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 47.1 t -73.73 132.25 33.68 Favored 'Isoleucine or valine' 0 C--O 1.241 0.639 0 CA-C-N 115.133 -0.939 . . . . 10.0 112.021 -179.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 77.86 -10.42 25.74 Favored Glycine 0 N--CA 1.437 -1.263 0 C-N-CA 125.299 1.428 . . . . 10.0 116.032 -179.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.6 tmtt? -113.25 126.48 55.45 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 114.514 -0.843 . . . . 10.0 112.218 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -41.82 141.15 0.87 Allowed 'General case' 0 C--N 1.32 -0.681 0 O-C-N 127.604 3.065 . . . . 10.0 112.789 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -124.15 151.34 44.1 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 113.912 -1.494 . . . . 10.0 113.248 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -126.49 151.81 47.31 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 105.994 -1.854 . . . . 10.0 105.994 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -143.32 145.5 32.75 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 117.201 2.297 . . . . 10.0 117.201 -179.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -129.81 124.05 32.4 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 121.487 0.661 . . . . 10.0 109.372 -179.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.492 HD13 HG12 ' A' ' 77' ' ' ILE . 80.5 mt -121.52 139.86 52.95 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 123.906 0.882 . . . . 10.0 111.751 -179.707 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.91 4.46 4.16 Favored 'General case' 0 N--CA 1.443 -0.8 0 O-C-N 120.649 -1.282 . . . . 10.0 109.631 -179.762 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -121.48 -21.23 3.07 Favored Glycine 0 CA--C 1.53 0.986 0 CA-C-O 117.892 -1.504 . . . . 10.0 110.858 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.656 HD13 ' N ' ' A' ' 77' ' ' ILE . 0.0 OUTLIER -124.43 120.17 58.37 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.687 0 CA-C-O 116.4 -1.762 . . . . 10.0 108.011 -179.868 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 3.4 p30 28.5 34.34 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.86 0 O-C-N 126.646 2.466 . . . . 10.0 114.027 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -4.56 81.13 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 127.68 2.392 . . . . 10.0 116.367 -179.592 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.9 158.23 44.91 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 113.095 -1.866 . . . . 10.0 110.265 -179.688 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -120.18 137.59 54.09 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 103.815 -2.661 . . . . 10.0 103.815 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 7.2 p -140.57 166.71 24.0 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.408 -1.269 . . . . 10.0 109.656 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -110.38 116.42 31.4 Favored 'General case' 0 N--CA 1.439 -0.995 1 N-CA-C 99.047 -4.427 . . . . 10.0 99.047 179.878 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 31.9 m -117.49 138.28 51.98 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 123.266 1.508 . . . . 10.0 114.329 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 20.7 m -127.51 123.49 36.01 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 106.238 -1.764 . . . . 10.0 106.238 -179.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 2.6 m -104.63 123.36 58.55 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.661 0 N-CA-C 102.647 -3.094 . . . . 10.0 102.647 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -137.97 178.37 7.17 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 122.724 1.25 . . . . 10.0 110.603 -179.834 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 4.0 p-90 -123.45 109.33 13.71 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 104.288 -2.486 . . . . 10.0 104.288 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -72.55 -55.09 7.47 Favored 'General case' 0 C--N 1.314 -0.974 1 N-CA-C 99.014 -4.439 . . . . 10.0 99.014 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -149.13 -117.57 0.89 Allowed Glycine 0 C--O 1.246 0.849 0 N-CA-C 105.505 -3.038 . . . . 10.0 105.505 -179.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -97.99 49.77 1.02 Allowed 'General case' 0 N--CA 1.461 0.115 0 C-N-CA 118.447 -1.301 . . . . 10.0 111.374 179.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.3 mtmm -147.14 -168.95 3.18 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 124.436 1.094 . . . . 10.0 109.181 -179.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -142.58 151.3 41.4 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 105.819 -1.919 . . . . 10.0 105.819 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 17.5 mt-30 -147.23 150.2 34.39 Favored 'General case' 0 C--O 1.215 -0.743 0 C-N-CA 124.595 1.158 . . . . 10.0 112.256 179.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -138.85 127.95 23.97 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-N 114.517 -1.22 . . . . 10.0 112.882 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 9.1 p -110.11 97.66 6.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 C-N-CA 123.992 0.917 . . . . 10.0 108.955 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -73.89 81.99 1.67 Allowed 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 105.675 -1.972 . . . . 10.0 105.675 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -71.64 97.45 1.73 Allowed 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 114.3 1.222 . . . . 10.0 114.3 -179.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -162.16 -155.26 7.89 Favored Glycine 0 C--N 1.315 -0.604 0 O-C-N 126.104 2.128 . . . . 10.0 110.621 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -64.96 -171.68 0.07 Allowed 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 120.639 0.256 . . . . 10.0 111.657 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 15.2 mmtm 74.97 162.49 0.25 Allowed 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 114.774 1.398 . . . . 10.0 114.774 -179.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -93.41 -32.84 14.08 Favored 'General case' 0 C--O 1.213 -0.824 0 CA-C-O 122.95 1.357 . . . . 10.0 112.446 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -130.78 80.86 0.34 Allowed Glycine 0 C--O 1.221 -0.719 0 C-N-CA 125.391 1.472 . . . . 10.0 115.392 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.49 126.11 46.13 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-O 123.571 1.653 . . . . 10.0 108.681 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 145.0 154.97 6.29 Favored Glycine 0 C--N 1.336 0.528 0 CA-C-O 117.834 -1.537 . . . . 10.0 109.709 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' TRP . . . . . 0.492 ' CD1' ' HG2' ' A' ' 119' ' ' MET . 2.9 m0 -115.81 161.19 19.11 Favored 'General case' 0 C--N 1.314 -0.968 0 O-C-N 127.118 2.305 . . . . 10.0 108.952 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 51.1 m -133.54 130.5 38.54 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 104.974 -2.232 . . . . 10.0 104.974 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -118.09 162.48 18.13 Favored 'General case' 0 C--N 1.318 -0.784 0 O-C-N 127.257 2.848 . . . . 10.0 111.6 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' TRP . . . . . 0.46 ' CD1' ' C ' ' A' ' 109' ' ' TRP . 0.0 OUTLIER 176.99 157.53 0.31 Allowed 'General case' 0 CA--C 1.5 -0.947 0 CA-C-N 114.354 -1.294 . . . . 10.0 107.613 -179.995 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 66.8 mt -121.62 130.88 74.21 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 CA-C-N 115.857 -0.61 . . . . 10.0 111.429 -179.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -111.12 58.99 0.61 Allowed 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 124.136 1.922 . . . . 10.0 107.93 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 77.22 -94.45 1.13 Allowed Glycine 0 CA--C 1.504 -0.634 0 O-C-N 120.478 -1.389 . . . . 10.0 110.739 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -102.93 4.75 37.89 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 114.271 1.211 . . . . 10.0 114.271 -179.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -142.45 139.83 31.73 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 124.013 1.863 . . . . 10.0 115.041 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.604 HD21 ' CE2' ' A' ' 8' ' ' TRP . 4.3 mm? -83.32 144.51 29.64 Favored 'General case' 0 N--CA 1.441 -0.905 0 CA-C-N 112.718 -2.037 . . . . 10.0 109.684 -179.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 8.4 m-70 -131.67 67.66 1.51 Allowed 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 113.319 -1.764 . . . . 10.0 107.375 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.93 154.07 20.8 Favored 'General case' 0 C--N 1.317 -0.82 0 O-C-N 125.06 1.475 . . . . 10.0 113.441 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -135.99 135.63 39.67 Favored 'General case' 0 CA--C 1.502 -0.896 0 N-CA-C 107.352 -1.351 . . . . 10.0 107.352 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.492 ' HG2' ' CD1' ' A' ' 106' ' ' TRP . 3.6 mtt -125.61 123.11 38.3 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-O 123.391 1.567 . . . . 10.0 111.784 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.09 158.29 23.4 Favored 'General case' 0 N--CA 1.443 -0.791 0 O-C-N 119.958 -1.714 . . . . 10.0 112.834 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . 0.567 ' O ' HG22 ' A' ' 124' ' ' VAL . . . -169.34 103.69 0.36 Allowed 'General case' 0 CA--C 1.515 -0.368 0 O-C-N 120.935 -1.103 . . . . 10.0 108.382 -179.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 73.47 13.21 4.57 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.397 1.879 . . . . 10.0 116.029 -179.855 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 107.81 13.75 19.27 Favored Glycine 0 CA--C 1.535 1.301 0 CA-C-O 116.144 -2.476 . . . . 10.0 116.326 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.567 HG22 ' O ' ' A' ' 121' ' ' ALA . 2.7 m -112.91 93.97 2.85 Favored 'Isoleucine or valine' 0 C--O 1.242 0.679 0 CA-C-N 119.869 1.834 . . . . 10.0 113.554 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -78.91 109.94 13.66 Favored 'General case' 0 C--N 1.317 -0.811 0 O-C-N 125.852 1.97 . . . . 10.0 113.809 -179.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -106.57 151.52 24.91 Favored 'General case' 0 N--CA 1.463 0.202 0 N-CA-C 105.02 -2.215 . . . . 10.0 105.02 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 9.0 mtpp -132.84 150.44 52.16 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 119.111 -1.035 . . . . 10.0 111.949 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -138.61 106.66 5.71 Favored 'General case' 0 C--N 1.316 -0.876 0 O-C-N 121.759 -0.588 . . . . 10.0 110.9 -179.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.543 HG22 ' O ' ' A' ' 115' ' ' LEU . 1.1 t -89.64 127.54 42.21 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 C-N-CA 118.611 -1.236 . . . . 10.0 109.126 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -108.38 167.06 10.3 Favored 'General case' 0 N--CA 1.445 -0.716 0 C-N-CA 125.309 1.443 . . . . 10.0 110.199 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -127.23 107.56 10.11 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 106.785 -1.561 . . . . 10.0 106.785 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . 0.46 ' HG3' ' CD1' ' A' ' 8' ' ' TRP . 21.3 tttt -56.26 109.88 0.67 Allowed 'General case' 0 C--O 1.221 -0.396 0 CA-C-N 119.726 1.148 . . . . 10.0 108.155 179.811 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 16.1 m -103.42 50.58 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.506 -0.724 0 C-N-CA 124.964 1.306 . . . . 10.0 110.94 179.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 2.1 t60 . . . . . 0 C--N 1.315 -0.922 0 O-C-N 121.569 -0.707 . . . . 10.0 109.767 179.96 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 . . . . . 0 CA--C 1.536 0.441 0 CA-C-O 116.54 -1.695 . . . . 10.0 112.972 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.595 ' CE1' HD12 ' A' ' 93' ' ' LEU . 0.7 OUTLIER -20.52 -52.49 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.779 0 O-C-N 126.313 2.258 . . . . 10.0 116.606 179.681 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.419 ' HA ' HG22 ' A' ' 42' ' ' ILE . 3.9 p-10 -53.12 110.56 0.55 Allowed 'General case' 0 N--CA 1.484 1.25 0 O-C-N 125.2 1.562 . . . . 10.0 112.404 179.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -152.75 171.08 31.87 Favored Glycine 0 N--CA 1.464 0.503 0 C-N-CA 118.507 -1.806 . . . . 10.0 115.748 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -92.65 87.45 5.91 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 101.355 -3.572 . . . . 10.0 101.355 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.53 ' CH2' HD11 ' A' ' 115' ' ' LEU . 38.7 m0 -89.55 112.63 23.88 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 123.282 1.515 . . . . 10.0 114.24 179.816 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 18.8 pttp -98.05 138.62 35.08 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 103.908 -2.627 . . . . 10.0 103.908 179.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.27 150.23 22.71 Favored 'General case' 0 C--N 1.313 -0.981 0 N-CA-C 114.115 1.154 . . . . 10.0 114.115 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.2 tt -113.34 -55.15 2.55 Favored 'General case' 0 C--O 1.242 0.696 0 CA-C-O 118.293 -0.86 . . . . 10.0 109.666 -179.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.4 p -167.99 133.09 1.83 Allowed 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 116.33 1.974 . . . . 10.0 116.33 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -90.4 165.89 13.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 111.173 -2.74 . . . . 10.0 105.715 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -124.13 -57.26 1.61 Allowed 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 120.549 1.522 . . . . 10.0 111.293 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -112.4 51.07 0.83 Allowed 'General case' 0 C--N 1.328 -0.342 0 O-C-N 126.592 2.432 . . . . 10.0 113.148 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 6.4 t80 -76.3 -28.57 57.04 Favored 'General case' 0 CA--C 1.546 0.799 0 O-C-N 118.889 -2.382 . . . . 10.0 110.133 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -79.26 -42.4 25.96 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 125.799 1.937 . . . . 10.0 112.0 179.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -74.79 -20.56 59.74 Favored 'General case' 0 C--O 1.22 -0.478 0 O-C-N 121.418 -0.801 . . . . 10.0 108.85 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 14.2 t80 -67.1 -39.86 86.81 Favored 'General case' 0 CA--C 1.548 0.88 0 CA-C-O 122.583 1.183 . . . . 10.0 110.074 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 34.9 mt -75.33 -40.33 58.49 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 122.385 1.088 . . . . 10.0 109.643 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.4 ttm180 -68.41 -27.2 65.99 Favored 'General case' 0 C--O 1.241 0.657 0 C-N-CA 125.415 1.486 . . . . 10.0 109.231 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.56 -26.36 59.9 Favored 'General case' 0 C--O 1.221 -0.432 0 O-C-N 124.664 1.228 . . . . 10.0 109.239 -179.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 79.0 mt -99.12 -15.26 19.05 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 124.756 1.223 . . . . 10.0 109.514 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 61.67 61.74 1.4 Allowed 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 116.424 2.009 . . . . 10.0 116.424 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.606 HG13 ' HA ' ' A' ' 78' ' ' ASP . 0.2 OUTLIER -88.33 -150.11 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.245 0.838 0 N-CA-C 104.892 -2.262 . . . . 10.0 104.892 -179.7 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.551 ' N ' ' ND2' ' A' ' 26' ' ' ASN . 0.0 OUTLIER -96.27 162.37 13.54 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 120.639 1.563 . . . . 10.0 113.786 -179.908 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.9 t -70.36 -39.33 76.41 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 O-C-N 125.735 1.897 . . . . 10.0 114.261 -179.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -71.56 -29.99 65.36 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 113.473 0.916 . . . . 10.0 113.473 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.74 -29.25 58.8 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 124.903 1.281 . . . . 10.0 111.455 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.05 -33.42 67.95 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 113.252 0.834 . . . . 10.0 113.252 179.726 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -72.21 -41.42 66.95 Favored 'General case' 0 N--CA 1.451 -0.423 0 O-C-N 125.813 1.946 . . . . 10.0 109.387 -179.402 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.555 HG21 ' CZ ' ' A' ' 57' ' ' PHE . 46.5 mm -73.58 -60.03 2.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 O-C-N 120.879 -1.138 . . . . 10.0 108.175 -179.556 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -46.32 -26.77 0.88 Allowed 'General case' 0 C--N 1.318 -0.771 0 O-C-N 125.026 1.454 . . . . 10.0 114.79 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -81.96 -16.98 48.6 Favored 'General case' 0 C--N 1.327 -0.37 0 O-C-N 124.448 1.092 . . . . 10.0 111.061 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -87.6 -15.83 36.24 Favored 'General case' 0 N--CA 1.441 -0.877 0 O-C-N 121.064 -1.023 . . . . 10.0 110.744 -179.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.67 172.97 8.41 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.518 -0.919 . . . . 10.0 108.518 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.5 ptpt -152.37 135.52 9.43 Favored Pre-proline 0 N--CA 1.474 0.77 0 N-CA-C 106.292 -1.744 . . . . 10.0 106.292 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -74.29 107.28 2.41 Favored 'Trans proline' 0 N--CA 1.448 -1.151 1 C-N-CA 126.532 4.822 . . . . 10.0 119.064 -179.758 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -82.38 149.02 27.92 Favored 'General case' 0 C--O 1.239 0.526 0 N-CA-C 105.778 -1.934 . . . . 10.0 105.778 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 28.6 mttp -121.36 155.91 33.76 Favored 'General case' 0 C--O 1.214 -0.811 0 O-C-N 120.48 -1.388 . . . . 10.0 109.671 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -143.37 105.01 4.32 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 102.907 -2.997 . . . . 10.0 102.907 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.419 HG22 ' HA ' ' A' ' 5' ' ' ASN . 1.3 mt -100.41 149.29 6.13 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.921 0 C-N-CA 117.679 -1.608 . . . . 10.0 111.525 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 45.4 t -138.34 145.42 28.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 113.594 -1.639 . . . . 10.0 107.694 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -139.01 128.08 23.83 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 113.538 -1.664 . . . . 10.0 112.005 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -103.55 -49.8 3.6 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 104.202 -2.518 . . . . 10.0 104.202 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -164.18 -113.15 0.28 Allowed Glycine 0 C--O 1.246 0.893 0 N-CA-C 106.466 -2.653 . . . . 10.0 106.466 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -75.17 -20.22 59.45 Favored 'General case' 0 C--O 1.215 -0.722 0 O-C-N 120.317 -1.696 . . . . 10.0 110.816 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.4 m170 -91.7 130.78 37.43 Favored 'General case' 0 N--CA 1.439 -0.982 0 CA-C-N 114.99 -1.005 . . . . 10.0 110.017 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.477 ' HG2' ' CD1' ' A' ' 51' ' ' ILE . 2.5 ttp -121.42 149.54 42.86 Favored 'General case' 0 N--CA 1.435 -1.181 0 O-C-N 125.761 1.913 . . . . 10.0 111.568 -179.659 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 19.9 mt -130.16 123.64 56.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 105.835 -1.913 . . . . 10.0 105.835 -179.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.477 ' CD1' ' HG2' ' A' ' 49' ' ' MET . 1.6 mp -110.05 128.18 66.4 Favored 'Isoleucine or valine' 0 C--O 1.24 0.578 0 N-CA-C 106.07 -1.826 . . . . 10.0 106.07 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.6 mmm180 -116.32 106.56 13.79 Favored 'General case' 0 N--CA 1.435 -1.221 0 CA-C-O 118.533 -0.746 . . . . 10.0 110.59 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.476 ' C ' HD12 ' A' ' 54' ' ' LEU . 65.3 m -91.52 129.87 37.43 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 102.126 -3.287 . . . . 10.0 102.126 -179.707 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.476 HD12 ' C ' ' A' ' 53' ' ' THR . 6.0 mp -127.37 86.5 2.5 Favored 'General case' 0 N--CA 1.441 -0.881 0 N-CA-C 119.353 3.094 . . . . 10.0 119.353 -179.811 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 7.1 m -108.42 132.67 53.53 Favored 'General case' 0 N--CA 1.443 -0.782 0 C-N-CA 125.491 1.517 . . . . 10.0 107.504 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.7 p -56.83 -24.73 53.2 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-O 123.021 1.391 . . . . 10.0 107.753 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.555 ' CZ ' HG21 ' A' ' 32' ' ' ILE . 1.2 t80 -87.0 -135.07 0.08 Allowed 'General case' 0 C--O 1.239 0.545 0 N-CA-C 106.782 -1.562 . . . . 10.0 106.782 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.69 140.21 44.02 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 118.868 -1.133 . . . . 10.0 113.723 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -138.14 144.06 40.62 Favored 'General case' 0 N--CA 1.466 0.367 0 O-C-N 125.851 1.97 . . . . 10.0 111.714 179.719 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 1.5 p90 -129.34 134.57 47.97 Favored 'General case' 0 C--O 1.217 -0.643 0 N-CA-C 105.449 -2.056 . . . . 10.0 105.449 -179.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 1.4 mp -97.28 119.5 45.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 124.327 2.013 . . . . 10.0 109.286 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -118.39 144.4 45.95 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-N 112.497 -2.138 . . . . 10.0 106.654 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -132.11 114.3 14.35 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 100.467 -3.901 . . . . 10.0 100.467 -179.834 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -102.55 177.38 4.88 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 117.429 2.381 . . . . 10.0 117.429 -179.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 15.9 mm-40 -144.1 105.58 4.27 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 103.095 -2.928 . . . . 10.0 103.095 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 47.8 t -62.81 119.43 6.78 Favored 'Isoleucine or valine' 0 C--O 1.243 0.744 0 CA-C-O 122.738 1.256 . . . . 10.0 113.106 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.12 37.28 63.89 Favored Glycine 0 CA--C 1.533 1.188 0 N-CA-C 117.117 1.607 . . . . 10.0 117.117 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.21 13.84 3.54 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 119.426 -0.91 . . . . 10.0 112.473 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 65.85 150.61 0.05 OUTLIER 'General case' 0 C--N 1.32 -0.706 0 O-C-N 125.656 1.847 . . . . 10.0 112.338 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -149.63 114.92 5.48 Favored 'General case' 0 C--O 1.243 0.714 0 CA-C-O 121.18 0.514 . . . . 10.0 111.665 179.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -87.07 89.93 8.18 Favored 'General case' 0 C--O 1.217 -0.612 0 N-CA-C 107.688 -1.227 . . . . 10.0 107.688 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -68.52 170.65 8.71 Favored 'General case' 0 C--N 1.319 -0.723 0 O-C-N 126.328 2.267 . . . . 10.0 115.625 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -150.02 62.66 0.98 Allowed 'General case' 0 N--CA 1.441 -0.91 0 N-CA-C 106.475 -1.676 . . . . 10.0 106.475 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.827 HD12 HG22 ' A' ' 77' ' ' ILE . 3.5 mm? -50.0 145.91 5.24 Favored 'General case' 0 N--CA 1.438 -1.034 0 N-CA-C 113.267 0.84 . . . . 10.0 113.267 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 62.2 m -156.1 92.67 1.36 Allowed 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.368 -0.833 . . . . 10.0 109.08 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 144.54 -43.85 0.94 Allowed Glycine 0 N--CA 1.434 -1.47 0 CA-C-O 117.072 -1.96 . . . . 10.0 112.097 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.827 HG22 HD12 ' A' ' 74' ' ' LEU . 0.3 OUTLIER -99.59 66.74 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.467 0 CA-C-N 118.961 1.38 . . . . 10.0 108.66 179.976 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.606 ' HA ' HG13 ' A' ' 25' ' ' VAL . 9.0 t70 83.24 -11.0 0.96 Allowed 'General case' 0 N--CA 1.443 -0.798 0 O-C-N 125.523 1.764 . . . . 10.0 109.744 -179.731 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 50.45 100.26 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 116.593 2.072 . . . . 10.0 116.593 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.42 124.11 4.01 Favored 'General case' 0 C--N 1.317 -0.818 0 O-C-N 120.688 -1.258 . . . . 10.0 112.178 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 10.3 mttt -63.05 149.21 45.62 Favored 'General case' 0 C--O 1.221 -0.447 0 N-CA-C 105.87 -1.9 . . . . 10.0 105.87 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 1.6 p -158.28 171.06 20.88 Favored 'General case' 0 C--O 1.215 -0.741 0 N-CA-C 105.652 -1.981 . . . . 10.0 105.652 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 30.1 mtp -120.56 96.38 5.11 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 102.664 -3.087 . . . . 10.0 102.664 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 27.7 m -107.24 117.52 34.28 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 116.977 2.214 . . . . 10.0 116.977 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 51.6 m -109.09 118.44 36.78 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 106.004 -1.85 . . . . 10.0 106.004 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.414 HG22 ' HB3' ' A' ' 95' ' ' CYS . 53.4 t -99.77 139.09 22.16 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 N-CA-C 105.714 -1.958 . . . . 10.0 105.714 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -154.41 -174.0 4.8 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 113.867 -1.515 . . . . 10.0 113.188 179.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 64.4 p-90 -133.93 130.48 37.79 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 121.787 0.804 . . . . 10.0 108.835 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 14.8 t0 -149.31 119.35 7.18 Favored 'General case' 0 C--O 1.242 0.666 0 N-CA-C 103.444 -2.798 . . . . 10.0 103.444 179.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 88.08 13.27 64.44 Favored Glycine 0 CA--C 1.503 -0.702 0 N-CA-C 106.979 -2.449 . . . . 10.0 106.979 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 20.9 t0 72.11 5.39 5.3 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 119.269 1.535 . . . . 10.0 111.859 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.44 168.85 9.48 Favored 'General case' 0 CA--C 1.504 -0.79 0 N-CA-C 106.499 -1.667 . . . . 10.0 106.499 179.782 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.595 HD12 ' CE1' ' A' ' 4' ' ' PHE . 0.5 OUTLIER -112.96 92.22 3.93 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 123.808 1.766 . . . . 10.0 106.425 179.586 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -104.45 155.87 18.42 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 114.72 -1.127 . . . . 10.0 110.446 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' CYS . . . . . 0.414 ' HB3' HG22 ' A' ' 86' ' ' VAL . 0.1 OUTLIER -145.3 170.59 16.01 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 117.601 -1.64 . . . . 10.0 108.461 -179.835 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 81.3 t -145.94 128.07 8.63 Favored 'Isoleucine or valine' 0 C--O 1.241 0.639 0 O-C-N 125.291 1.619 . . . . 10.0 107.574 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -110.89 118.94 37.47 Favored 'General case' 0 C--N 1.32 -0.695 0 O-C-N 125.041 1.463 . . . . 10.0 109.136 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 2.7 mmmt -96.17 80.58 3.26 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 122.655 1.217 . . . . 10.0 110.373 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -143.27 74.96 0.32 Allowed Glycine 0 C--N 1.338 0.652 0 CA-C-N 114.101 -1.409 . . . . 10.0 110.481 179.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 58.72 -176.12 0.08 Allowed 'General case' 0 C--O 1.234 0.241 0 N-CA-C 116.125 1.898 . . . . 10.0 116.125 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 24.9 mmtt 60.81 175.58 0.1 Allowed 'General case' 0 CA--C 1.544 0.747 0 O-C-N 125.244 1.59 . . . . 10.0 114.822 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 75.2 mt-10 -123.68 88.3 2.89 Favored 'General case' 0 C--O 1.232 0.134 0 O-C-N 125.568 1.792 . . . . 10.0 113.512 179.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 142.46 -23.39 2.36 Favored Glycine 0 C--O 1.217 -0.953 0 CA-C-O 118.258 -1.301 . . . . 10.0 116.263 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 7.0 mtp180 -47.94 130.89 15.45 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.869 0.982 . . . . 10.0 112.347 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 142.99 148.96 5.03 Favored Glycine 0 N--CA 1.439 -1.111 0 O-C-N 125.874 1.984 . . . . 10.0 109.952 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' TRP . . . . . 0.511 ' CE3' HD11 ' A' ' 117' ' ' LEU . 2.6 m0 -112.26 171.54 7.45 Favored 'General case' 0 N--CA 1.455 -0.22 0 O-C-N 121.789 -0.83 . . . . 10.0 109.727 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 4.0 m -153.54 88.98 1.3 Allowed 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 104.106 -2.553 . . . . 10.0 104.106 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 -79.76 98.23 6.94 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 125.156 1.535 . . . . 10.0 112.9 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -105.15 130.71 53.26 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 107.218 -1.401 . . . . 10.0 107.218 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 15.6 mt -93.18 119.64 41.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 116.679 2.103 . . . . 10.0 116.679 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -101.5 71.85 1.37 Allowed 'General case' 0 C--O 1.223 -0.303 0 CA-C-O 123.337 1.541 . . . . 10.0 108.243 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 59.52 -103.6 0.44 Allowed Glycine 0 C--N 1.341 0.826 0 N-CA-C 109.419 -1.473 . . . . 10.0 109.419 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 17.9 p-10 -87.12 16.79 4.74 Favored 'General case' 0 N--CA 1.476 0.842 0 O-C-N 121.392 -1.063 . . . . 10.0 112.54 179.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 13.4 mt-10 -138.92 158.33 44.4 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 125.166 2.412 . . . . 10.0 110.304 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.53 HD11 ' CH2' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -118.75 121.1 39.3 Favored 'General case' 0 C--O 1.24 0.582 0 N-CA-C 105.629 -1.989 . . . . 10.0 105.629 -179.931 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 48.0 t-80 -115.18 68.03 0.7 Allowed 'General case' 0 N--CA 1.444 -0.739 0 CA-C-O 123.327 1.537 . . . . 10.0 110.828 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.511 HD11 ' CE3' ' A' ' 106' ' ' TRP . 9.0 tt -69.48 126.28 29.27 Favored 'General case' 0 N--CA 1.441 -0.889 0 CA-C-N 113.206 -1.815 . . . . 10.0 108.796 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -128.38 98.19 4.98 Favored 'General case' 0 CA--C 1.498 -1.047 0 CA-C-O 124.31 2.005 . . . . 10.0 107.494 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 3.1 ptp -95.09 133.64 38.68 Favored 'General case' 0 CA--C 1.515 -0.396 0 O-C-N 120.663 -1.273 . . . . 10.0 112.346 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.97 169.1 9.25 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 117.613 -1.184 . . . . 10.0 112.388 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -177.58 116.6 0.09 Allowed 'General case' 0 C--O 1.237 0.433 0 O-C-N 125.43 1.706 . . . . 10.0 106.604 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 67.91 31.56 5.61 Favored 'General case' 0 C--O 1.245 0.865 0 CA-C-O 123.354 1.55 . . . . 10.0 114.344 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 78.83 -3.81 63.3 Favored Glycine 0 CA--C 1.526 0.747 0 O-C-N 120.049 -1.657 . . . . 10.0 113.178 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 49.1 t -95.85 121.68 46.63 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 N-CA-C 105.924 -1.88 . . . . 10.0 105.924 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 4.9 m -104.4 117.47 34.26 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-O 122.407 1.099 . . . . 10.0 112.164 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 4.2 t -103.4 128.03 50.62 Favored 'General case' 0 C--O 1.214 -0.777 0 C-N-CA 126.039 1.736 . . . . 10.0 107.538 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.42 155.08 47.94 Favored 'General case' 0 C--O 1.218 -0.572 0 C-N-CA 119.098 -1.041 . . . . 10.0 111.457 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -136.22 135.54 39.16 Favored 'General case' 0 N--CA 1.439 -1.02 0 N-CA-C 113.146 0.795 . . . . 10.0 113.146 179.869 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -86.23 103.19 12.58 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 CA-C-N 114.2 -1.364 . . . . 10.0 107.676 179.601 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . 0.494 ' CD1' ' HB3' ' A' ' 8' ' ' TRP . 0.7 OUTLIER -93.52 165.58 12.68 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 118.109 -0.948 . . . . 10.0 109.096 -179.86 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 13.5 tptp -133.02 134.87 45.0 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 125.94 2.025 . . . . 10.0 108.543 179.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 15.4 tptm -88.49 131.46 34.89 Favored 'General case' 0 CA--C 1.512 -0.493 0 CA-C-N 114.603 -1.181 . . . . 10.0 109.487 -179.677 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 28.3 t -109.8 -48.42 6.94 Favored 'Isoleucine or valine' 0 C--O 1.243 0.75 0 O-C-N 125.876 1.985 . . . . 10.0 109.075 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 6.2 t-80 . . . . . 0 N--CA 1.438 -1.05 0 CA-C-N 112.84 -1.982 . . . . 10.0 114.17 -179.806 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.467 0.383 0 CA-C-O 123.512 1.625 . . . . 10.0 109.983 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.414 ' CE1' HD11 ' A' ' 110' ' ' ILE . 10.0 m-85 63.21 -43.32 0.21 Allowed 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 117.11 2.263 . . . . 10.0 117.11 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 42.7 t-20 -40.25 106.39 0.05 Allowed 'General case' 0 C--N 1.319 -0.744 0 C-N-CA 125.455 1.502 . . . . 10.0 114.916 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -165.45 -127.17 0.87 Allowed Glycine 0 N--CA 1.468 0.796 0 N-CA-C 116.61 1.404 . . . . 10.0 116.61 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -167.15 122.98 1.11 Allowed 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 102.664 -3.087 . . . . 10.0 102.664 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 40.9 m0 -106.77 107.69 18.83 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 117.75 -1.119 . . . . 10.0 109.345 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.413 ' HE3' ' HB3' ' A' ' 131' ' ' LYS . 20.0 pttt -97.4 108.34 21.05 Favored 'General case' 0 C--O 1.216 -0.683 0 N-CA-C 105.589 -2.004 . . . . 10.0 105.589 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.17 166.84 0.09 Allowed 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 115.602 1.704 . . . . 10.0 115.602 -179.868 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.3 tt -126.12 -63.88 1.08 Allowed 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 105.18 -2.156 . . . . 10.0 105.18 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 77.4 p -144.64 155.89 43.84 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 124.654 1.182 . . . . 10.0 113.891 179.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -129.35 155.7 45.21 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 125.392 1.682 . . . . 10.0 106.647 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.8 pm0 -144.81 146.88 32.31 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 116.821 2.156 . . . . 10.0 116.821 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.1 m120 54.85 16.47 1.45 Allowed 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 114.571 1.323 . . . . 10.0 114.571 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -59.17 -36.79 75.92 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 116.015 1.858 . . . . 10.0 116.015 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.38 -34.77 61.14 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-N 119.419 1.009 . . . . 10.0 111.62 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -73.55 -27.39 61.31 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 107.846 -1.168 . . . . 10.0 107.846 179.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.412 ' CD2' HD23 ' A' ' 20' ' ' LEU . 10.1 t80 -65.15 -42.52 93.72 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 124.994 1.317 . . . . 10.0 111.024 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.633 HD12 ' HA ' ' A' ' 30' ' ' ARG . 24.4 mt -75.11 -25.52 58.56 Favored 'General case' 0 N--CA 1.478 0.946 0 O-C-N 121.797 -0.564 . . . . 10.0 109.576 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 57.1 ttt180 -67.79 -27.66 66.93 Favored 'General case' 0 C--O 1.242 0.708 0 C-N-CA 124.582 1.153 . . . . 10.0 110.735 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.51 -42.33 71.43 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.08 1.352 . . . . 10.0 110.096 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 32.6 mt -76.99 -13.47 59.96 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 122.312 1.053 . . . . 10.0 109.741 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 29.7 m-20 45.46 39.67 4.86 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.575 1.15 . . . . 10.0 111.483 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.569 HG12 ' N ' ' A' ' 26' ' ' ASN . 1.2 t -57.15 -63.54 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 O-C-N 127.428 2.955 . . . . 10.0 104.692 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.569 ' N ' HG12 ' A' ' 25' ' ' VAL . 5.4 t-20 -167.75 161.35 13.25 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.303 0.853 . . . . 10.0 113.303 -179.761 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.4 HG13 ' NH2' ' A' ' 30' ' ' ARG . 2.9 t -78.51 -33.14 16.85 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 N-CA-C 114.633 1.345 . . . . 10.0 114.633 -179.822 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -74.67 -32.34 62.19 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.003 -0.999 . . . . 10.0 112.634 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.5 tp -78.84 -21.47 47.57 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 122.021 0.915 . . . . 10.0 113.306 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.633 ' HA ' HD12 ' A' ' 20' ' ' LEU . 15.7 ttm180 -74.46 -31.31 62.19 Favored 'General case' 0 C--O 1.22 -0.491 0 O-C-N 119.605 -1.935 . . . . 10.0 111.311 -179.751 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.2 tttp -77.95 -39.03 43.95 Favored 'General case' 0 C--O 1.225 -0.19 0 CA-C-N 114.137 -1.392 . . . . 10.0 110.209 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 10.7 mm -75.29 -46.41 38.54 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 CA-C-N 114.278 -1.328 . . . . 10.0 109.913 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.54 ' CB ' HD11 ' A' ' 20' ' ' LEU . . . -67.21 -21.07 65.78 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 115.623 1.712 . . . . 10.0 115.623 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -71.1 -45.69 63.19 Favored 'General case' 0 N--CA 1.443 -0.819 0 N-CA-C 114.886 1.439 . . . . 10.0 114.886 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.3 pp -59.04 -21.84 59.74 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 113.627 0.973 . . . . 10.0 113.627 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -69.23 159.03 33.8 Favored 'General case' 0 C--O 1.217 -0.63 0 O-C-N 124.116 0.885 . . . . 10.0 112.348 -179.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 7.6 mttp -146.28 107.29 4.16 Favored Pre-proline 0 C--N 1.322 -0.593 0 N-CA-C 103.662 -2.718 . . . . 10.0 103.662 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -89.13 104.35 0.39 Allowed 'Trans proline' 0 C--N 1.354 0.868 0 N-CA-C 118.8 2.577 . . . . 10.0 118.8 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -81.28 136.01 35.76 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 103.536 -2.764 . . . . 10.0 103.536 178.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 12.0 mtpp -118.66 142.51 47.59 Favored 'General case' 0 C--N 1.31 -1.141 0 C-N-CA 118.846 -1.142 . . . . 10.0 112.153 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.424 ' OE1' HG23 ' A' ' 43' ' ' VAL . 0.2 OUTLIER -120.98 116.77 25.72 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 102.706 -3.072 . . . . 10.0 102.706 179.76 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 29.9 mt -110.66 136.26 47.22 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.058 0 CA-C-O 124.653 2.168 . . . . 10.0 111.062 -179.536 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.424 HG23 ' OE1' ' A' ' 41' ' ' GLU . 83.7 t -131.53 124.35 54.29 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.875 0 N-CA-C 105.095 -2.187 . . . . 10.0 105.095 -179.8 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 -108.86 165.13 11.79 Favored 'General case' 0 C--O 1.215 -0.733 0 CA-C-N 114.733 -1.121 . . . . 10.0 109.596 179.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -145.4 -146.81 0.2 Allowed 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 104.525 -2.398 . . . . 10.0 104.525 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -84.81 91.85 1.71 Allowed Glycine 0 CA--C 1.527 0.8 0 N-CA-C 105.993 -2.843 . . . . 10.0 105.993 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 62.02 20.34 11.51 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 124.481 0.754 . . . . 10.0 112.311 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 4.9 t-160 -125.75 103.52 7.85 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 105.413 -2.069 . . . . 10.0 105.413 -179.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.53 ' HG2' HD11 ' A' ' 51' ' ' ILE . 2.8 ttp -109.87 107.21 17.07 Favored 'General case' 0 C--O 1.216 -0.686 0 CA-C-N 112.723 -2.035 . . . . 10.0 116.028 -179.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.531 ' H ' HD12 ' A' ' 50' ' ' ILE . 3.3 mp -88.97 146.8 5.73 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 C-N-CA 125.824 1.65 . . . . 10.0 107.858 -179.583 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.53 HD11 ' HG2' ' A' ' 49' ' ' MET . 1.8 mp -133.87 133.12 56.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 O-C-N 124.582 1.176 . . . . 10.0 108.065 179.657 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 21.1 mtt-85 -124.14 127.58 48.0 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-O 117.798 -1.096 . . . . 10.0 113.199 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 12.7 m -114.63 94.85 4.96 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 102.814 -3.032 . . . . 10.0 102.814 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 58.0 mt -82.87 100.06 10.12 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 120.554 3.539 . . . . 10.0 120.554 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 48.9 p -122.82 -139.88 0.31 Allowed 'General case' 0 C--N 1.319 -0.759 0 O-C-N 126.168 2.167 . . . . 10.0 108.028 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -139.1 -38.36 0.5 Allowed 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 119.212 0.915 . . . . 10.0 111.86 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -54.76 -81.16 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 123.048 1.404 . . . . 10.0 110.507 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 3.2 mmp_? -110.47 -25.67 9.92 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 116.767 -1.587 . . . . 10.0 113.847 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . 0.639 ' O ' HD12 ' A' ' 61' ' ' ILE . 5.2 m120 56.83 85.31 0.08 Allowed 'General case' 0 CA--C 1.537 0.477 0 O-C-N 126.41 2.319 . . . . 10.0 108.352 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -56.16 117.83 4.12 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 107.007 -1.479 . . . . 10.0 107.007 -179.548 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.639 HD12 ' O ' ' A' ' 59' ' ' ASN . 3.6 mt -128.1 114.29 34.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 CA-C-N 113.798 -1.546 . . . . 10.0 111.454 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 3.2 mtm -121.27 172.39 8.04 Favored 'General case' 0 C--O 1.214 -0.795 0 N-CA-C 104.716 -2.327 . . . . 10.0 104.716 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.407 ' HA ' ' HA ' ' A' ' 50' ' ' ILE . 0.8 OUTLIER -163.23 128.6 3.11 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 104.904 -2.258 . . . . 10.0 104.904 179.553 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 -135.02 178.63 6.88 Favored 'General case' 0 CA--C 1.515 -0.366 0 N-CA-C 114.142 1.164 . . . . 10.0 114.142 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -129.44 100.51 5.58 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 126.868 2.605 . . . . 10.0 105.457 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.1 t -43.95 146.59 0.32 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.594 0 O-C-N 125.879 1.987 . . . . 10.0 110.419 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 56.42 63.74 5.04 Favored Glycine 0 CA--C 1.526 0.78 0 CA-C-N 114.077 -1.42 . . . . 10.0 113.03 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.12 166.57 2.4 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 125.011 2.338 . . . . 10.0 116.22 -179.758 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -87.5 133.96 33.68 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 113.444 -1.707 . . . . 10.0 110.783 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -145.69 112.51 5.99 Favored 'General case' 0 C--N 1.318 -0.777 0 O-C-N 125.301 1.625 . . . . 10.0 114.1 -179.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 17.9 pt-20 -76.6 135.66 39.21 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 105.13 -2.174 . . . . 10.0 105.13 -179.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -99.9 -34.92 9.92 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 122.44 1.114 . . . . 10.0 112.511 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 75.83 -60.48 0.49 Allowed 'General case' 0 C--O 1.221 -0.418 0 CA-C-N 114.235 -1.348 . . . . 10.0 108.614 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 61.77 33.57 17.77 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 116.689 2.107 . . . . 10.0 116.689 179.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -59.44 125.2 22.67 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-O 123.144 1.45 . . . . 10.0 109.158 -179.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 75.33 133.41 0.36 Allowed Glycine 0 C--O 1.223 -0.554 0 CA-C-O 118.336 -1.258 . . . . 10.0 110.413 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.485 HG22 ' O ' ' A' ' 77' ' ' ILE . 2.8 mt 92.02 20.49 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 O-C-N 126.448 1.911 . . . . 10.0 108.711 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.554 ' HA ' HG22 ' A' ' 25' ' ' VAL . 18.4 t70 143.32 -33.84 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.74 0 O-C-N 128.659 3.724 . . . . 10.0 114.098 179.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 50.48 52.85 14.0 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 124.121 0.968 . . . . 10.0 112.967 -179.648 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.5 -67.65 0.57 Allowed 'General case' 0 N--CA 1.467 0.407 0 O-C-N 119.49 -2.006 . . . . 10.0 114.094 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 88.56 118.74 0.03 OUTLIER 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 102.876 -3.009 . . . . 10.0 102.876 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 4.6 p -147.4 171.25 15.77 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 123.433 1.587 . . . . 10.0 110.246 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.09 71.75 0.87 Allowed 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 100.287 -3.968 . . . . 10.0 100.287 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 6.3 m -76.77 139.53 40.43 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 118.315 2.709 . . . . 10.0 118.315 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 1.9 m -124.97 129.27 50.01 Favored 'General case' 0 C--O 1.244 0.77 0 O-C-N 125.475 1.734 . . . . 10.0 107.421 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -101.86 159.19 4.24 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.989 0 N-CA-C 104.773 -2.306 . . . . 10.0 104.773 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.4 t -145.99 167.76 22.54 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 122.75 1.262 . . . . 10.0 110.837 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . 0.468 ' HA ' HD12 ' A' ' 93' ' ' LEU . 11.1 p90 -124.32 122.61 38.18 Favored 'General case' 0 C--O 1.239 0.534 0 CA-C-N 112.815 -1.993 . . . . 10.0 107.177 179.853 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -88.97 172.52 9.07 Favored 'General case' 0 C--N 1.312 -1.053 1 N-CA-C 98.593 -4.595 . . . . 10.0 98.593 179.985 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -65.87 -27.78 73.07 Favored Glycine 0 CA--C 1.496 -1.156 0 N-CA-C 108.448 -1.861 . . . . 10.0 108.448 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 44.0 p-10 -145.66 25.88 1.3 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 118.89 1.345 . . . . 10.0 111.897 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 2.1 mtmt -153.03 -157.11 0.76 Allowed 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 108.3 -1.0 . . . . 10.0 108.3 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.468 HD12 ' HA ' ' A' ' 88' ' ' TRP . 4.4 tp -165.27 136.48 3.99 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 106.257 -1.757 . . . . 10.0 106.257 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -132.38 156.72 46.15 Favored 'General case' 0 CA--C 1.508 -0.655 0 N-CA-C 114.623 1.342 . . . . 10.0 114.623 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -133.72 145.25 49.7 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 123.129 1.442 . . . . 10.0 111.439 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 3.8 t -138.52 153.57 26.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 114.132 -1.395 . . . . 10.0 108.908 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -148.5 152.76 37.44 Favored 'General case' 0 C--O 1.246 0.878 0 CA-C-O 122.355 1.074 . . . . 10.0 108.365 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 2.8 mttp -117.62 83.54 2.01 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 114.61 -1.177 . . . . 10.0 110.122 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -152.96 87.07 0.13 Allowed Glycine 0 C--N 1.315 -0.604 0 C-N-CA 119.174 -1.489 . . . . 10.0 110.133 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 42.61 -154.81 0.02 OUTLIER 'General case' 0 C--O 1.246 0.888 0 N-CA-C 116.968 2.21 . . . . 10.0 116.968 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.401 ' N ' ' CD ' ' A' ' 101' ' ' LYS . 0.0 OUTLIER 62.66 166.65 0.12 Allowed 'General case' 0 C--O 1.217 -0.642 0 CA-C-O 124.089 1.899 . . . . 10.0 112.552 179.759 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -100.13 4.9 44.8 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-N 112.646 -2.07 . . . . 10.0 114.451 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 170.48 58.13 0.04 OUTLIER Glycine 0 C--N 1.319 -0.373 0 N-CA-C 120.02 2.768 . . . . 10.0 120.02 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.504 ' H ' ' NE ' ' A' ' 104' ' ' ARG . 0.0 OUTLIER -86.59 161.88 18.28 Favored 'General case' 0 N--CA 1.441 -0.88 0 O-C-N 125.034 1.079 . . . . 10.0 109.44 -179.943 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 127.55 154.94 8.62 Favored Glycine 0 N--CA 1.435 -1.402 0 C-N-CA 120.624 -0.798 . . . . 10.0 111.457 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -118.77 154.64 32.48 Favored 'General case' 0 CA--C 1.506 -0.734 0 C-N-CA 124.442 1.097 . . . . 10.0 110.502 -179.776 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.1 m -131.88 139.79 48.89 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-O 123.697 1.713 . . . . 10.0 107.864 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -120.94 125.31 47.1 Favored 'General case' 0 C--O 1.246 0.917 0 CA-C-N 113.249 -1.796 . . . . 10.0 108.608 -179.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 5.5 t-105 -132.27 137.03 47.34 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 106.839 -1.541 . . . . 10.0 106.839 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.414 HD11 ' CE1' ' A' ' 4' ' ' PHE . 2.1 mt -111.26 140.85 28.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 O-C-N 126.352 2.283 . . . . 10.0 117.022 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -123.82 170.56 10.42 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 104.103 -2.554 . . . . 10.0 104.103 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -33.95 -80.0 0.02 OUTLIER Glycine 0 C--O 1.241 0.59 0 O-C-N 128.152 3.407 . . . . 10.0 111.159 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -115.42 15.53 16.77 Favored 'General case' 0 CA--C 1.555 1.143 0 CA-C-N 120.157 1.978 . . . . 10.0 108.776 179.737 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -126.9 154.51 44.35 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 124.547 2.117 . . . . 10.0 112.516 -179.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.485 ' HB3' ' HB2' ' A' ' 130' ' ' PHE . 0.2 OUTLIER -113.42 127.55 56.15 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 111.715 -2.493 . . . . 10.0 106.525 179.863 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -110.87 79.64 1.22 Allowed 'General case' 0 C--O 1.217 -0.656 0 CA-C-O 122.305 1.05 . . . . 10.0 111.785 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 1.7 tp -80.27 148.24 30.85 Favored 'General case' 0 C--O 1.218 -0.582 0 CA-C-O 124.417 2.056 . . . . 10.0 113.493 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.412 ' HA ' ' HB3' ' A' ' 127' ' ' LYS . 0.0 OUTLIER -142.89 136.33 28.53 Favored 'General case' 0 C--O 1.219 -0.54 0 O-C-N 119.594 -1.941 . . . . 10.0 107.264 -179.835 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 7.5 mtp -138.48 151.08 47.07 Favored 'General case' 0 CA--C 1.51 -0.589 0 CA-C-O 122.941 1.353 . . . . 10.0 108.111 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.421 ' O ' ' HB2' ' A' ' 121' ' ' ALA . 2.8 mtt-85 -143.58 166.48 24.71 Favored 'General case' 0 CA--C 1.512 -0.512 0 O-C-N 119.852 -1.78 . . . . 10.0 112.338 -179.777 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . 0.421 ' HB2' ' O ' ' A' ' 120' ' ' ARG . . . 178.57 122.66 0.05 OUTLIER 'General case' 0 CA--C 1.503 -0.848 0 CA-C-N 114.418 -1.264 . . . . 10.0 109.212 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 50.92 41.19 26.68 Favored 'General case' 0 C--O 1.244 0.791 0 O-C-N 125.96 2.037 . . . . 10.0 115.947 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 84.12 -7.37 71.55 Favored Glycine 0 C--N 1.341 0.811 0 O-C-N 124.646 1.216 . . . . 10.0 115.165 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 12.7 t -91.31 126.85 43.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 CA-C-O 117.642 -1.17 . . . . 10.0 111.409 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 85.6 m -111.86 111.35 22.24 Favored 'General case' 0 N--CA 1.441 -0.904 0 O-C-N 126.725 2.516 . . . . 10.0 115.83 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 1.4 t -110.07 156.39 20.61 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 104.996 -2.224 . . . . 10.0 104.996 -179.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . 0.412 ' HB3' ' HA ' ' A' ' 118' ' ' GLU . 0.0 OUTLIER -168.07 177.92 5.32 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 123.306 1.527 . . . . 10.0 110.163 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -149.83 150.42 31.95 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 112.789 -2.005 . . . . 10.0 114.092 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 28.1 t -111.32 115.66 50.45 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.788 0 N-CA-C 105.199 -2.149 . . . . 10.0 105.199 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . 0.485 ' HB2' ' HB3' ' A' ' 115' ' ' LEU . 55.1 m-85 -110.39 162.55 14.55 Favored 'General case' 0 CA--C 1.51 -0.573 0 O-C-N 125.584 1.802 . . . . 10.0 111.809 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.413 ' HB3' ' HE3' ' A' ' 9' ' ' LYS . 0.0 OUTLIER -129.45 115.22 17.18 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 105.879 -1.897 . . . . 10.0 105.879 179.866 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 9.9 tttp -76.45 116.78 17.46 Favored 'General case' 0 C--O 1.216 -0.675 0 O-C-N 125.524 1.765 . . . . 10.0 108.506 -179.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.63 -37.39 77.55 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.678 0 CA-C-N 114.127 -1.397 . . . . 10.0 112.117 -179.741 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 . . . . . 0 N--CA 1.446 -0.641 0 CA-C-O 117.195 -1.384 . . . . 10.0 107.86 179.849 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.9 t0 . . . . . 0 C--O 1.238 0.497 0 CA-C-O 123.167 1.46 . . . . 10.0 111.419 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.447 ' CD1' HD11 ' A' ' 110' ' ' ILE . 57.0 m-85 -96.5 -28.23 14.5 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 116.899 2.185 . . . . 10.0 116.899 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 47.0 p-10 -64.48 139.79 58.8 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 117.985 2.587 . . . . 10.0 117.985 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -174.23 -130.57 1.3 Allowed Glycine 0 N--CA 1.452 -0.267 0 N-CA-C 117.179 1.632 . . . . 10.0 117.179 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -160.84 98.15 1.19 Allowed 'General case' 0 C--O 1.239 0.533 0 N-CA-C 105.709 -1.96 . . . . 10.0 105.709 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.562 ' CZ3' ' HG2' ' A' ' 132' ' ' LYS . 0.8 OUTLIER -90.15 139.64 30.43 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 116.253 -1.832 . . . . 10.0 107.697 179.9 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -123.04 8.88 9.28 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 125.09 1.494 . . . . 10.0 111.481 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 61.77 135.09 0.01 OUTLIER 'General case' 0 C--N 1.309 -1.163 0 O-C-N 126.718 2.511 . . . . 10.0 117.527 179.101 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.5 tp -113.05 -56.08 2.45 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 107.854 -1.165 . . . . 10.0 107.854 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.1 p -154.01 -178.25 6.96 Favored 'General case' 0 C--O 1.242 0.679 0 N-CA-C 115.522 1.675 . . . . 10.0 115.522 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -154.17 164.02 39.18 Favored 'General case' 0 C--O 1.238 0.457 0 N-CA-C 105.002 -2.222 . . . . 10.0 105.002 -179.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -156.02 18.6 0.37 Allowed 'General case' 0 C--O 1.234 0.237 0 O-C-N 118.545 -2.597 . . . . 10.0 114.658 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.415 ' CB ' ' HA ' ' A' ' 126' ' ' CYS . 0.3 OUTLIER -163.01 26.52 0.09 Allowed 'General case' 0 C--O 1.241 0.651 0 O-C-N 125.34 1.65 . . . . 10.0 114.332 -179.873 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.634 ' CE2' ' HB1' ' A' ' 33' ' ' ALA . 2.6 t80 -62.75 -52.59 62.61 Favored 'General case' 0 C--O 1.243 0.718 0 C-N-CA 124.627 1.171 . . . . 10.0 113.71 -179.591 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.0 tm-20 -69.01 -34.13 74.77 Favored 'General case' 0 CA--C 1.511 -0.557 0 N-CA-C 115.151 1.537 . . . . 10.0 115.151 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -77.0 -23.3 52.25 Favored 'General case' 0 C--N 1.32 -0.715 0 O-C-N 124.91 1.381 . . . . 10.0 108.034 -179.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -78.1 -32.59 50.63 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 107.994 -1.113 . . . . 10.0 107.994 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 81.8 mt -75.9 -30.4 58.77 Favored 'General case' 0 C--O 1.217 -0.656 0 O-C-N 119.926 -1.733 . . . . 10.0 111.876 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.2 ttm180 -68.96 -27.09 65.42 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 124.11 0.964 . . . . 10.0 110.245 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.26 -49.01 54.24 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.189 1.795 . . . . 10.0 109.308 -179.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.566 HD13 ' HB3' ' A' ' 78' ' ' ASP . 2.6 mt -74.9 -15.47 60.7 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 125.915 2.009 . . . . 10.0 111.793 179.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 69.15 28.94 4.84 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 115.396 1.628 . . . . 10.0 115.396 -179.7 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 6.1 m -62.0 178.12 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 N-CA-C 107.675 -1.231 . . . . 10.0 107.675 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -62.32 152.07 34.83 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 116.327 1.973 . . . . 10.0 116.327 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 14.8 p -70.74 -32.29 48.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 N-CA-C 115.072 1.508 . . . . 10.0 115.072 179.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -73.72 -25.04 60.01 Favored 'General case' 0 C--O 1.243 0.725 0 O-C-N 124.989 1.431 . . . . 10.0 109.171 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -73.99 -50.48 19.69 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-N 114.024 -1.444 . . . . 10.0 108.826 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.49 -25.37 68.23 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 125.145 1.378 . . . . 10.0 113.491 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -73.92 -44.84 53.78 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 113.166 -1.833 . . . . 10.0 112.12 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.418 HG22 ' CD2' ' A' ' 36' ' ' LEU . 1.7 mm -69.31 -54.85 17.67 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 O-C-N 120.093 -1.629 . . . . 10.0 110.755 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.634 ' HB1' ' CE2' ' A' ' 16' ' ' PHE . . . -45.57 -28.13 0.89 Allowed 'General case' 0 C--O 1.216 -0.696 0 N-CA-C 115.874 1.805 . . . . 10.0 115.874 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 13.9 t-20 -86.15 -2.47 58.38 Favored 'General case' 0 N--CA 1.44 -0.968 0 O-C-N 119.995 -1.691 . . . . 10.0 113.908 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 15.7 mt -104.43 -20.15 13.81 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 108.942 -0.762 . . . . 10.0 108.942 179.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.418 ' CD2' HG22 ' A' ' 32' ' ' ILE . 0.4 OUTLIER -128.29 173.66 9.96 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 113.422 0.897 . . . . 10.0 113.422 -179.953 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 6.5 ptpt -151.32 155.19 34.46 Favored Pre-proline 0 N--CA 1.478 0.949 0 N-CA-C 104.236 -2.505 . . . . 10.0 104.236 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo -101.74 162.56 0.35 Allowed 'Trans proline' 0 N--CA 1.459 -0.547 1 C-N-CA 126.799 4.999 . . . . 10.0 116.672 -179.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -110.42 -175.86 2.83 Favored 'General case' 0 C--O 1.239 0.55 0 N-CA-C 104.927 -2.249 . . . . 10.0 104.927 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.76 140.78 11.1 Favored 'General case' 0 C--N 1.309 -1.153 0 O-C-N 120.517 -1.364 . . . . 10.0 111.73 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -132.16 135.84 46.66 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 105.225 -2.139 . . . . 10.0 105.225 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.406 HG13 ' NE1' ' A' ' 8' ' ' TRP . 0.9 OUTLIER -121.52 141.21 42.92 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.026 0 N-CA-C 109.265 -0.642 . . . . 10.0 109.265 -179.926 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.5 t -137.86 135.35 45.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 105.791 -1.929 . . . . 10.0 105.791 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -126.47 113.3 16.65 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 121.482 0.658 . . . . 10.0 109.85 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -82.08 -17.57 46.09 Favored 'General case' 0 C--O 1.219 -0.543 0 N-CA-C 106.757 -1.572 . . . . 10.0 106.757 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 140.44 -110.67 0.69 Allowed Glycine 0 CA--C 1.521 0.451 0 N-CA-C 107.619 -2.192 . . . . 10.0 107.619 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 60.0 m-20 -71.24 -13.54 61.94 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 119.299 -2.294 . . . . 10.0 108.541 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 31.7 m170 -109.78 144.83 37.66 Favored 'General case' 0 N--CA 1.439 -0.997 0 N-CA-C 105.372 -2.084 . . . . 10.0 105.372 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.528 ' C ' HD12 ' A' ' 50' ' ' ILE . 16.5 ttt -133.14 154.95 50.13 Favored 'General case' 0 C--N 1.317 -0.812 0 O-C-N 125.807 1.942 . . . . 10.0 111.592 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.528 HD12 ' C ' ' A' ' 49' ' ' MET . 4.6 mp -142.26 132.11 23.49 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.058 0 N-CA-C 107.161 -1.422 . . . . 10.0 107.161 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -120.24 125.56 74.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 CA-C-O 117.355 -1.307 . . . . 10.0 108.785 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.401 ' HB2' HD21 ' A' ' 54' ' ' LEU . 3.5 ptp180 -115.83 128.59 55.94 Favored 'General case' 0 C--O 1.221 -0.413 0 O-C-N 126.058 2.099 . . . . 10.0 108.27 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.611 ' C ' HD22 ' A' ' 54' ' ' LEU . 76.9 m -123.99 113.07 17.95 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 104.861 -2.274 . . . . 10.0 104.861 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.611 HD22 ' C ' ' A' ' 53' ' ' THR . 2.5 mm? -119.51 140.3 50.71 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 119.52 3.156 . . . . 10.0 119.52 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -165.29 28.16 0.06 Allowed 'General case' 0 N--CA 1.445 -0.704 0 N-CA-C 109.273 -0.64 . . . . 10.0 109.273 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . 0.49 ' O ' HG22 ' A' ' 56' ' ' THR . 9.0 m 44.14 48.21 7.58 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 112.647 0.61 . . . . 10.0 112.647 179.814 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -159.98 -70.89 0.07 Allowed 'General case' 0 C--O 1.247 0.946 0 N-CA-C 105.849 -1.908 . . . . 10.0 105.849 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.408 ' NE ' ' HA ' ' A' ' 58' ' ' ARG . 0.0 OUTLIER -113.11 118.26 34.25 Favored 'General case' 0 C--O 1.245 0.836 0 CA-C-N 113.628 -1.624 . . . . 10.0 109.74 -179.916 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -102.53 102.34 12.6 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.745 0.784 . . . . 10.0 109.914 179.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.699 ' OH ' HD11 ' A' ' 74' ' ' LEU . 0.1 OUTLIER -87.34 107.76 18.67 Favored 'General case' 0 C--O 1.212 -0.88 0 N-CA-C 105.33 -2.1 . . . . 10.0 105.33 -179.698 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 5.2 mt -135.84 141.48 41.82 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 CA-C-O 122.463 1.125 . . . . 10.0 111.312 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 28.3 mmt -149.57 178.16 9.09 Favored 'General case' 0 CA--C 1.505 -0.76 0 N-CA-C 104.549 -2.389 . . . . 10.0 104.549 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 58.6 m-20 -142.16 69.46 1.32 Allowed 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 102.638 -3.097 . . . . 10.0 102.638 -179.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 6.0 m-30 -70.58 146.12 50.31 Favored 'General case' 0 C--O 1.243 0.732 0 N-CA-C 115.398 1.629 . . . . 10.0 115.398 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -116.93 120.79 39.53 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 107.046 -1.465 . . . . 10.0 107.046 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 43.9 t -65.04 100.95 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.723 0 C-N-CA 123.942 0.897 . . . . 10.0 110.871 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 94.61 68.3 1.04 Allowed Glycine 0 C--O 1.221 -0.695 0 O-C-N 127.868 3.23 . . . . 10.0 112.027 -179.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -167.3 136.46 2.73 Favored 'General case' 0 C--O 1.231 0.091 0 O-C-N 119.472 -2.193 . . . . 10.0 114.851 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -84.57 136.06 33.94 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 118.485 -1.286 . . . . 10.0 111.311 179.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 44.2 p90 -158.62 128.37 5.79 Favored 'General case' 0 C--N 1.322 -0.617 0 O-C-N 120.612 -1.305 . . . . 10.0 109.268 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -61.9 155.14 24.21 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 123.719 1.723 . . . . 10.0 110.902 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 14.8 tp10 -120.95 67.49 0.86 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 113.139 -1.846 . . . . 10.0 113.564 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -68.97 71.82 0.24 Allowed 'General case' 0 C--N 1.316 -0.85 0 C-N-CA 125.395 1.478 . . . . 10.0 107.107 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.699 HD11 ' OH ' ' A' ' 60' ' ' TYR . 0.4 OUTLIER -76.58 137.16 39.35 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 114.082 -1.417 . . . . 10.0 113.721 -179.807 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 51.0 p -152.78 50.91 0.75 Allowed 'General case' 0 C--O 1.242 0.707 0 N-CA-C 106.165 -1.791 . . . . 10.0 106.165 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -128.91 -59.18 0.11 Allowed Glycine 0 N--CA 1.435 -1.425 0 O-C-N 125.266 1.604 . . . . 10.0 112.417 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.492 HG22 ' N ' ' A' ' 78' ' ' ASP . 46.3 mt -112.46 -87.15 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.539 0 O-C-N 124.667 0.863 . . . . 10.0 109.692 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.566 ' HB3' HD13 ' A' ' 23' ' ' LEU . 1.3 p30 -81.26 3.82 22.61 Favored 'General case' 0 CA--C 1.51 -0.566 0 N-CA-C 115.298 1.592 . . . . 10.0 115.298 -179.725 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.8 p30 44.68 -155.76 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 114.545 1.313 . . . . 10.0 114.545 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 72.84 130.77 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 119.477 1.035 . . . . 10.0 111.841 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 6.3 ttpm? -87.73 122.45 31.41 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 104.783 -2.303 . . . . 10.0 104.783 -179.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -121.59 172.4 8.13 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 107.601 -1.259 . . . . 10.0 107.601 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . 0.404 ' CB ' ' HB2' ' A' ' 98' ' ' LYS . 0.0 OUTLIER -116.48 126.6 53.6 Favored 'General case' 0 CA--C 1.512 -0.498 1 N-CA-C 98.902 -4.481 . . . . 10.0 98.902 -179.954 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 33.9 m -127.1 140.11 52.5 Favored 'General case' 0 C--N 1.311 -1.097 0 O-C-N 121.189 -0.945 . . . . 10.0 113.513 -179.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 2.1 m -126.82 101.54 6.64 Favored 'General case' 0 C--N 1.316 -0.872 0 O-C-N 125.052 1.47 . . . . 10.0 109.345 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 1.3 m -81.97 138.13 20.01 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.954 0 N-CA-C 101.332 -3.581 . . . . 10.0 101.332 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 13.7 t -145.89 167.13 24.0 Favored 'General case' 0 C--N 1.317 -0.84 0 C-N-CA 119.364 -0.935 . . . . 10.0 111.037 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 5.7 t90 -97.28 129.23 44.61 Favored 'General case' 0 C--N 1.314 -0.956 0 O-C-N 125.707 1.879 . . . . 10.0 106.554 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -139.85 98.0 3.37 Favored 'General case' 0 CA--C 1.505 -0.771 0 N-CA-C 101.519 -3.512 . . . . 10.0 101.519 -179.773 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 52.19 -130.77 37.43 Favored Glycine 0 N--CA 1.437 -1.29 0 N-CA-C 104.762 -3.335 . . . . 10.0 104.762 179.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -89.37 24.23 2.29 Favored 'General case' 0 N--CA 1.446 -0.628 0 O-C-N 124.288 0.64 . . . . 10.0 112.205 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.7 167.42 12.07 Favored 'General case' 0 CA--C 1.508 -0.641 0 CA-C-O 121.601 0.715 . . . . 10.0 110.651 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -125.05 99.64 6.21 Favored 'General case' 0 C--O 1.241 0.635 0 N-CA-C 102.85 -3.018 . . . . 10.0 102.85 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 18.4 mm-40 -85.76 137.0 33.1 Favored 'General case' 0 CA--C 1.503 -0.851 0 O-C-N 124.756 1.285 . . . . 10.0 113.188 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 7.1 t -137.94 123.86 20.11 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 108.33 -0.989 . . . . 10.0 108.33 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 16.1 t -133.93 117.12 25.03 Favored 'Isoleucine or valine' 0 C--O 1.245 0.84 0 CA-C-N 112.939 -1.937 . . . . 10.0 109.256 -179.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 17.3 mt-30 -90.54 143.23 26.95 Favored 'General case' 0 C--O 1.243 0.758 0 N-CA-C 107.235 -1.394 . . . . 10.0 107.235 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.404 ' HB2' ' CB ' ' A' ' 83' ' ' MET . 0.6 OUTLIER -85.18 17.07 3.17 Favored 'General case' 0 CA--C 1.508 -0.643 0 O-C-N 124.249 0.968 . . . . 10.0 113.255 179.973 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -77.79 -178.08 48.05 Favored Glycine 0 N--CA 1.435 -1.37 0 C-N-CA 118.231 -1.937 . . . . 10.0 109.816 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -70.76 164.06 25.95 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 113.681 0.993 . . . . 10.0 113.681 -179.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 15.0 mttm 82.95 -179.91 0.05 Allowed 'General case' 0 CA--C 1.54 0.575 0 O-C-N 125.773 1.921 . . . . 10.0 112.401 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -108.17 130.76 55.11 Favored 'General case' 0 C--O 1.223 -0.301 0 O-C-N 124.76 1.288 . . . . 10.0 112.306 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 106.09 -20.55 35.47 Favored Glycine 0 C--O 1.215 -1.057 0 N-CA-C 118.338 2.095 . . . . 10.0 118.338 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 10.2 mtt180 -40.98 116.35 0.71 Allowed 'General case' 0 C--N 1.327 -0.407 0 O-C-N 125.956 1.621 . . . . 10.0 110.999 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 125.74 170.95 13.11 Favored Glycine 0 C--O 1.218 -0.898 0 N-CA-C 107.933 -2.067 . . . . 10.0 107.933 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -130.92 174.72 9.71 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 123.036 1.398 . . . . 10.0 110.038 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 48.6 m -130.97 133.69 46.03 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 104.672 -2.344 . . . . 10.0 104.672 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -122.08 125.73 46.86 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 118.254 -0.879 . . . . 10.0 110.699 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' TRP . . . . . 0.496 ' CD1' ' C ' ' A' ' 109' ' ' TRP . 0.0 OUTLIER -138.45 145.14 40.53 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 126.097 2.123 . . . . 10.0 106.74 -179.98 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.447 HD11 ' CD1' ' A' ' 4' ' ' PHE . 4.7 mt -105.36 137.9 32.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 124.184 1.945 . . . . 10.0 115.646 179.718 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -104.45 165.95 10.72 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 104.611 -2.366 . . . . 10.0 104.611 179.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -39.55 -73.07 0.19 Allowed Glycine 0 N--CA 1.448 -0.521 0 O-C-N 126.015 2.072 . . . . 10.0 111.414 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -122.46 35.98 4.75 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 121.576 0.703 . . . . 10.0 110.248 -179.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -150.45 164.12 36.69 Favored 'General case' 0 C--O 1.241 0.62 0 O-C-N 119.402 -2.061 . . . . 10.0 109.722 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -119.2 120.99 38.68 Favored 'General case' 0 C--N 1.314 -0.965 0 N-CA-C 104.351 -2.463 . . . . 10.0 104.351 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -119.0 91.1 3.47 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 119.348 0.976 . . . . 10.0 108.517 179.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.513 HD12 ' H ' ' A' ' 118' ' ' GLU . 30.5 tp -86.98 151.2 23.49 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 124.55 1.156 . . . . 10.0 109.745 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.513 ' H ' HD12 ' A' ' 117' ' ' LEU . 34.6 tt0 -139.46 102.94 4.59 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 114.924 -1.034 . . . . 10.0 109.966 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 4.7 mtp -97.54 154.33 17.58 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 108.437 -0.949 . . . . 10.0 108.437 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -146.89 154.78 41.7 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 114.093 1.146 . . . . 10.0 114.093 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -170.02 118.53 0.59 Allowed 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 105.027 -2.212 . . . . 10.0 105.027 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 63.64 43.31 5.78 Favored 'General case' 0 C--O 1.242 0.7 0 O-C-N 126.664 2.477 . . . . 10.0 113.093 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 64.47 15.92 59.98 Favored Glycine 0 C--O 1.22 -0.763 0 O-C-N 121.236 -0.915 . . . . 10.0 115.37 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 2.6 t -105.16 123.25 59.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 N-CA-C 108.064 -1.087 . . . . 10.0 108.064 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 85.1 m -93.78 117.47 30.14 Favored 'General case' 0 N--CA 1.441 -0.903 0 O-C-N 123.82 0.7 . . . . 10.0 112.484 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . 0.415 ' HA ' ' CB ' ' A' ' 15' ' ' ASN . 51.6 t -116.88 104.93 11.8 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 106.487 -1.672 . . . . 10.0 106.487 179.808 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 28.9 mtpt -106.56 152.38 23.78 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 122.396 1.093 . . . . 10.0 111.822 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -135.3 107.91 7.43 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 108.206 -1.035 . . . . 10.0 108.206 -179.579 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 76.8 t -83.14 122.37 37.38 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.73 0 O-C-N 125.555 1.784 . . . . 10.0 107.694 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 59.6 m-85 -112.07 -172.38 2.03 Favored 'General case' 0 N--CA 1.45 -0.457 0 O-C-N 125.173 1.545 . . . . 10.0 108.506 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 24.1 tptp -151.87 122.48 7.4 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 123.542 1.639 . . . . 10.0 107.745 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . 0.562 ' HG2' ' CZ3' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -78.27 110.78 13.59 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-N 115.01 -0.995 . . . . 10.0 108.866 -179.832 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 4.2 t -100.87 -1.85 9.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 118.209 -0.901 . . . . 10.0 109.313 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.44 -0.936 0 O-C-N 126.044 2.09 . . . . 10.0 110.866 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.47 0.561 0 N-CA-C 112.511 0.56 . . . . 10.0 112.511 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.434 ' CE1' HD12 ' A' ' 110' ' ' ILE . 84.9 m-85 68.86 -49.22 0.58 Allowed 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 126.168 1.787 . . . . 10.0 114.027 -179.706 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -47.55 113.17 0.65 Allowed 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 115.105 1.52 . . . . 10.0 115.105 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 169.96 -116.0 0.63 Allowed Glycine 0 CA--C 1.529 0.968 0 O-C-N 125.467 1.729 . . . . 10.0 113.954 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -165.66 144.4 6.15 Favored 'General case' 0 C--O 1.224 -0.243 0 N-CA-C 100.894 -3.743 . . . . 10.0 100.894 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.577 ' CE2' HD12 ' A' ' 115' ' ' LEU . 87.2 m95 -129.92 114.9 16.43 Favored 'General case' 0 C--N 1.315 -0.919 0 O-C-N 124.53 1.144 . . . . 10.0 109.331 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 9.1 tptt -99.01 116.91 32.32 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.231 -1.35 . . . . 10.0 110.698 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.467 ' HA ' ' HA ' ' A' ' 130' ' ' PHE . 0.0 OUTLIER -61.46 135.51 57.7 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-O 122.234 1.016 . . . . 10.0 111.483 179.265 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 15.0 tp -117.02 -45.02 2.77 Favored 'General case' 0 CA--C 1.514 -0.441 0 O-C-N 120.611 -1.306 . . . . 10.0 111.436 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -122.29 156.93 32.82 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 123.977 1.846 . . . . 10.0 113.992 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -148.43 120.04 8.01 Favored 'General case' 0 CA--C 1.508 -0.666 0 CA-C-N 112.098 -2.319 . . . . 10.0 107.51 179.683 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.5 mt-10 -101.49 -71.57 0.71 Allowed 'General case' 0 C--N 1.319 -0.76 0 C-N-CA 122.861 0.465 . . . . 10.0 112.169 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 10.3 m-20 -107.18 56.38 0.64 Allowed 'General case' 0 C--O 1.24 0.586 0 CA-C-O 123.123 1.439 . . . . 10.0 112.893 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -71.26 -49.75 39.87 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 118.16 -2.838 . . . . 10.0 111.088 179.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -64.62 -36.63 84.88 Favored 'General case' 0 C--N 1.323 -0.565 0 O-C-N 119.396 -2.065 . . . . 10.0 115.633 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.68 -28.92 64.06 Favored 'General case' 0 C--O 1.216 -0.701 0 CA-C-O 122.95 1.357 . . . . 10.0 111.752 179.508 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.429 ' CE1' HD11 ' A' ' 23' ' ' LEU . 4.5 t80 -67.58 -42.96 81.7 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 113.142 -1.844 . . . . 10.0 111.447 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.518 ' HA ' HD12 ' A' ' 23' ' ' LEU . 46.9 mt -75.73 -22.35 56.65 Favored 'General case' 0 C--O 1.212 -0.902 0 O-C-N 120.989 -1.07 . . . . 10.0 110.817 179.739 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.34 -21.53 56.03 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 112.883 -1.962 . . . . 10.0 106.44 179.682 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.8 -35.71 59.98 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-O 125.194 2.426 . . . . 10.0 111.151 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.518 HD12 ' HA ' ' A' ' 20' ' ' LEU . 0.5 OUTLIER -89.41 -7.74 54.51 Favored 'General case' 0 CA--C 1.546 0.808 0 O-C-N 120.265 -1.522 . . . . 10.0 114.618 179.753 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 64.78 38.34 6.84 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 124.232 1.968 . . . . 10.0 113.606 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.555 ' CG2' HD23 ' A' ' 29' ' ' LEU . 0.3 OUTLIER -68.22 160.47 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.709 0 N-CA-C 105.161 -2.162 . . . . 10.0 105.161 -179.909 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 13.0 p30 -63.0 160.14 15.62 Favored 'General case' 0 C--O 1.242 0.663 0 O-C-N 125.412 1.695 . . . . 10.0 114.557 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -67.95 -35.24 71.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 N-CA-C 115.925 1.824 . . . . 10.0 115.925 -179.365 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.449 ' O ' HD12 ' A' ' 32' ' ' ILE . . . -72.66 -34.72 67.44 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 121.259 -0.9 . . . . 10.0 112.086 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.641 HD21 HG22 ' A' ' 77' ' ' ILE . 32.8 tp -66.18 -31.02 71.61 Favored 'General case' 0 C--N 1.32 -0.679 0 O-C-N 120.153 -1.592 . . . . 10.0 112.093 -179.719 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 7.7 ttp180 -78.04 -29.83 49.55 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 113.757 -1.565 . . . . 10.0 109.563 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -78.86 -41.08 30.82 Favored 'General case' 0 N--CA 1.466 0.328 0 O-C-N 124.431 1.082 . . . . 10.0 111.608 -179.783 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.449 HD12 ' O ' ' A' ' 28' ' ' ALA . 1.2 mp -74.72 -30.47 24.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 CA-C-N 113.698 -1.592 . . . . 10.0 109.449 -179.788 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -76.8 -52.23 9.91 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 115.691 1.737 . . . . 10.0 115.691 179.792 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 16.8 p30 -45.65 -23.96 0.3 Allowed 'General case' 0 C--O 1.217 -0.628 0 N-CA-C 115.409 1.633 . . . . 10.0 115.409 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.0 mt -73.56 -46.95 44.37 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-O 124.198 1.951 . . . . 10.0 111.1 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.6 pp -97.51 -178.91 4.29 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 113.783 -1.553 . . . . 10.0 109.815 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 18.8 mttt -142.43 138.53 16.52 Favored Pre-proline 0 N--CA 1.468 0.438 0 N-CA-C 104.293 -2.484 . . . . 10.0 104.293 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -68.83 108.83 1.98 Allowed 'Trans proline' 0 N--CA 1.45 -1.055 0 C-N-CA 124.782 3.655 . . . . 10.0 119.018 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -88.26 136.32 33.03 Favored 'General case' 0 C--O 1.219 -0.521 0 N-CA-C 105.38 -2.082 . . . . 10.0 105.38 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.9 mttm -119.06 138.81 52.61 Favored 'General case' 0 C--O 1.211 -0.922 0 CA-C-O 123.417 1.579 . . . . 10.0 112.29 179.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -134.61 128.36 33.03 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 103.544 -2.761 . . . . 10.0 103.544 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 17.5 mt -118.01 136.84 53.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 O-C-N 125.843 1.964 . . . . 10.0 110.992 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 48.7 t -128.79 103.84 10.28 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.38 0 N-CA-C 105.162 -2.162 . . . . 10.0 105.162 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.26 142.84 27.92 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-O 123.374 1.559 . . . . 10.0 111.804 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -132.45 167.45 19.93 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 102.725 -3.065 . . . . 10.0 102.725 -179.699 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -67.9 118.43 9.65 Favored Glycine 0 C--O 1.246 0.862 0 CA-C-O 117.685 -1.619 . . . . 10.0 109.443 179.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 62.74 18.75 10.91 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 119.198 1.499 . . . . 10.0 112.695 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -156.76 119.98 4.15 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 105.837 -1.912 . . . . 10.0 105.837 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.62 ' CE ' HD11 ' A' ' 93' ' ' LEU . 5.6 ttp -118.88 159.61 23.45 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 114.794 -1.094 . . . . 10.0 112.226 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.63 ' C ' HD13 ' A' ' 51' ' ' ILE . 35.0 mt -145.41 135.45 18.59 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 N-CA-C 108.095 -1.076 . . . . 10.0 108.095 179.746 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.63 HD13 ' C ' ' A' ' 50' ' ' ILE . 2.3 mm -117.42 129.17 74.33 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 N-CA-C 105.262 -2.125 . . . . 10.0 105.262 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.9 mtp-105 -121.85 106.26 11.11 Favored 'General case' 0 N--CA 1.437 -1.091 0 O-C-N 124.338 1.024 . . . . 10.0 113.588 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.3 m -80.81 128.78 34.05 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 101.17 -3.641 . . . . 10.0 101.17 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 64.2 mt -132.94 76.46 1.68 Allowed 'General case' 0 N--CA 1.448 -0.549 1 N-CA-C 122.559 4.281 . . . . 10.0 122.559 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -110.18 129.33 55.73 Favored 'General case' 0 C--O 1.242 0.66 0 C-N-CA 124.992 1.317 . . . . 10.0 107.942 -179.737 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 22.9 p -61.41 89.11 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.728 0 O-C-N 125.145 1.528 . . . . 10.0 109.465 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 3.0 t80 174.11 -69.52 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 126.796 2.56 . . . . 10.0 109.71 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 40.2 ttm180 -148.21 105.72 3.67 Favored 'General case' 0 C--N 1.344 0.368 0 O-C-N 125.246 1.591 . . . . 10.0 114.758 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . 0.66 HD22 ' N ' ' A' ' 59' ' ' ASN . 0.7 OUTLIER -91.04 123.86 34.83 Favored 'General case' 0 C--N 1.319 -0.722 0 O-C-N 125.182 1.551 . . . . 10.0 112.668 -179.746 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.407 ' CD1' ' O ' ' A' ' 60' ' ' TYR . 0.1 OUTLIER -118.09 120.68 38.49 Favored 'General case' 0 C--O 1.211 -0.931 0 N-CA-C 104.041 -2.577 . . . . 10.0 104.041 179.697 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.0 mm -108.56 156.61 9.08 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.476 0 O-C-N 119.049 -2.282 . . . . 10.0 111.895 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . 0.49 ' O ' HG23 ' A' ' 50' ' ' ILE . 0.7 OUTLIER -136.18 -169.07 2.35 Favored 'General case' 0 C--O 1.219 -0.551 0 CA-C-N 112.86 -1.973 . . . . 10.0 107.819 -179.938 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 12.3 t0 -170.62 77.42 0.08 Allowed 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 101.598 -3.482 . . . . 10.0 101.598 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.499 ' CD1' ' CD2' ' A' ' 70' ' ' PHE . 66.4 m-85 -62.96 175.13 0.91 Allowed 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 114.722 1.379 . . . . 10.0 114.722 -179.891 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -134.75 94.05 3.12 Favored 'General case' 0 C--O 1.217 -0.65 0 N-CA-C 104.451 -2.425 . . . . 10.0 104.451 179.517 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 5.3 t -59.99 120.12 5.29 Favored 'Isoleucine or valine' 0 C--O 1.245 0.862 0 O-C-N 124.268 0.98 . . . . 10.0 112.961 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 105.66 23.35 7.56 Favored Glycine 0 CA--C 1.532 1.149 0 CA-C-N 114.903 -1.044 . . . . 10.0 114.957 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -172.43 143.5 1.4 Allowed 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 116.795 -1.574 . . . . 10.0 114.701 179.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.3 118.31 3.72 Favored 'General case' 0 C--N 1.319 -0.747 0 O-C-N 125.333 1.646 . . . . 10.0 108.61 179.757 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.499 ' CD2' ' CD1' ' A' ' 64' ' ' PHE . 81.8 t80 -91.83 -34.29 14.61 Favored 'General case' 0 C--O 1.239 0.525 0 CA-C-N 113.122 -1.854 . . . . 10.0 112.824 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 72.6 161.76 0.25 Allowed 'General case' 0 C--O 1.217 -0.649 0 N-CA-C 105.513 -2.032 . . . . 10.0 105.513 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.492 ' OE1' HD23 ' A' ' 74' ' ' LEU . 32.8 mt-10 -136.85 -46.92 0.59 Allowed 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 114.779 1.4 . . . . 10.0 114.779 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 56.52 28.03 13.19 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 108.405 -0.961 . . . . 10.0 108.405 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.498 HD13 ' H ' ' A' ' 75' ' ' THR . 0.2 OUTLIER -39.57 143.25 0.23 Allowed 'General case' 0 C--N 1.313 -1.009 0 N-CA-C 116.917 2.191 . . . . 10.0 116.917 -179.95 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.498 ' H ' HD13 ' A' ' 74' ' ' LEU . 0.2 OUTLIER -165.84 107.62 0.75 Allowed 'General case' 0 C--O 1.241 0.626 0 N-CA-C 107.314 -1.365 . . . . 10.0 107.314 179.755 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 162.26 -54.88 0.3 Allowed Glycine 0 N--CA 1.438 -1.177 0 N-CA-C 108.988 -1.645 . . . . 10.0 108.988 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.641 HG22 HD21 ' A' ' 29' ' ' LEU . 1.2 pt -121.77 142.94 36.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 N-CA-C 103.441 -2.8 . . . . 10.0 103.441 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.431 ' HA ' HG23 ' A' ' 25' ' ' VAL . 23.5 t0 64.7 -68.5 0.1 Allowed 'General case' 0 N--CA 1.443 -0.804 0 O-C-N 125.712 1.883 . . . . 10.0 113.918 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 81.83 70.52 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.572 0 O-C-N 126.309 2.255 . . . . 10.0 111.46 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 6.3 mtm180 -121.68 -171.96 2.33 Favored 'General case' 0 C--O 1.236 0.358 0 O-C-N 120.506 -1.371 . . . . 10.0 112.733 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 5.4 mtpm? -139.27 135.77 34.2 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 103.439 -2.801 . . . . 10.0 103.439 -179.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 27.5 p -172.22 159.08 4.7 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-O 123.014 1.388 . . . . 10.0 108.993 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -107.05 108.45 19.94 Favored 'General case' 0 N--CA 1.441 -0.923 1 N-CA-C 98.381 -4.674 . . . . 10.0 98.381 -179.726 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 17.7 m -105.04 112.79 26.05 Favored 'General case' 0 N--CA 1.445 -0.693 0 O-C-N 126.805 2.566 . . . . 10.0 116.641 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 25.5 m -106.72 115.66 30.57 Favored 'General case' 0 N--CA 1.439 -0.979 0 O-C-N 125.892 1.995 . . . . 10.0 109.284 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 58.1 t -86.76 143.21 11.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 104.625 -2.361 . . . . 10.0 104.625 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 39.1 t -163.73 133.17 4.01 Favored 'General case' 0 C--O 1.243 0.759 0 CA-C-N 113.986 -1.461 . . . . 10.0 111.712 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -82.61 126.22 32.07 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 119.573 -0.851 . . . . 10.0 110.08 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -75.28 -37.95 60.65 Favored 'General case' 0 C--N 1.313 -1.002 1 N-CA-C 98.803 -4.518 . . . . 10.0 98.803 179.868 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 163.04 -73.75 0.19 Allowed Glycine 0 C--N 1.333 0.4 0 N-CA-C 106.015 -2.834 . . . . 10.0 106.015 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -106.57 8.45 31.29 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.092 -0.643 . . . . 10.0 109.669 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.5 121.04 21.59 Favored 'General case' 0 N--CA 1.442 -0.846 0 N-CA-C 109.195 -0.669 . . . . 10.0 109.195 -179.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.62 HD11 ' CE ' ' A' ' 49' ' ' MET . 0.3 OUTLIER -84.24 83.32 8.01 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 104.931 -2.248 . . . . 10.0 104.931 -179.998 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -86.05 139.45 31.14 Favored 'General case' 0 C--O 1.212 -0.881 0 CA-C-N 113.051 -1.886 . . . . 10.0 113.663 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -130.86 146.05 52.17 Favored 'General case' 0 C--O 1.241 0.631 0 CA-C-N 113.521 -1.672 . . . . 10.0 109.616 -179.753 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 9.1 p -121.16 142.41 37.43 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 N-CA-C 104.765 -2.309 . . . . 10.0 104.765 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -148.82 94.43 2.26 Favored 'General case' 0 C--N 1.321 -0.656 0 O-C-N 125.106 1.504 . . . . 10.0 109.557 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.87 119.88 8.54 Favored 'General case' 0 C--O 1.213 -0.833 0 O-C-N 121.055 -1.028 . . . . 10.0 112.448 -179.697 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -134.77 -160.37 9.08 Favored Glycine 0 C--N 1.312 -0.782 0 CA-C-O 117.808 -1.551 . . . . 10.0 110.62 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -90.33 4.48 50.67 Favored 'General case' 0 C--N 1.316 -0.873 0 O-C-N 126.7 2.059 . . . . 10.0 115.723 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 11.1 mmtt -107.86 -176.27 3.01 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 115.342 1.608 . . . . 10.0 115.342 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -67.31 -60.89 2.21 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 125.546 1.779 . . . . 10.0 108.659 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -141.91 127.28 3.22 Favored Glycine 0 C--N 1.338 0.681 0 N-CA-C 117.639 1.815 . . . . 10.0 117.639 179.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -144.45 127.92 16.96 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-O 117.734 -1.127 . . . . 10.0 109.343 -179.655 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 176.49 160.68 24.11 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 109.21 -1.556 . . . . 10.0 109.21 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 38.6 m0 -116.48 105.29 12.32 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 123.321 0.648 . . . . 10.0 109.726 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.4 m -98.69 77.03 2.24 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 107.518 -1.29 . . . . 10.0 107.518 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.435 ' HG3' HD13 ' A' ' 117' ' ' LEU . 14.5 mp0 -72.02 111.69 7.47 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 122.743 1.259 . . . . 10.0 108.468 -179.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 4.4 t90 -113.53 109.31 18.44 Favored 'General case' 0 C--O 1.214 -0.804 0 O-C-N 120.557 -1.34 . . . . 10.0 110.934 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.434 HD12 ' CE1' ' A' ' 4' ' ' PHE . 10.3 mt -76.58 148.09 7.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 116.568 2.062 . . . . 10.0 116.568 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -130.84 58.66 1.69 Allowed 'General case' 0 C--O 1.219 -0.523 0 N-CA-C 105.429 -2.063 . . . . 10.0 105.429 -179.833 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 65.66 -94.24 0.19 Allowed Glycine 0 C--O 1.22 -0.777 0 N-CA-C 109.785 -1.326 . . . . 10.0 109.785 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -89.6 29.1 1.18 Allowed 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 122.838 1.304 . . . . 10.0 111.787 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -152.63 163.9 38.72 Favored 'General case' 0 CA--C 1.503 -0.827 0 O-C-N 120.736 -1.228 . . . . 10.0 114.082 179.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.577 HD12 ' CE2' ' A' ' 8' ' ' TRP . 2.4 tt -134.37 108.74 8.35 Favored 'General case' 0 N--CA 1.437 -1.12 0 O-C-N 126.201 2.188 . . . . 10.0 106.375 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -103.83 99.64 9.42 Favored 'General case' 0 C--O 1.212 -0.909 0 N-CA-C 105.53 -2.026 . . . . 10.0 105.53 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.435 HD13 ' HG3' ' A' ' 108' ' ' GLN . 17.2 tp -99.7 123.75 44.28 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 115.413 1.634 . . . . 10.0 115.413 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -99.66 73.7 1.82 Allowed 'General case' 0 N--CA 1.446 -0.665 0 O-C-N 123.479 0.487 . . . . 10.0 110.424 179.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 13.9 ttp -57.03 140.7 48.27 Favored 'General case' 0 N--CA 1.449 -0.516 0 O-C-N 124.4 1.063 . . . . 10.0 108.143 -179.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -125.64 156.04 39.85 Favored 'General case' 0 C--N 1.322 -0.621 0 O-C-N 125.928 2.018 . . . . 10.0 109.884 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 178.9 117.85 0.04 OUTLIER 'General case' 0 C--O 1.216 -0.662 0 O-C-N 126.545 2.403 . . . . 10.0 109.241 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 50.85 34.64 10.64 Favored 'General case' 0 N--CA 1.445 -0.72 0 O-C-N 125.447 1.717 . . . . 10.0 113.007 -179.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 85.02 -3.41 87.27 Favored Glycine 0 C--N 1.339 0.707 0 CA-C-O 122.385 0.992 . . . . 10.0 113.348 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 24.7 t -95.12 111.16 25.2 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 N-CA-C 107.632 -1.247 . . . . 10.0 107.632 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 4.1 m -101.1 106.25 17.5 Favored 'General case' 0 N--CA 1.442 -0.859 0 C-N-CA 125.468 1.507 . . . . 10.0 112.004 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -105.5 147.33 28.45 Favored 'General case' 0 C--O 1.214 -0.769 0 N-CA-C 105.047 -2.205 . . . . 10.0 105.047 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 7.8 mtpt -114.55 149.5 36.39 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 123.317 0.647 . . . . 10.0 110.739 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . 0.416 ' NE2' ' CZ ' ' A' ' 130' ' ' PHE . 0.1 OUTLIER -138.52 115.8 11.11 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 118.047 -0.978 . . . . 10.0 109.553 179.942 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 21.3 t -97.26 106.24 18.25 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.28 0 O-C-N 126.659 2.475 . . . . 10.0 110.885 -179.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . 0.467 ' HA ' ' HA ' ' A' ' 10' ' ' MET . 96.3 m-85 -92.75 172.65 8.21 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 106.58 -1.637 . . . . 10.0 106.58 179.827 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 46.5 tptt -140.88 122.13 14.83 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 107.014 -1.476 . . . . 10.0 107.014 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 18.4 ttpt -68.04 138.84 56.14 Favored 'General case' 0 C--O 1.218 -0.572 0 CA-C-N 120.169 1.35 . . . . 10.0 107.951 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -154.03 54.41 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.241 0.646 0 O-C-N 126.069 2.106 . . . . 10.0 111.139 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.441 -0.884 0 CA-C-O 116.392 -1.766 . . . . 10.0 111.925 -179.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.521 -0.135 0 CA-C-O 122.661 1.219 . . . . 10.0 109.664 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.406 ' HB3' ' HB ' ' A' ' 42' ' ' ILE . 99.0 m-85 -91.73 -17.39 25.5 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 117.447 2.388 . . . . 10.0 117.447 179.863 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 8.8 m120 -54.19 113.82 1.39 Allowed 'General case' 0 N--CA 1.477 0.89 0 CA-C-O 122.985 1.374 . . . . 10.0 112.858 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -177.61 -110.84 0.28 Allowed Glycine 0 C--N 1.347 1.163 0 N-CA-C 117.704 1.841 . . . . 10.0 117.704 179.75 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.574 ' O ' HG23 ' A' ' 133' ' ' VAL . 0.2 OUTLIER 173.09 93.99 0.01 OUTLIER 'General case' 0 C--O 1.241 0.621 0 N-CA-C 102.767 -3.049 . . . . 10.0 102.767 -179.846 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 10.0 m95 -94.38 105.48 17.45 Favored 'General case' 0 C--O 1.215 -0.724 0 CA-C-N 114.282 -1.326 . . . . 10.0 112.382 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.99 -163.5 0.04 OUTLIER 'General case' 0 C--O 1.239 0.53 0 C-N-CA 118.923 -1.111 . . . . 10.0 109.401 179.789 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -128.7 134.7 48.56 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.406 0.622 . . . . 10.0 112.628 179.813 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -99.73 -63.09 1.16 Allowed 'General case' 0 C--O 1.236 0.352 0 N-CA-C 108.853 -0.795 . . . . 10.0 108.853 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -132.52 173.77 10.97 Favored 'General case' 0 CA--C 1.511 -0.532 0 O-C-N 126.771 2.544 . . . . 10.0 114.59 -179.533 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 23.8 p-10 -150.11 172.48 15.21 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 113.906 -1.497 . . . . 10.0 107.641 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -157.6 132.68 8.79 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 114.673 1.36 . . . . 10.0 114.673 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 52.32 42.95 31.19 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 122.691 1.234 . . . . 10.0 112.425 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -69.36 -44.41 71.62 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 115.004 1.483 . . . . 10.0 115.004 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -71.9 -34.18 68.92 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-O 122.69 1.233 . . . . 10.0 113.758 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 -77.44 -20.35 54.66 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 117.651 -1.166 . . . . 10.0 109.371 179.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.751 ' CE1' HD11 ' A' ' 23' ' ' LEU . 0.1 OUTLIER -76.19 -42.81 45.09 Favored 'General case' 0 CA--C 1.552 1.032 0 O-C-N 126.976 2.673 . . . . 10.0 108.537 179.968 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.634 HD12 ' HA ' ' A' ' 30' ' ' ARG . 3.0 mt -72.03 -21.41 61.54 Favored 'General case' 0 C--O 1.211 -0.947 0 O-C-N 120.764 -1.21 . . . . 10.0 113.211 -179.826 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.6 ttm180 -78.52 -25.37 45.54 Favored 'General case' 0 C--O 1.243 0.737 0 N-CA-C 106.252 -1.759 . . . . 10.0 106.252 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.437 ' HB3' ' O ' ' A' ' 19' ' ' TYR . . . -63.81 -47.23 81.7 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.86 1.059 . . . . 10.0 113.86 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.751 HD11 ' CE1' ' A' ' 19' ' ' TYR . 0.4 OUTLIER -87.36 -6.4 58.49 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 119.25 0.932 . . . . 10.0 110.355 -179.705 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 71.48 19.04 5.3 Favored 'General case' 0 C--O 1.224 -0.273 0 O-C-N 123.815 0.697 . . . . 10.0 111.734 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.448 HG23 ' H ' ' A' ' 78' ' ' ASP . 10.0 p -59.04 163.54 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.219 0 N-CA-C 105.621 -1.992 . . . . 10.0 105.621 -179.833 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -41.81 148.31 0.17 Allowed 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 115.38 1.622 . . . . 10.0 115.38 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 2.9 p -73.32 -23.24 19.66 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.66 0 O-C-N 119.441 -2.037 . . . . 10.0 114.021 -179.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -73.98 -23.75 59.51 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 109.554 -0.535 . . . . 10.0 109.554 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -71.04 -45.49 63.77 Favored 'General case' 0 C--O 1.218 -0.566 0 O-C-N 126.317 2.261 . . . . 10.0 112.694 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.634 ' HA ' HD12 ' A' ' 20' ' ' LEU . 0.0 OUTLIER -68.15 -30.99 70.25 Favored 'General case' 0 CA--C 1.512 -0.499 0 O-C-N 125.107 1.504 . . . . 10.0 111.47 179.986 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.19 -44.72 59.37 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 108.647 -0.871 . . . . 10.0 108.647 -179.623 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 5.4 mt -76.21 -30.54 20.24 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 N-CA-C 108.109 -1.071 . . . . 10.0 108.109 -179.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -49.94 -61.57 2.06 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 127.977 3.298 . . . . 10.0 110.403 179.505 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.661 ' O ' HD12 ' A' ' 35' ' ' LEU . 14.5 t-20 -52.86 154.93 2.57 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 116.134 -1.888 . . . . 10.0 108.632 179.497 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.661 HD12 ' O ' ' A' ' 34' ' ' ASN . 0.4 OUTLIER 77.3 -39.21 0.31 Allowed 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 120.16 1.345 . . . . 10.0 113.167 -179.248 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -100.48 139.68 35.82 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 120.068 1.304 . . . . 10.0 110.948 179.693 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 14.9 mttt -127.13 111.82 21.62 Favored Pre-proline 0 CA--C 1.535 0.404 0 CA-C-O 123.151 1.453 . . . . 10.0 107.677 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -60.04 105.88 0.31 Allowed 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 123.307 2.671 . . . . 10.0 115.954 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.58 -177.98 1.67 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 118.31 0.504 . . . . 10.0 109.687 179.847 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.0 tptt -140.44 153.0 46.12 Favored 'General case' 0 C--N 1.314 -0.966 0 O-C-N 121.043 -1.036 . . . . 10.0 109.526 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.415 ' HB2' HD12 ' A' ' 54' ' ' LEU . 17.0 tt0 -154.6 69.68 0.76 Allowed 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 104.143 -2.54 . . . . 10.0 104.143 -179.894 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.453 HG22 ' N ' ' A' ' 43' ' ' VAL . 25.4 mm -56.99 152.21 2.7 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.01 0 O-C-N 121.791 -0.568 . . . . 10.0 112.181 -179.727 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.453 ' N ' HG22 ' A' ' 42' ' ' ILE . 0.0 OUTLIER -146.49 95.29 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 N-CA-C 104.461 -2.422 . . . . 10.0 104.461 179.969 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 55.8 tt0 -122.78 118.76 28.76 Favored 'General case' 0 C--O 1.218 -0.597 0 O-C-N 119.846 -1.784 . . . . 10.0 108.634 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -69.02 -85.89 0.02 OUTLIER 'General case' 0 C--O 1.236 0.387 0 N-CA-C 105.638 -1.986 . . . . 10.0 105.638 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -160.45 -54.79 0.01 OUTLIER Glycine 0 N--CA 1.461 0.348 0 N-CA-C 106.192 -2.763 . . . . 10.0 106.192 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.9 m-20 -100.78 4.4 42.92 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 108.643 -0.873 . . . . 10.0 108.643 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 34.6 m170 -142.07 174.2 10.82 Favored 'General case' 0 N--CA 1.438 -1.049 0 CA-C-O 117.82 -1.086 . . . . 10.0 110.246 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 14.0 ttp -149.22 165.07 32.98 Favored 'General case' 0 N--CA 1.441 -0.91 0 C-N-CA 118.699 -1.201 . . . . 10.0 111.806 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.437 ' C ' HD12 ' A' ' 51' ' ' ILE . 6.8 mm -149.25 123.5 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 103.563 -2.754 . . . . 10.0 103.563 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.437 HD12 ' C ' ' A' ' 50' ' ' ILE . 1.6 mp -110.51 133.23 56.6 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 N-CA-C 107.833 -1.173 . . . . 10.0 107.833 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.478 HH21 HD21 ' A' ' 54' ' ' LEU . 63.6 mtp180 -127.36 146.87 50.31 Favored 'General case' 0 C--O 1.214 -0.763 0 N-CA-C 109.021 -0.733 . . . . 10.0 109.021 179.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 18.4 m -128.22 108.21 10.42 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 102.402 -3.184 . . . . 10.0 102.402 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.478 HD21 HH21 ' A' ' 52' ' ' ARG . 11.0 mt -105.26 99.24 8.86 Favored 'General case' 0 C--N 1.32 -0.707 1 N-CA-C 122.095 4.109 . . . . 10.0 122.095 -179.775 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.5 m -129.94 173.29 10.83 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 104.879 -2.267 . . . . 10.0 104.879 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 32.5 p -101.49 31.5 3.73 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 107.211 -1.403 . . . . 10.0 107.211 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -124.5 -43.85 2.01 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-O 118.277 -0.868 . . . . 10.0 110.123 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -176.3 137.38 0.29 Allowed 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 118.006 -0.997 . . . . 10.0 112.389 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . 0.412 ' N ' ' ND2' ' A' ' 59' ' ' ASN . 0.9 OUTLIER -101.55 171.07 7.79 Favored 'General case' 0 C--O 1.241 0.621 0 O-C-N 125.012 1.445 . . . . 10.0 113.81 179.833 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -130.32 117.25 19.49 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 104.533 -2.395 . . . . 10.0 104.533 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 26.0 mm -122.8 112.86 35.78 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 N-CA-C 115.024 1.49 . . . . 10.0 115.024 179.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 3.2 mmt -130.67 178.25 6.78 Favored 'General case' 0 C--O 1.212 -0.876 0 CA-C-O 123.507 1.622 . . . . 10.0 108.372 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -151.59 107.53 3.4 Favored 'General case' 0 N--CA 1.437 -1.102 0 N-CA-C 101.929 -3.36 . . . . 10.0 101.929 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -107.73 174.31 5.94 Favored 'General case' 0 C--O 1.247 0.964 0 N-CA-C 116.854 2.168 . . . . 10.0 116.854 -179.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 5.7 mm100 -126.06 115.27 19.58 Favored 'General case' 0 N--CA 1.444 -0.743 0 N-CA-C 104.934 -2.247 . . . . 10.0 104.934 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 3.4 t -71.12 95.25 0.49 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.728 0 N-CA-C 109.218 -0.66 . . . . 10.0 109.218 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 112.29 55.74 0.46 Allowed Glycine 0 CA--C 1.532 1.131 0 C-N-CA 124.705 1.145 . . . . 10.0 115.46 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -174.06 121.9 0.3 Allowed 'General case' 0 C--O 1.236 0.388 0 C-N-CA 123.386 0.674 . . . . 10.0 112.562 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -56.08 135.81 52.65 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 124.521 1.128 . . . . 10.0 112.708 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -120.5 -174.66 2.85 Favored 'General case' 0 N--CA 1.437 -1.085 0 C-N-CA 124.165 0.986 . . . . 10.0 110.74 -179.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -148.9 66.72 1.04 Allowed 'General case' 0 C--N 1.312 -1.039 0 N-CA-C 108.149 -1.056 . . . . 10.0 108.149 179.639 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -51.4 118.39 3.26 Favored 'General case' 0 CA--C 1.509 -0.624 0 O-C-N 124.682 1.239 . . . . 10.0 111.529 179.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -71.54 -36.91 71.14 Favored 'General case' 0 C--N 1.318 -0.768 0 O-C-N 125.539 1.774 . . . . 10.0 110.544 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 19.4 mt 41.76 71.71 0.2 Allowed 'General case' 0 N--CA 1.441 -0.88 0 C-N-CA 124.813 1.245 . . . . 10.0 114.268 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -113.79 116.75 29.85 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 106.722 -1.584 . . . . 10.0 106.722 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 140.35 -67.84 0.49 Allowed Glycine 0 N--CA 1.444 -0.825 0 CA-C-O 118.778 -1.012 . . . . 10.0 111.361 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -111.14 147.15 15.35 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 N-CA-C 105.539 -2.022 . . . . 10.0 105.539 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.448 ' H ' HG23 ' A' ' 25' ' ' VAL . 77.7 m-20 55.28 16.5 1.71 Allowed 'General case' 0 N--CA 1.443 -0.8 0 CA-C-O 116.019 -1.943 . . . . 10.0 113.414 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -2.35 68.41 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 118.062 2.615 . . . . 10.0 118.062 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.64 -163.43 1.37 Allowed 'General case' 0 N--CA 1.452 -0.337 0 O-C-N 119.936 -1.727 . . . . 10.0 111.868 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 2.1 tptp -153.18 147.64 25.98 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 102.998 -2.964 . . . . 10.0 102.998 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 5.7 p -158.84 140.6 13.55 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 122.395 1.093 . . . . 10.0 110.562 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.1 ttt -93.77 67.6 3.84 Favored 'General case' 0 N--CA 1.441 -0.895 0 N-CA-C 102.797 -3.038 . . . . 10.0 102.797 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.552 HG23 ' N ' ' A' ' 85' ' ' THR . 0.6 OUTLIER -50.89 166.21 0.09 Allowed 'General case' 0 N--CA 1.434 -1.263 0 CA-C-N 112.958 -1.928 . . . . 10.0 115.479 179.921 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.552 ' N ' HG23 ' A' ' 84' ' ' THR . 0.2 OUTLIER -164.27 106.05 0.89 Allowed 'General case' 0 N--CA 1.442 -0.842 0 N-CA-C 108.217 -1.031 . . . . 10.0 108.217 179.608 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.459 ' CG1' HD11 ' A' ' 93' ' ' LEU . 32.6 t -108.15 118.05 54.99 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.974 0 N-CA-C 103.237 -2.875 . . . . 10.0 103.237 -179.903 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -124.65 149.44 47.13 Favored 'General case' 0 C--N 1.315 -0.895 0 O-C-N 124.786 1.304 . . . . 10.0 114.483 -179.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 4.0 t90 -85.4 127.88 34.53 Favored 'General case' 0 C--N 1.329 -0.319 0 O-C-N 121.567 -0.708 . . . . 10.0 110.055 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -92.24 -55.33 3.47 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 101.434 -3.543 . . . . 10.0 101.434 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 146.59 -76.87 0.26 Allowed Glycine 0 C--O 1.245 0.787 0 N-CA-C 107.691 -2.164 . . . . 10.0 107.691 179.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.0 -24.12 67.59 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 114.837 -0.681 . . . . 10.0 111.078 -179.768 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.33 168.08 23.51 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-O 122.249 1.023 . . . . 10.0 110.129 179.831 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.68 HD13 ' N ' ' A' ' 94' ' ' GLN . 1.5 tm? -108.81 136.9 47.6 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 104.298 -2.482 . . . . 10.0 104.298 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . 0.68 ' N ' HD13 ' A' ' 93' ' ' LEU . 1.0 OUTLIER -138.33 145.25 40.95 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 118.772 0.715 . . . . 10.0 110.199 -179.911 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 6.7 m -123.03 159.98 27.27 Favored 'General case' 0 CA--C 1.505 -0.784 0 O-C-N 126.163 2.165 . . . . 10.0 114.129 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -159.02 128.75 0.75 Allowed 'Isoleucine or valine' 0 C--O 1.246 0.903 0 N-CA-C 105.134 -2.173 . . . . 10.0 105.134 -179.662 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.6 140.05 48.06 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 122.673 1.225 . . . . 10.0 110.998 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -86.92 179.69 6.67 Favored 'General case' 0 C--N 1.343 0.297 0 N-CA-C 115.013 1.486 . . . . 10.0 115.013 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 142.37 -157.01 26.44 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.972 -0.632 . . . . 10.0 112.281 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -89.03 -17.04 30.19 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 118.387 2.736 . . . . 10.0 118.387 179.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 17.3 mmtt -81.96 179.55 7.78 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 115.203 1.557 . . . . 10.0 115.203 -179.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -108.71 14.87 24.1 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 126.764 2.026 . . . . 10.0 113.004 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -148.24 -88.24 0.07 OUTLIER Glycine 0 C--N 1.342 0.914 0 CA-C-N 113.547 -1.661 . . . . 10.0 114.549 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 6.2 mtp180 31.71 92.17 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.808 0 O-C-N 126.912 2.183 . . . . 10.0 114.889 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 169.97 149.88 6.57 Favored Glycine 0 N--CA 1.441 -0.97 0 N-CA-C 110.085 -1.206 . . . . 10.0 110.085 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -112.26 168.08 9.91 Favored 'General case' 0 C--N 1.32 -0.679 0 O-C-N 120.64 -1.506 . . . . 10.0 109.257 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.7 m -151.01 120.06 6.7 Favored 'General case' 0 C--O 1.215 -0.72 0 N-CA-C 107.703 -1.221 . . . . 10.0 107.703 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -117.38 102.0 8.87 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 124.426 2.06 . . . . 10.0 114.738 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' TRP . . . . . 0.489 ' CD1' ' C ' ' A' ' 109' ' ' TRP . 0.0 OUTLIER -111.99 133.48 54.14 Favored 'General case' 0 C--O 1.217 -0.645 0 O-C-N 119.6 -1.938 . . . . 10.0 107.333 179.956 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 33.1 mt -98.93 142.13 15.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 O-C-N 126.603 2.439 . . . . 10.0 114.4 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -130.57 97.29 4.34 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 104.619 -2.363 . . . . 10.0 104.619 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 55.61 -118.13 10.04 Favored Glycine 0 C--O 1.221 -0.714 0 N-CA-C 109.721 -1.351 . . . . 10.0 109.721 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -92.4 12.72 21.76 Favored 'General case' 0 C--N 1.327 -0.392 0 O-C-N 126.06 1.682 . . . . 10.0 111.277 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -109.74 -179.18 3.74 Favored 'General case' 0 CA--C 1.513 -0.448 0 CA-C-O 117.701 -1.142 . . . . 10.0 111.234 179.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.707 HD23 ' CG ' ' A' ' 130' ' ' PHE . 2.3 tp -157.0 117.97 3.66 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 127.128 2.171 . . . . 10.0 106.725 179.749 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -104.47 121.21 42.96 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 106.367 -1.716 . . . . 10.0 106.367 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 10.8 tp -106.16 132.48 52.18 Favored 'General case' 0 C--N 1.315 -0.895 0 O-C-N 123.285 0.366 . . . . 10.0 111.101 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -119.25 100.53 7.38 Favored 'General case' 0 C--N 1.315 -0.893 0 O-C-N 125.149 1.531 . . . . 10.0 107.694 -179.664 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.537 ' HE1' ' CZ ' ' A' ' 19' ' ' TYR . 1.3 tmm? -109.55 136.67 48.55 Favored 'General case' 0 N--CA 1.444 -0.767 0 O-C-N 124.767 1.292 . . . . 10.0 109.372 -179.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -124.03 147.76 47.58 Favored 'General case' 0 C--N 1.315 -0.922 0 O-C-N 125.947 2.03 . . . . 10.0 113.172 179.756 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -156.17 131.49 9.41 Favored 'General case' 0 CA--C 1.501 -0.916 0 O-C-N 124.473 1.108 . . . . 10.0 109.314 179.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 47.42 29.5 1.35 Allowed 'General case' 0 C--N 1.319 -0.754 0 O-C-N 125.176 1.548 . . . . 10.0 114.409 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 93.6 -0.84 68.24 Favored Glycine 0 CA--C 1.528 0.881 0 N-CA-C 116.333 1.293 . . . . 10.0 116.333 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 21.2 t -107.21 158.9 7.0 Favored 'Isoleucine or valine' 0 C--O 1.242 0.676 0 N-CA-C 106.699 -1.593 . . . . 10.0 106.699 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -138.86 130.3 27.21 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 118.72 0.691 . . . . 10.0 111.94 -179.744 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 1.1 t -98.18 148.56 23.46 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 104.837 -2.282 . . . . 10.0 104.837 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 20.1 mtpt -126.83 111.48 14.24 Favored 'General case' 0 C--O 1.218 -0.605 0 O-C-N 125.491 1.744 . . . . 10.0 108.988 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -114.53 113.59 24.63 Favored 'General case' 0 N--CA 1.447 -0.622 0 O-C-N 127.287 2.867 . . . . 10.0 114.136 179.821 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 2.3 t -91.56 133.01 34.49 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.768 0 O-C-N 123.905 0.753 . . . . 10.0 109.043 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . 0.707 ' CG ' HD23 ' A' ' 115' ' ' LEU . 9.3 m-85 -121.58 177.62 5.16 Favored 'General case' 0 C--O 1.214 -0.802 0 C-N-CA 126.178 1.791 . . . . 10.0 107.259 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 4.9 ttpt -158.07 138.66 12.84 Favored 'General case' 0 N--CA 1.445 -0.715 0 O-C-N 126.281 2.238 . . . . 10.0 106.376 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 2.2 tttp -74.16 130.11 39.14 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 123.035 1.398 . . . . 10.0 108.692 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' VAL . . . . . 0.574 HG23 ' O ' ' A' ' 7' ' ' TYR . 2.1 t -96.83 -0.69 10.52 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 CA-C-N 114.846 -1.07 . . . . 10.0 109.219 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.24 0.604 0 O-C-N 126.773 2.545 . . . . 10.0 108.778 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.541 0.62 0 N-CA-C 113.857 1.058 . . . . 10.0 113.857 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -56.82 -28.7 61.92 Favored 'General case' 0 C--O 1.222 -0.358 0 N-CA-C 117.869 2.544 . . . . 10.0 117.869 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.4 p30 -52.46 153.15 3.14 Favored 'General case' 0 N--CA 1.478 0.962 0 O-C-N 125.75 1.906 . . . . 10.0 113.673 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 148.06 -140.91 8.71 Favored Glycine 0 C--N 1.336 0.533 0 N-CA-C 116.659 1.423 . . . . 10.0 116.659 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -144.17 156.9 44.51 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 103.392 -2.818 . . . . 10.0 103.392 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.751 ' CE2' HD22 ' A' ' 115' ' ' LEU . 3.8 m0 -160.11 72.73 0.5 Allowed 'General case' 0 C--N 1.315 -0.897 0 O-C-N 126.313 2.258 . . . . 10.0 113.202 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.31 113.83 1.73 Allowed 'General case' 0 C--O 1.238 0.458 0 N-CA-C 107.21 -1.404 . . . . 10.0 107.21 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -68.32 146.31 53.4 Favored 'General case' 0 CA--C 1.512 -0.51 0 O-C-N 119.338 -2.101 . . . . 10.0 113.424 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.0 mt -103.98 -46.56 4.44 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.994 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.5 t -155.31 153.82 31.13 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 116.182 1.919 . . . . 10.0 116.182 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -120.37 115.12 22.9 Favored 'General case' 0 C--N 1.318 -0.789 0 O-C-N 127.059 2.725 . . . . 10.0 104.508 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -92.68 139.22 30.78 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 120.243 1.383 . . . . 10.0 112.923 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 8.2 m120 56.09 31.66 18.59 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 113.683 0.994 . . . . 10.0 113.683 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 22.0 t80 -67.5 -32.13 72.74 Favored 'General case' 0 CA--C 1.55 0.967 0 O-C-N 120.778 -1.201 . . . . 10.0 113.733 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.65 -37.43 42.06 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-O 122.729 1.252 . . . . 10.0 110.565 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.33 -20.22 60.18 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-O 123.897 1.808 . . . . 10.0 107.064 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -74.81 -39.26 61.78 Favored 'General case' 0 CA--C 1.553 1.093 0 CA-C-N 114.141 -1.391 . . . . 10.0 111.105 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.591 HD12 ' HG3' ' A' ' 30' ' ' ARG . 4.0 mt -78.02 -21.13 51.22 Favored 'General case' 0 C--O 1.21 -0.987 0 O-C-N 125.152 1.532 . . . . 10.0 109.73 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 26.9 ttp180 -77.27 -24.13 51.11 Favored 'General case' 0 C--O 1.245 0.846 0 CA-C-N 114.015 -1.448 . . . . 10.0 109.101 179.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.22 -51.46 67.68 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 126.224 1.809 . . . . 10.0 113.731 -179.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -110.78 6.98 21.84 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 119.094 0.861 . . . . 10.0 112.001 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 50.57 80.77 0.07 Allowed 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.795 1.035 . . . . 10.0 113.795 179.568 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.449 ' CG1' HD13 ' A' ' 20' ' ' LEU . 8.7 p -99.09 39.69 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.808 0 CA-C-N 115.162 -0.926 . . . . 10.0 110.074 -179.624 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 75.11 143.7 0.08 Allowed 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 117.151 2.278 . . . . 10.0 117.151 -179.48 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 63.3 t -75.4 -33.42 27.57 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 O-C-N 124.893 1.371 . . . . 10.0 114.647 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -71.51 -27.87 63.5 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 122.933 1.349 . . . . 10.0 111.223 179.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.441 HD22 HG22 ' A' ' 25' ' ' VAL . 1.3 tp -79.17 -34.65 42.91 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 123.685 0.794 . . . . 10.0 110.206 179.751 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.591 ' HG3' HD12 ' A' ' 20' ' ' LEU . 42.8 ttp85 -77.37 -30.86 53.97 Favored 'General case' 0 C--O 1.242 0.702 0 O-C-N 120.742 -1.224 . . . . 10.0 111.746 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.66 -39.5 80.64 Favored 'General case' 0 C--N 1.314 -0.947 0 C-N-CA 126.45 1.9 . . . . 10.0 109.38 179.715 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 80.1 mt -79.41 -57.16 5.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 O-C-N 125.284 1.615 . . . . 10.0 112.595 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -50.01 -31.79 13.71 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 115.127 1.528 . . . . 10.0 115.127 -179.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -61.05 -26.76 67.86 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 123.38 1.562 . . . . 10.0 113.377 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.662 ' N ' HD22 ' A' ' 35' ' ' LEU . 0.9 OUTLIER -97.17 -6.3 35.15 Favored 'General case' 0 C--N 1.323 -0.576 0 O-C-N 119.074 -2.266 . . . . 10.0 113.666 179.848 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 47.2 mt -96.64 109.03 21.73 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 124.933 1.395 . . . . 10.0 108.023 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 20.1 mttp -120.01 93.86 48.17 Favored Pre-proline 0 C--O 1.236 0.392 0 O-C-N 119.657 -1.902 . . . . 10.0 106.935 -179.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -69.41 172.1 12.9 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 125.205 3.937 . . . . 10.0 118.211 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -122.0 113.63 19.83 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 104.429 -2.434 . . . . 10.0 104.429 -179.825 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.1 mttm -81.26 138.17 35.77 Favored 'General case' 0 C--N 1.316 -0.883 0 O-C-N 120.752 -1.218 . . . . 10.0 112.431 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -128.32 107.62 9.91 Favored 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 103.783 -2.673 . . . . 10.0 103.783 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.6 mt -95.82 149.34 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 CA-C-O 123.573 1.654 . . . . 10.0 108.968 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -147.41 131.03 9.07 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 CA-C-O 123.92 1.819 . . . . 10.0 106.105 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -116.61 143.95 44.99 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 105.638 -1.986 . . . . 10.0 105.638 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -126.29 -66.65 0.91 Allowed 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 108.31 -0.996 . . . . 10.0 108.31 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -171.54 92.78 0.1 OUTLIER Glycine 0 CA--C 1.522 0.479 0 N-CA-C 107.82 -2.112 . . . . 10.0 107.82 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 60.89 19.29 9.59 Favored 'General case' 0 C--N 1.32 -0.686 0 O-C-N 121.72 -0.871 . . . . 10.0 109.663 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 5.9 m80 -137.88 78.18 1.67 Allowed 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 104.884 -2.265 . . . . 10.0 104.884 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.479 ' HB2' ' CG2' ' A' ' 66' ' ' VAL . 1.0 OUTLIER -78.3 126.27 30.54 Favored 'General case' 0 N--CA 1.441 -0.889 0 CA-C-N 114.114 -1.403 . . . . 10.0 112.133 179.925 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.617 ' C ' HD12 ' A' ' 51' ' ' ILE . 76.3 mt -110.6 139.68 33.14 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.544 0 N-CA-C 107.872 -1.159 . . . . 10.0 107.872 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.617 HD12 ' C ' ' A' ' 50' ' ' ILE . 1.8 mp -132.43 109.56 15.0 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 N-CA-C 105.629 -1.989 . . . . 10.0 105.629 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 36.7 mtt180 -106.15 116.15 31.44 Favored 'General case' 0 C--N 1.315 -0.904 0 O-C-N 126.802 2.564 . . . . 10.0 111.487 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.1 m -105.28 127.59 53.02 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 100.441 -3.911 . . . . 10.0 100.441 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 11.6 mt -117.29 98.28 6.35 Favored 'General case' 0 C--N 1.321 -0.662 1 N-CA-C 121.929 4.048 . . . . 10.0 121.929 179.772 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 82.7 p -108.72 138.75 44.54 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 126.926 2.09 . . . . 10.0 106.342 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -82.36 9.22 9.43 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 116.873 -1.537 . . . . 10.0 111.564 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 29.1 t80 -110.1 -46.62 3.43 Favored 'General case' 0 C--O 1.24 0.599 0 N-CA-C 108.27 -1.011 . . . . 10.0 108.27 -179.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 2.4 tpm_? -163.86 102.62 0.9 Allowed 'General case' 0 C--O 1.241 0.618 0 O-C-N 124.65 1.219 . . . . 10.0 111.93 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -76.05 170.09 16.94 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 120.737 -1.227 . . . . 10.0 111.435 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.459 ' CG ' ' O ' ' A' ' 60' ' ' TYR . 0.1 OUTLIER -151.44 56.19 0.87 Allowed 'General case' 0 C--O 1.214 -0.802 0 CA-C-O 125.088 2.375 . . . . 10.0 107.194 179.902 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.436 HD13 ' N ' ' A' ' 61' ' ' ILE . 2.9 mm -39.79 134.15 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 O-C-N 120.429 -1.42 . . . . 10.0 114.593 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -106.92 -178.06 3.54 Favored 'General case' 0 CA--C 1.513 -0.457 0 O-C-N 125.426 1.704 . . . . 10.0 107.345 -179.668 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -166.76 87.76 0.32 Allowed 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 101.878 -3.378 . . . . 10.0 101.878 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -93.2 164.87 13.08 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 116.249 1.944 . . . . 10.0 116.249 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.64 125.22 33.49 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 102.79 -3.041 . . . . 10.0 102.79 -179.715 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.479 ' CG2' ' HB2' ' A' ' 49' ' ' MET . 5.1 t -80.18 95.51 2.37 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 O-C-N 124.143 0.902 . . . . 10.0 112.803 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 102.8 39.8 2.64 Favored Glycine 0 CA--C 1.52 0.383 0 N-CA-C 114.99 0.756 . . . . 10.0 114.99 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -160.96 144.84 13.41 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 115.256 1.576 . . . . 10.0 115.256 -179.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -91.91 129.2 37.93 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 108.639 -0.874 . . . . 10.0 108.639 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 29.6 p90 -150.05 31.17 0.69 Allowed 'General case' 0 N--CA 1.439 -0.989 0 CA-C-O 116.113 -1.898 . . . . 10.0 113.413 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 12.6 pm0 36.18 84.53 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.773 0 O-C-N 126.243 2.215 . . . . 10.0 110.762 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -23.65 -43.51 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.959 0 O-C-N 126.764 2.54 . . . . 10.0 117.124 -179.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 73.29 89.68 0.09 Allowed 'General case' 0 C--O 1.224 -0.277 0 CA-C-N 113.223 -1.808 . . . . 10.0 109.871 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.558 HD22 ' CD1' ' A' ' 77' ' ' ILE . 8.6 mt -104.41 65.46 0.78 Allowed 'General case' 0 C--N 1.313 -0.988 0 O-C-N 121.145 -0.972 . . . . 10.0 112.798 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 11.0 p -107.99 33.22 4.22 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.447 -0.946 . . . . 10.0 108.447 179.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -116.98 -26.68 2.93 Favored Glycine 0 CA--C 1.509 -0.334 0 CA-C-O 117.617 -1.657 . . . . 10.0 113.277 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.558 ' CD1' HD22 ' A' ' 74' ' ' LEU . 0.1 OUTLIER -132.11 -80.1 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.721 0 CA-C-N 119.202 1.501 . . . . 10.0 110.022 -179.826 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -87.52 36.85 0.76 Allowed 'General case' 0 N--CA 1.444 -0.768 0 CA-C-O 116.697 -1.621 . . . . 10.0 115.02 -179.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 25.0 t0 11.75 74.93 0.01 OUTLIER 'General case' 0 C--O 1.219 -0.501 0 O-C-N 126.283 2.24 . . . . 10.0 116.45 179.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.86 96.09 1.11 Allowed 'General case' 0 CA--C 1.508 -0.653 0 O-C-N 126.667 2.48 . . . . 10.0 114.299 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 11.1 ttpt -67.75 128.6 37.08 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 106.378 -1.712 . . . . 10.0 106.378 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 41.3 m -120.97 171.82 8.37 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 126.856 2.598 . . . . 10.0 108.159 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 18.5 mtt -95.54 107.35 19.52 Favored 'General case' 0 C--N 1.314 -0.977 1 N-CA-C 99.697 -4.186 . . . . 10.0 99.697 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 5.2 m -122.89 144.14 49.42 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 117.665 2.468 . . . . 10.0 117.665 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -136.52 125.61 24.49 Favored 'General case' 0 N--CA 1.441 -0.878 0 N-CA-C 107.661 -1.237 . . . . 10.0 107.661 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -100.1 149.62 5.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 N-CA-C 102.798 -3.038 . . . . 10.0 102.798 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -165.77 156.86 13.71 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 114.306 1.224 . . . . 10.0 114.306 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -97.55 112.32 24.22 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 114.574 -1.194 . . . . 10.0 109.49 -179.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -118.8 85.03 2.29 Favored 'General case' 0 CA--C 1.532 0.288 1 N-CA-C 99.998 -4.075 . . . . 10.0 99.998 -179.774 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 92.93 -133.91 11.93 Favored Glycine 0 CA--C 1.498 -0.977 0 N-CA-C 105.308 -3.117 . . . . 10.0 105.308 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -104.43 35.17 2.81 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 122.841 0.457 . . . . 10.0 110.0 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 7.5 mtpt -128.18 172.33 11.1 Favored 'General case' 0 N--CA 1.463 0.18 0 O-C-N 126.506 2.379 . . . . 10.0 106.817 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -133.65 89.48 2.59 Favored 'General case' 0 C--N 1.323 -0.572 0 O-C-N 126.715 2.509 . . . . 10.0 107.275 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -76.16 154.99 34.97 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 116.465 -0.334 . . . . 10.0 110.828 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 3.3 m -144.27 133.74 23.34 Favored 'General case' 0 C--O 1.218 -0.587 0 O-C-N 126.212 2.195 . . . . 10.0 110.506 179.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -136.83 132.84 48.05 Favored 'Isoleucine or valine' 0 C--O 1.243 0.747 0 CA-C-N 113.42 -1.718 . . . . 10.0 107.395 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -118.54 121.1 39.42 Favored 'General case' 0 C--O 1.24 0.597 0 C-N-CA 124.36 1.064 . . . . 10.0 110.776 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 6.9 mttm -90.7 87.31 6.64 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 119.123 0.874 . . . . 10.0 109.979 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -131.11 75.55 0.42 Allowed Glycine 0 N--CA 1.438 -1.174 0 CA-C-O 116.458 -2.301 . . . . 10.0 114.082 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 28.04 39.74 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 117.549 2.426 . . . . 10.0 117.549 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 5.8 mmtt -131.46 160.01 36.41 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 115.31 1.596 . . . . 10.0 115.31 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -73.75 -37.95 64.88 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 112.676 -2.056 . . . . 10.0 108.829 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -135.78 134.0 6.97 Favored Glycine 0 C--O 1.222 -0.617 0 CA-C-O 117.201 -1.888 . . . . 10.0 113.681 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 173.72 106.07 0.01 OUTLIER 'General case' 0 N--CA 1.439 -0.983 0 O-C-N 124.91 1.006 . . . . 10.0 110.034 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 166.45 160.31 13.49 Favored Glycine 0 C--O 1.215 -1.063 0 N-CA-C 109.313 -1.515 . . . . 10.0 109.313 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 6.2 m0 -123.04 -179.65 4.35 Favored 'General case' 0 N--CA 1.442 -0.841 0 O-C-N 126.496 1.939 . . . . 10.0 109.268 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -164.47 151.55 11.46 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 104.163 -2.532 . . . . 10.0 104.163 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.595 ' NE2' HD13 ' A' ' 117' ' ' LEU . 3.4 tp-100 -140.32 151.98 45.48 Favored 'General case' 0 N--CA 1.444 -0.744 0 O-C-N 125.731 1.894 . . . . 10.0 108.808 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' TRP . . . . . 0.458 ' CD1' ' C ' ' A' ' 109' ' ' TRP . 0.0 OUTLIER -167.34 137.39 2.88 Favored 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 125.156 1.382 . . . . 10.0 107.529 179.977 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 33.6 mt -96.92 114.98 35.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 118.624 2.824 . . . . 10.0 118.624 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -95.97 161.75 13.86 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 102.645 -3.094 . . . . 10.0 102.645 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -57.75 106.25 0.75 Allowed Glycine 0 N--CA 1.443 -0.843 0 CA-C-O 118.571 -1.127 . . . . 10.0 110.835 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 69.34 11.76 8.18 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 126.133 1.725 . . . . 10.0 112.701 -179.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -151.86 120.57 6.53 Favored 'General case' 0 CA--C 1.499 -0.989 0 CA-C-O 124.712 2.196 . . . . 10.0 114.559 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.751 HD22 ' CE2' ' A' ' 8' ' ' TRP . 2.9 tp -78.07 138.06 38.57 Favored 'General case' 0 C--N 1.319 -0.717 0 CA-C-N 113.903 -1.498 . . . . 10.0 107.52 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -117.81 112.01 19.83 Favored 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 106.601 -1.629 . . . . 10.0 106.601 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.595 HD13 ' NE2' ' A' ' 108' ' ' GLN . 6.9 tp -122.65 131.83 53.99 Favored 'General case' 0 C--N 1.315 -0.921 0 C-N-CA 124.952 1.301 . . . . 10.0 107.922 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -135.81 151.93 50.57 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 106.183 -1.784 . . . . 10.0 106.183 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -156.39 160.42 39.63 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.328 -0.851 . . . . 10.0 109.641 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 3.4 mtm180 -138.82 179.55 6.42 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 117.289 -1.338 . . . . 10.0 114.042 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -173.62 132.5 0.45 Allowed 'General case' 0 CA--C 1.499 -1.016 0 O-C-N 125.269 1.606 . . . . 10.0 106.734 179.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 35.56 60.46 0.75 Allowed 'General case' 0 N--CA 1.475 0.821 0 O-C-N 126.669 2.481 . . . . 10.0 116.661 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 64.52 10.33 42.63 Favored Glycine 0 N--CA 1.444 -0.813 0 C-N-CA 123.877 0.751 . . . . 10.0 113.091 179.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 14.9 t -107.81 151.42 9.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 CA-C-N 118.958 1.379 . . . . 10.0 108.203 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 3.1 m -121.85 140.01 52.92 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 122.648 1.213 . . . . 10.0 112.279 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -137.77 175.23 9.77 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 113.165 -1.834 . . . . 10.0 106.466 -179.749 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 177.74 163.33 0.6 Allowed 'General case' 0 C--O 1.24 0.553 0 O-C-N 123.973 0.795 . . . . 10.0 111.309 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -131.01 133.51 45.83 Favored 'General case' 0 CA--C 1.5 -0.961 0 CA-C-N 115.708 -0.678 . . . . 10.0 111.461 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 55.5 t -100.21 90.56 1.94 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.43 0 C-N-CA 124.675 1.19 . . . . 10.0 109.68 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . 0.46 ' HB2' ' HB3' ' A' ' 115' ' ' LEU . 13.4 m-30 -81.96 166.57 19.74 Favored 'General case' 0 N--CA 1.442 -0.85 0 CA-C-O 122.557 1.17 . . . . 10.0 111.31 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.23 127.14 16.36 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 106.318 -1.734 . . . . 10.0 106.318 179.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 8.6 tttp -77.55 142.98 38.72 Favored 'General case' 0 CA--C 1.504 -0.807 0 N-CA-C 106.376 -1.713 . . . . 10.0 106.376 179.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 10.4 p -97.03 -14.26 7.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 119.369 0.986 . . . . 10.0 111.978 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 12.0 t-80 . . . . . 0 C--N 1.314 -0.946 0 O-C-N 126.315 2.259 . . . . 10.0 110.87 -179.958 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 . . . . . 0 C--O 1.239 0.52 0 N-CA-C 113.89 1.07 . . . . 10.0 113.89 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -85.45 24.32 1.2 Allowed 'General case' 0 C--O 1.243 0.719 0 O-C-N 121.119 -0.988 . . . . 10.0 111.759 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 13.2 m-80 -55.92 125.51 21.74 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 120.909 -1.12 . . . . 10.0 111.762 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 159.26 -163.38 33.35 Favored Glycine 0 C--O 1.214 -1.132 0 C-N-CA 117.963 -2.065 . . . . 10.0 116.409 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -122.7 173.26 7.84 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 105.058 -2.201 . . . . 10.0 105.058 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.657 ' CE3' HD12 ' A' ' 115' ' ' LEU . 1.1 m0 -169.56 98.58 0.33 Allowed 'General case' 0 N--CA 1.445 -0.698 0 O-C-N 125.306 1.629 . . . . 10.0 114.782 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.53 146.95 28.06 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 104.362 -2.458 . . . . 10.0 104.362 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -93.39 132.4 37.67 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 117.554 -1.658 . . . . 10.0 114.447 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -80.92 -54.98 5.1 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 113.731 -1.577 . . . . 10.0 110.07 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 33.9 m -156.47 130.79 8.68 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 115.598 1.703 . . . . 10.0 115.598 -179.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 5.1 p30 -116.18 171.36 7.86 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 112.534 -2.121 . . . . 10.0 105.521 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -136.57 -56.51 0.74 Allowed 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 116.703 2.112 . . . . 10.0 116.703 -179.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -92.96 51.05 1.62 Allowed 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 114.029 1.122 . . . . 10.0 114.029 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 27.9 t80 -71.72 -49.58 38.05 Favored 'General case' 0 C--O 1.243 0.761 0 CA-C-O 117.219 -1.372 . . . . 10.0 112.861 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.407 ' OE2' ' ND2' ' A' ' 34' ' ' ASN . 1.7 mp0 -72.66 -39.09 67.39 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 114.362 1.245 . . . . 10.0 114.362 -179.766 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.94 -24.7 63.39 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 121.831 0.824 . . . . 10.0 110.871 -179.816 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -74.63 -42.8 57.92 Favored 'General case' 0 C--N 1.319 -0.756 0 O-C-N 120.292 -1.505 . . . . 10.0 107.803 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 45.7 mt -75.92 -20.13 58.23 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-O 123.408 1.575 . . . . 10.0 109.64 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -79.7 -29.1 40.61 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 107.577 -1.268 . . . . 10.0 107.577 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.468 ' HB1' ' HB3' ' A' ' 122' ' ' GLU . . . -68.82 -23.23 64.24 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 120.427 -1.421 . . . . 10.0 111.977 -179.61 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 85.2 mt -102.42 -21.92 14.17 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 118.247 -0.882 . . . . 10.0 111.394 179.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 50.0 m-20 70.86 63.85 0.18 Allowed 'General case' 0 C--O 1.247 0.935 0 O-C-N 126.965 2.666 . . . . 10.0 114.561 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -93.1 167.22 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 106.203 -1.777 . . . . 10.0 106.203 179.811 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 43.9 t30 -43.67 159.02 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 117.154 2.279 . . . . 10.0 117.154 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.4 t -77.19 -40.92 30.33 Favored 'Isoleucine or valine' 0 C--O 1.232 0.158 0 CA-C-N 113.057 -1.883 . . . . 10.0 112.791 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.75 -33.9 71.29 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.212 -0.904 . . . . 10.0 111.798 -179.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.625 HD23 ' O ' ' A' ' 29' ' ' LEU . 10.5 tt -72.31 -26.94 62.15 Favored 'General case' 0 C--O 1.218 -0.585 0 CA-C-N 115.662 -0.699 . . . . 10.0 111.969 -179.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.1 -31.35 62.76 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 125.024 1.33 . . . . 10.0 110.535 179.703 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 30.4 tttp -78.24 -41.28 34.7 Favored 'General case' 0 N--CA 1.447 -0.606 0 O-C-N 123.735 0.647 . . . . 10.0 112.736 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 40.2 mt -75.46 -44.48 41.43 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.321 0 O-C-N 124.048 0.843 . . . . 10.0 111.623 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.421 ' HA ' HD11 ' A' ' 36' ' ' LEU . . . -63.12 -22.57 66.95 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.267 -0.879 . . . . 10.0 113.034 -179.733 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.407 ' ND2' ' OE2' ' A' ' 17' ' ' GLU . 49.4 t30 -81.25 -5.35 57.68 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 113.934 1.087 . . . . 10.0 113.934 179.761 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.5 13.05 36.16 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-O 116.711 -1.614 . . . . 10.0 112.859 -179.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.421 HD11 ' HA ' ' A' ' 33' ' ' ALA . 0.0 OUTLIER -137.14 172.98 12.2 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 119.557 1.071 . . . . 10.0 110.184 179.791 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -127.94 102.29 22.15 Favored Pre-proline 0 C--O 1.24 0.601 0 N-CA-C 104.853 -2.277 . . . . 10.0 104.853 -179.593 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -57.56 87.57 0.05 OUTLIER 'Trans proline' 0 C--O 1.221 -0.374 0 N-CA-C 116.947 1.864 . . . . 10.0 116.947 179.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -61.55 152.57 30.0 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 122.165 0.983 . . . . 10.0 108.819 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -108.75 156.39 19.67 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.038 -1.437 . . . . 10.0 110.335 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.428 ' OE1' HG23 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -149.62 103.05 3.22 Favored 'General case' 0 N--CA 1.439 -1.007 0 N-CA-C 103.477 -2.786 . . . . 10.0 103.477 -179.866 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 5.0 mt -101.66 133.99 43.43 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 CA-C-N 115.586 -0.734 . . . . 10.0 111.885 179.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.428 HG23 ' OE1' ' A' ' 41' ' ' GLU . 47.2 t -136.66 90.62 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.883 0 N-CA-C 105.265 -2.124 . . . . 10.0 105.265 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 21.8 tt0 -90.0 126.76 35.87 Favored 'General case' 0 C--N 1.313 -0.983 0 O-C-N 125.6 1.813 . . . . 10.0 109.288 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -95.71 -22.48 17.52 Favored 'General case' 0 C--N 1.319 -0.747 0 O-C-N 120.571 -1.331 . . . . 10.0 108.829 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 140.34 -126.49 3.2 Favored Glycine 0 CA--C 1.534 1.243 0 N-CA-C 105.943 -2.863 . . . . 10.0 105.943 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -47.25 -30.75 3.23 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 119.737 1.769 . . . . 10.0 111.672 -179.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 40.7 m170 -102.37 128.46 48.94 Favored 'General case' 0 N--CA 1.444 -0.766 0 O-C-N 120.037 -1.664 . . . . 10.0 106.571 179.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 31.7 ttm -122.2 142.11 50.77 Favored 'General case' 0 N--CA 1.437 -1.102 0 O-C-N 119.698 -1.876 . . . . 10.0 112.374 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 10.1 mt -131.33 121.85 49.62 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.068 0 N-CA-C 107.383 -1.339 . . . . 10.0 107.383 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mp -116.16 125.98 73.46 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 N-CA-C 104.985 -2.228 . . . . 10.0 104.985 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.592 ' HA ' HG22 ' A' ' 61' ' ' ILE . 3.9 mtt85 -120.16 94.96 4.56 Favored 'General case' 0 C--O 1.214 -0.766 0 O-C-N 126.069 2.106 . . . . 10.0 109.074 -179.781 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.8 m -83.16 113.5 20.68 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 101.323 -3.584 . . . . 10.0 101.323 -179.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 6.6 mp -102.74 93.97 5.37 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 118.267 2.691 . . . . 10.0 118.267 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -100.21 132.0 45.83 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 104.413 -2.439 . . . . 10.0 104.413 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 8.4 p -46.88 -28.57 1.63 Allowed 'General case' 0 CA--C 1.545 0.776 0 O-C-N 125.252 1.595 . . . . 10.0 109.041 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -106.01 99.79 9.36 Favored 'General case' 0 C--O 1.245 0.817 0 C-N-CA 125.048 1.339 . . . . 10.0 110.446 -179.609 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 67.79 149.74 0.06 Allowed 'General case' 0 C--N 1.321 -0.659 0 O-C-N 126.697 2.498 . . . . 10.0 110.743 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -108.73 150.37 27.68 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 113.594 -1.639 . . . . 10.0 110.785 179.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 6.5 t80 -137.59 84.67 2.06 Favored 'General case' 0 N--CA 1.434 -1.244 0 CA-C-N 114.035 -1.438 . . . . 10.0 107.468 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.592 HG22 ' HA ' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -102.99 157.33 4.94 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-N 120.492 1.496 . . . . 10.0 112.488 179.821 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 2.4 mtp -134.82 158.97 42.83 Favored 'General case' 0 C--N 1.32 -0.686 0 O-C-N 126.378 2.299 . . . . 10.0 107.826 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -145.55 95.84 2.72 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 100.79 -3.782 . . . . 10.0 100.79 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 8.6 m-30 -116.87 163.38 16.28 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 117.026 2.232 . . . . 10.0 117.026 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 82.2 mt-30 -117.23 116.33 27.05 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 103.611 -2.737 . . . . 10.0 103.611 179.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.9 t -66.95 138.99 21.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 124.025 1.869 . . . . 10.0 109.483 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 66.06 24.39 71.73 Favored Glycine 0 C--N 1.336 0.553 0 CA-C-N 114.081 -1.418 . . . . 10.0 113.818 179.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 11.7 mttt -141.41 158.22 44.15 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 118.417 -1.313 . . . . 10.0 113.389 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -72.74 167.88 19.94 Favored 'General case' 0 C--N 1.316 -0.885 0 O-C-N 124.87 1.357 . . . . 10.0 109.145 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -157.48 -175.28 5.31 Favored 'General case' 0 C--O 1.247 0.941 0 C-N-CA 124.482 1.113 . . . . 10.0 110.547 -179.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -163.14 127.51 2.96 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 105.304 -2.11 . . . . 10.0 105.304 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -120.17 169.51 10.17 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 114.913 -1.039 . . . . 10.0 113.543 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -100.22 -15.24 18.17 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 107.258 -1.386 . . . . 10.0 107.258 179.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 3.3 pp -141.72 -174.64 4.12 Favored 'General case' 0 C--N 1.314 -0.954 0 O-C-N 125.495 1.747 . . . . 10.0 114.706 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -141.88 -76.1 0.29 Allowed 'General case' 0 C--O 1.218 -0.582 0 N-CA-C 106.899 -1.519 . . . . 10.0 106.899 179.829 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -130.78 76.33 0.41 Allowed Glycine 0 C--O 1.238 0.37 0 CA-C-O 119.702 -0.499 . . . . 10.0 112.273 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 19.5 mt 64.63 -71.22 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.714 0 CA-C-O 118.262 -0.875 . . . . 10.0 109.928 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -45.25 -29.81 1.08 Allowed 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 124.917 1.287 . . . . 10.0 110.536 -179.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.8 p30 56.25 168.77 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 129.386 3.074 . . . . 10.0 118.595 179.348 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.9 ttm-85 169.03 118.23 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 116.107 -1.902 . . . . 10.0 108.134 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 23.3 mtpt -47.52 121.19 3.76 Favored 'General case' 0 C--N 1.314 -0.973 0 O-C-N 125.336 1.648 . . . . 10.0 107.583 -179.545 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -133.93 170.61 15.36 Favored 'General case' 0 C--N 1.315 -0.901 0 O-C-N 125.933 2.021 . . . . 10.0 109.696 179.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 4.3 mtp -126.75 98.43 5.37 Favored 'General case' 0 N--CA 1.44 -0.964 1 N-CA-C 100.063 -4.051 . . . . 10.0 100.063 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 26.1 m -99.94 131.24 46.03 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 124.371 2.034 . . . . 10.0 114.762 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 1.2 m -115.88 128.93 56.18 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 112.773 -2.012 . . . . 10.0 107.032 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 2.2 t -106.2 127.32 61.51 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.929 0 N-CA-C 103.384 -2.821 . . . . 10.0 103.384 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.2 t -151.13 147.11 26.65 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 123.143 1.449 . . . . 10.0 111.547 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 2.2 p-90 -95.75 130.4 42.68 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 105.589 -2.004 . . . . 10.0 105.589 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -78.3 -51.17 10.53 Favored 'General case' 0 C--O 1.247 0.93 1 N-CA-C 99.904 -4.11 . . . . 10.0 99.904 179.888 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -157.25 -76.55 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.445 0 N-CA-C 108.192 -1.963 . . . . 10.0 108.192 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -114.48 19.05 16.45 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 115.103 1.52 . . . . 10.0 115.103 179.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 9.0 mttm -129.98 -171.96 2.66 Favored 'General case' 0 C--O 1.244 0.792 0 CA-C-O 118.24 -0.886 . . . . 10.0 108.725 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.3 tt -137.34 131.92 32.86 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 104.57 -2.382 . . . . 10.0 104.57 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -137.43 -173.62 3.53 Favored 'General case' 0 C--O 1.219 -0.508 0 N-CA-C 114.78 1.4 . . . . 10.0 114.78 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 1.1 m -156.33 137.28 13.53 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 118.817 0.735 . . . . 10.0 110.156 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 3.7 t -95.8 -52.83 8.9 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 N-CA-C 106.845 -1.539 . . . . 10.0 106.845 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 1.9 mm-40 71.44 114.37 0.05 Allowed 'General case' 0 C--O 1.244 0.809 0 C-N-CA 127.395 2.278 . . . . 10.0 109.572 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 13.4 mttt -97.21 74.58 2.54 Favored 'General case' 0 C--N 1.343 0.306 0 CA-C-O 116.756 -1.593 . . . . 10.0 112.41 -179.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -107.5 -93.22 2.29 Favored Glycine 0 N--CA 1.451 -0.305 0 O-C-N 125.473 1.733 . . . . 10.0 109.967 179.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -167.55 -39.01 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 117.553 2.427 . . . . 10.0 117.553 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.05 146.34 11.43 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 113.808 1.04 . . . . 10.0 113.808 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -78.82 83.37 4.95 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 125.08 1.352 . . . . 10.0 112.341 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 142.23 -1.75 1.71 Allowed Glycine 0 C--O 1.219 -0.802 0 O-C-N 126.516 2.385 . . . . 10.0 115.544 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 23.7 mtt180 -52.63 161.81 0.66 Allowed 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 118.572 1.186 . . . . 10.0 112.835 -179.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 107.65 152.88 17.82 Favored Glycine 0 C--O 1.224 -0.485 0 CA-C-N 112.522 -2.126 . . . . 10.0 110.562 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' TRP . . . . . 0.423 ' CD1' ' N ' ' A' ' 106' ' ' TRP . 0.0 OUTLIER -117.39 179.28 4.09 Favored 'General case' 0 C--N 1.33 -0.249 0 O-C-N 120.198 -1.766 . . . . 10.0 110.246 179.909 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -153.51 99.08 2.3 Favored 'General case' 0 CA--C 1.503 -0.839 0 O-C-N 124.748 1.28 . . . . 10.0 108.517 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 62.4 mt-30 -98.49 147.41 24.78 Favored 'General case' 0 C--O 1.239 0.52 0 O-C-N 126.564 2.415 . . . . 10.0 112.309 -179.674 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -169.41 128.76 1.01 Allowed 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 105.966 -1.864 . . . . 10.0 105.966 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 69.5 mt -88.56 160.28 2.86 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.802 0 N-CA-C 116.894 2.183 . . . . 10.0 116.894 -179.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -139.28 63.04 1.51 Allowed 'General case' 0 N--CA 1.463 0.194 0 O-C-N 126.36 2.287 . . . . 10.0 106.474 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 72.89 -98.64 0.88 Allowed Glycine 0 CA--C 1.531 1.036 0 N-CA-C 107.928 -2.069 . . . . 10.0 107.928 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -108.13 19.63 19.71 Favored 'General case' 0 C--N 1.321 -0.655 0 O-C-N 121.453 -1.028 . . . . 10.0 113.078 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -128.86 95.8 4.19 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 120.554 -1.341 . . . . 10.0 111.071 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.657 HD12 ' CE3' ' A' ' 8' ' ' TRP . 0.2 OUTLIER -64.89 120.1 11.91 Favored 'General case' 0 C--N 1.319 -0.738 0 O-C-N 121.123 -0.985 . . . . 10.0 109.677 -179.838 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 5.0 t60 -109.97 103.28 12.01 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 107.083 -1.451 . . . . 10.0 107.083 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.529 ' O ' HD23 ' A' ' 117' ' ' LEU . 0.2 OUTLIER -110.09 115.94 30.66 Favored 'General case' 0 C--N 1.321 -0.653 0 O-C-N 125.237 1.586 . . . . 10.0 109.11 -179.853 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -108.83 90.99 3.46 Favored 'General case' 0 CA--C 1.507 -0.711 0 N-CA-C 105.408 -2.071 . . . . 10.0 105.408 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -78.01 154.93 31.03 Favored 'General case' 0 N--CA 1.443 -0.823 0 C-N-CA 126.336 1.854 . . . . 10.0 111.15 179.776 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -136.98 137.62 39.68 Favored 'General case' 0 C--N 1.319 -0.734 0 O-C-N 126.027 2.079 . . . . 10.0 113.809 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . 0.722 ' O ' HG22 ' A' ' 124' ' ' VAL . . . -160.91 129.97 4.72 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 116.362 -1.78 . . . . 10.0 109.291 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . 0.468 ' HB3' ' HB1' ' A' ' 22' ' ' ALA . 3.5 tt0 40.23 49.42 2.46 Favored 'General case' 0 C--O 1.241 0.647 0 N-CA-C 115.639 1.718 . . . . 10.0 115.639 -179.747 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 70.49 16.87 74.1 Favored Glycine 0 CA--C 1.538 1.512 0 CA-C-O 115.945 -2.586 . . . . 10.0 115.847 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.722 HG22 ' O ' ' A' ' 121' ' ' ALA . 4.0 m -108.1 169.45 3.04 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 O-C-N 125.723 1.484 . . . . 10.0 108.698 179.758 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 2.7 m -136.39 91.08 2.63 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.98 -0.554 . . . . 10.0 111.573 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 26.2 t -95.23 99.62 11.55 Favored 'General case' 0 C--O 1.216 -0.66 0 N-CA-C 105.691 -1.966 . . . . 10.0 105.691 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.33 151.01 22.4 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 114.055 -1.429 . . . . 10.0 109.564 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 14.1 mt-30 -144.4 125.5 14.53 Favored 'General case' 0 C--N 1.315 -0.911 0 O-C-N 126.136 2.147 . . . . 10.0 113.462 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 19.4 t -91.03 114.4 28.31 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 107.077 -1.453 . . . . 10.0 107.077 -179.663 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -101.99 177.21 4.96 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.661 -0.866 . . . . 10.0 108.661 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -148.17 120.06 8.16 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 106.339 -1.726 . . . . 10.0 106.339 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -79.64 125.58 29.81 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 117.86 -1.536 . . . . 10.0 107.632 -179.619 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 18.3 t -82.61 -66.18 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-O 117.934 -1.031 . . . . 10.0 109.996 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.255 1.364 0 O-C-N 125.289 1.618 . . . . 10.0 109.711 179.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 . . . . . 0 C--O 1.237 0.4 0 N-CA-C 112.59 0.589 . . . . 10.0 112.59 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 68.1 -28.97 0.15 Allowed 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 117.296 2.332 . . . . 10.0 117.296 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -37.39 115.14 0.38 Allowed 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 116.499 2.037 . . . . 10.0 116.499 179.695 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -176.16 164.19 33.98 Favored Glycine 0 CA--C 1.527 0.808 0 N-CA-C 117.384 1.714 . . . . 10.0 117.384 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 16.9 m-30 -94.96 141.92 28.08 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 101.138 -3.653 . . . . 10.0 101.138 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.758 ' NE1' HD12 ' A' ' 42' ' ' ILE . 57.8 m95 -134.82 85.73 2.2 Favored 'General case' 0 C--N 1.313 -1.0 0 O-C-N 126.012 2.07 . . . . 10.0 111.591 179.726 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.06 149.39 27.82 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 104.912 -2.255 . . . . 10.0 104.912 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.455 ' HE2' ' CZ ' ' A' ' 130' ' ' PHE . 27.4 ttm -99.93 150.09 22.76 Favored 'General case' 0 N--CA 1.444 -0.748 0 N-CA-C 115.171 1.545 . . . . 10.0 115.171 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.8 mp -108.71 -64.71 1.2 Allowed 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 113.394 -1.73 . . . . 10.0 107.281 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -156.42 154.61 30.74 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 117.023 2.231 . . . . 10.0 117.023 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -113.8 165.79 12.21 Favored 'General case' 0 CA--C 1.509 -0.616 0 O-C-N 128.406 3.566 . . . . 10.0 109.154 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -142.37 138.06 30.92 Favored 'General case' 0 C--O 1.24 0.565 0 O-C-N 120.659 -1.275 . . . . 10.0 112.962 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 60.79 17.71 7.94 Favored 'General case' 0 C--O 1.247 0.959 0 CA-C-O 124.737 2.208 . . . . 10.0 115.686 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -52.24 -50.48 61.94 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 116.607 -3.808 . . . . 10.0 115.966 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 59.7 mt-10 -63.33 -30.43 71.57 Favored 'General case' 0 C--O 1.219 -0.535 0 N-CA-C 114.748 1.388 . . . . 10.0 114.748 179.496 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -79.87 -28.99 39.92 Favored 'General case' 0 C--N 1.328 -0.361 0 O-C-N 127.022 2.701 . . . . 10.0 109.989 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -65.5 -53.26 44.95 Favored 'General case' 0 C--N 1.317 -0.823 0 O-C-N 124.209 0.943 . . . . 10.0 111.369 179.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.55 ' HB3' HG22 ' A' ' 25' ' ' VAL . 12.8 mt -65.45 -21.7 66.68 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 114.091 1.145 . . . . 10.0 114.091 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -71.18 -31.41 67.62 Favored 'General case' 0 C--N 1.317 -0.81 0 C-N-CA 124.316 1.046 . . . . 10.0 110.534 -179.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.68 -48.64 79.89 Favored 'General case' 0 CA--C 1.531 0.24 0 O-C-N 125.204 1.565 . . . . 10.0 113.396 179.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -90.76 -12.3 36.96 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.406 -1.27 . . . . 10.0 109.167 179.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.2 t0 55.83 57.82 4.91 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 114.512 -1.222 . . . . 10.0 113.529 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.55 HG22 ' HB3' ' A' ' 20' ' ' LEU . 14.5 m -73.37 -164.8 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-N 114.703 -1.135 . . . . 10.0 109.123 -179.837 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -64.17 140.83 58.91 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 116.232 1.938 . . . . 10.0 116.232 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.408 ' H ' HG12 ' A' ' 27' ' ' VAL . 1.4 p -60.15 -39.14 79.67 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.945 0 C-N-CA 126.188 1.795 . . . . 10.0 115.775 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.63 -21.16 64.49 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 114.16 -1.382 . . . . 10.0 111.043 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.41 -43.18 23.87 Favored 'General case' 0 C--O 1.218 -0.603 0 O-C-N 124.773 1.296 . . . . 10.0 110.719 -179.762 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.5 ttm180 -59.58 -34.12 72.31 Favored 'General case' 0 C--O 1.243 0.763 0 C-N-CA 125.709 1.604 . . . . 10.0 114.291 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.0 ttpt -75.89 -46.73 28.6 Favored 'General case' 0 N--CA 1.438 -1.032 0 O-C-N 125.715 1.885 . . . . 10.0 112.659 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 7.8 mm -76.19 -39.36 35.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 O-C-N 121.427 -0.796 . . . . 10.0 111.451 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.468 ' HA ' ' HB3' ' A' ' 36' ' ' LEU . . . -63.64 -24.23 67.71 Favored 'General case' 0 C--O 1.215 -0.752 0 N-CA-C 115.732 1.752 . . . . 10.0 115.732 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -65.32 -56.54 12.06 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 119.522 -0.871 . . . . 10.0 109.903 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.534 ' C ' HD12 ' A' ' 35' ' ' LEU . 4.5 pp -79.89 0.87 29.38 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 113.031 0.752 . . . . 10.0 113.031 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.468 ' HB3' ' HA ' ' A' ' 33' ' ' ALA . 12.3 tp -105.68 125.1 50.6 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 124.451 1.094 . . . . 10.0 108.728 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.56 103.06 53.08 Favored Pre-proline 0 C--N 1.316 -0.862 0 CA-C-N 120.463 1.483 . . . . 10.0 109.582 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -70.59 112.41 3.22 Favored 'Trans proline' 0 C--N 1.354 0.826 0 CA-C-O 123.906 1.544 . . . . 10.0 114.516 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -71.5 169.61 15.07 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 114.407 -1.27 . . . . 10.0 109.443 -179.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.6 mtmt -136.58 153.21 51.03 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-O 122.575 1.178 . . . . 10.0 112.527 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -142.1 115.35 8.89 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 103.003 -2.962 . . . . 10.0 103.003 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.758 HD12 ' NE1' ' A' ' 8' ' ' TRP . 61.7 mt -100.49 147.65 7.58 Favored 'Isoleucine or valine' 0 C--O 1.247 0.925 0 N-CA-C 108.757 -0.831 . . . . 10.0 108.757 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.5 t -147.96 130.32 7.05 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.836 0 N-CA-C 105.727 -1.953 . . . . 10.0 105.727 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -132.56 151.98 51.75 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 122.68 1.229 . . . . 10.0 109.667 -179.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -149.82 100.47 2.96 Favored 'General case' 0 N--CA 1.444 -0.763 0 N-CA-C 106.876 -1.528 . . . . 10.0 106.876 179.841 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.17 -115.49 4.04 Favored Glycine 0 C--N 1.345 1.045 0 N-CA-C 109.056 -1.618 . . . . 10.0 109.056 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -119.12 18.46 13.09 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 108.62 -0.882 . . . . 10.0 108.62 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 7.6 t-160 -107.85 122.24 46.39 Favored 'General case' 0 CA--C 1.508 -0.671 0 N-CA-C 106.601 -1.629 . . . . 10.0 106.601 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 4.1 ttt -109.68 134.43 51.98 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 114.333 1.234 . . . . 10.0 114.333 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 7.1 mt -118.63 98.79 6.85 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.994 0 N-CA-C 107.751 -1.204 . . . . 10.0 107.751 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.418 ' N ' HD12 ' A' ' 51' ' ' ILE . 2.0 mp -89.0 131.37 36.5 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.969 0 N-CA-C 105.527 -2.027 . . . . 10.0 105.527 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 22.0 mtm180 -129.31 133.96 47.7 Favored 'General case' 0 C--O 1.215 -0.745 0 N-CA-C 113.506 0.928 . . . . 10.0 113.506 -179.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 54.1 m -114.13 99.37 7.58 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 101.048 -3.686 . . . . 10.0 101.048 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 8.4 mt -99.41 133.22 44.04 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 120.194 3.405 . . . . 10.0 120.194 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -158.33 155.26 28.46 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 126.679 1.992 . . . . 10.0 105.683 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 7.0 t -87.05 -1.96 58.27 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 105.753 -1.943 . . . . 10.0 105.753 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -124.49 102.41 7.63 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 105.27 -2.122 . . . . 10.0 105.27 179.761 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 63.85 129.83 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 125.434 2.54 . . . . 10.0 110.825 179.799 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -150.28 157.24 42.86 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-O 125.15 2.405 . . . . 10.0 110.376 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 32.3 p90 -152.25 139.74 19.62 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 104.743 -2.317 . . . . 10.0 104.743 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.534 ' N ' HD12 ' A' ' 61' ' ' ILE . 2.0 mp -130.87 139.64 50.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 O-C-N 125.299 1.625 . . . . 10.0 111.443 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 5.0 ptp -115.89 179.78 3.88 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 127.322 2.249 . . . . 10.0 104.975 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -157.08 102.93 1.99 Allowed 'General case' 0 N--CA 1.441 -0.876 0 N-CA-C 102.575 -3.12 . . . . 10.0 102.575 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -114.47 160.67 18.94 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 117.696 2.48 . . . . 10.0 117.696 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 5.6 mm-40 -116.31 152.01 34.71 Favored 'General case' 0 C--O 1.216 -0.706 0 N-CA-C 107.734 -1.21 . . . . 10.0 107.734 179.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 14.7 t -95.19 115.9 35.25 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 CA-C-O 123.492 1.615 . . . . 10.0 111.062 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 79.41 23.94 61.91 Favored Glycine 0 C--O 1.224 -0.481 0 CA-C-N 113.943 -1.481 . . . . 10.0 113.729 179.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.86 145.08 51.33 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 123.346 0.658 . . . . 10.0 111.145 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 66.5 tt0 -68.95 165.17 20.58 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 107.56 -1.274 . . . . 10.0 107.56 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -160.26 131.44 5.76 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 122.741 1.258 . . . . 10.0 112.465 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -96.24 67.52 2.56 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.514 -1.221 . . . . 10.0 109.916 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 57.1 tt0 -58.79 125.11 22.13 Favored 'General case' 0 N--CA 1.442 -0.865 0 O-C-N 126.798 2.561 . . . . 10.0 115.985 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -111.61 105.11 13.56 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-O 122.853 1.311 . . . . 10.0 108.337 179.729 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 20.9 mt -80.53 137.39 36.42 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 114.752 -1.113 . . . . 10.0 113.587 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 53.8 p -120.2 105.38 10.91 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 106.155 -1.794 . . . . 10.0 106.155 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 98.79 -169.39 23.17 Favored Glycine 0 C--O 1.243 0.69 0 CA-C-O 117.171 -1.905 . . . . 10.0 108.98 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.404 HG23 ' O ' ' A' ' 77' ' ' ILE . 0.1 OUTLIER 39.64 54.11 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 O-C-N 126.739 2.082 . . . . 10.0 110.474 179.83 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 5.0 t70 86.97 -26.85 0.08 Allowed 'General case' 0 C--O 1.239 0.526 0 O-C-N 126.126 2.141 . . . . 10.0 112.426 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 47.07 100.24 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 123.947 1.832 . . . . 10.0 115.931 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.89 93.73 1.98 Allowed 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 114.222 -1.354 . . . . 10.0 110.187 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 5.4 pttt -58.44 141.02 52.84 Favored 'General case' 0 N--CA 1.444 -0.743 0 N-CA-C 104.51 -2.404 . . . . 10.0 104.51 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -134.64 -177.3 4.55 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 113.715 -1.584 . . . . 10.0 110.002 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 25.6 mtm -119.85 66.15 0.81 Allowed 'General case' 0 CA--C 1.503 -0.844 0 N-CA-C 102.564 -3.125 . . . . 10.0 102.564 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 96.7 m -72.17 139.12 48.09 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 117.623 2.453 . . . . 10.0 117.623 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -120.63 116.64 25.73 Favored 'General case' 0 C--N 1.319 -0.752 0 O-C-N 126.955 2.659 . . . . 10.0 105.566 179.782 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 1.4 t -107.36 146.89 13.01 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 O-C-N 126.961 2.663 . . . . 10.0 104.407 179.647 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.9 t -148.78 -173.83 4.46 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 123.65 0.78 . . . . 10.0 109.091 -179.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 1.1 p-90 -151.65 122.71 7.64 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 106.834 -1.543 . . . . 10.0 106.834 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -112.24 56.67 0.66 Allowed 'General case' 0 CA--C 1.5 -0.976 0 N-CA-C 101.648 -3.464 . . . . 10.0 101.648 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 117.43 -154.0 16.94 Favored Glycine 0 C--N 1.338 0.659 0 N-CA-C 104.92 -3.272 . . . . 10.0 104.92 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 12.0 t0 -82.85 58.63 4.42 Favored 'General case' 0 C--O 1.219 -0.528 0 O-C-N 120.024 -1.868 . . . . 10.0 112.027 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.5 mtmt -136.03 -172.11 3.04 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 122.644 1.211 . . . . 10.0 108.249 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 1.5 tp -152.64 98.29 2.34 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 108.385 -0.968 . . . . 10.0 108.385 -179.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.31 138.31 40.25 Favored 'General case' 0 C--O 1.216 -0.688 0 CA-C-O 121.863 0.84 . . . . 10.0 110.023 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 7.7 m -128.81 143.99 51.05 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 123.784 0.834 . . . . 10.0 111.7 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 23.8 t -137.46 110.48 7.75 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 N-CA-C 105.157 -2.164 . . . . 10.0 105.157 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 -101.65 127.29 48.45 Favored 'General case' 0 C--O 1.244 0.79 0 C-N-CA 123.219 0.608 . . . . 10.0 110.041 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 1.3 pttt -114.62 88.39 2.85 Favored 'General case' 0 C--O 1.233 0.204 0 N-CA-C 113.06 0.763 . . . . 10.0 113.06 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -115.17 -91.49 1.77 Allowed Glycine 0 N--CA 1.437 -1.252 0 N-CA-C 110.361 -1.096 . . . . 10.0 110.361 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -134.83 -8.15 2.4 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 116.966 2.21 . . . . 10.0 116.966 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.04 -177.53 4.52 Favored 'General case' 0 C--N 1.326 -0.423 0 O-C-N 126.682 2.489 . . . . 10.0 113.856 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -123.04 30.64 6.29 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 126.962 2.105 . . . . 10.0 112.869 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -161.93 -19.32 0.03 OUTLIER Glycine 0 N--CA 1.467 0.758 0 N-CA-C 119.855 2.702 . . . . 10.0 119.855 -179.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 1.5 mtt180 -51.42 116.12 1.92 Allowed 'General case' 0 C--O 1.223 -0.339 0 CA-C-O 124.133 1.921 . . . . 10.0 110.989 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 165.11 150.39 6.18 Favored Glycine 0 CA--C 1.518 0.26 0 N-CA-C 108.963 -1.655 . . . . 10.0 108.963 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -135.27 -173.05 3.22 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-N 114.181 -1.01 . . . . 10.0 112.227 -179.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . 0.518 ' O ' HD12 ' A' ' 117' ' ' LEU . 35.5 m -165.63 136.03 3.64 Favored 'General case' 0 N--CA 1.443 -0.782 0 C-N-CA 124.651 1.18 . . . . 10.0 108.544 -179.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -125.94 103.75 7.92 Favored 'General case' 0 C--O 1.244 0.807 0 C-N-CA 126.675 1.99 . . . . 10.0 108.944 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' TRP . . . . . 0.476 ' C ' ' CD1' ' A' ' 109' ' ' TRP . 0.0 OUTLIER -100.9 161.48 13.56 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 106.254 -1.758 . . . . 10.0 106.254 -179.805 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.421 ' N ' ' CD1' ' A' ' 109' ' ' TRP . 0.6 OUTLIER -131.28 143.03 41.87 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.028 0 N-CA-C 114.957 1.466 . . . . 10.0 114.957 179.999 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -136.59 90.14 2.53 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 112.703 -2.044 . . . . 10.0 108.993 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 47.4 -91.86 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.672 0 N-CA-C 109.278 -1.529 . . . . 10.0 109.278 179.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -96.94 -19.83 18.53 Favored 'General case' 0 C--N 1.333 -0.146 0 O-C-N 120.57 -1.547 . . . . 10.0 113.95 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -98.09 148.87 23.1 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 121.162 1.801 . . . . 10.0 113.937 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.442 ' HB3' ' HB2' ' A' ' 130' ' ' PHE . 13.7 tp -116.53 138.0 51.73 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 106.483 -1.673 . . . . 10.0 106.483 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 48.3 m80 -132.76 89.38 2.63 Favored 'General case' 0 C--N 1.315 -0.928 0 O-C-N 121.006 -1.058 . . . . 10.0 108.62 -179.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.518 HD12 ' O ' ' A' ' 107' ' ' THR . 31.6 tp -94.68 142.95 26.85 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 114.317 -1.31 . . . . 10.0 109.686 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -140.78 107.5 5.36 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 119.239 -0.984 . . . . 10.0 108.769 179.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 6.4 mtt -87.83 149.3 24.22 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 109.446 -0.575 . . . . 10.0 109.446 179.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -133.61 142.93 48.33 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 118.814 0.734 . . . . 10.0 109.481 179.616 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -154.27 134.5 13.28 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 108.828 -0.805 . . . . 10.0 108.828 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 36.0 44.14 0.24 Allowed 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 116.298 1.962 . . . . 10.0 116.298 -179.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 91.46 2.35 70.46 Favored Glycine 0 N--CA 1.468 0.807 0 CA-C-O 118.15 -1.361 . . . . 10.0 115.878 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -109.9 162.56 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 CA-C-N 120.398 2.099 . . . . 10.0 109.667 179.873 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 20.9 m -135.92 101.68 4.81 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 114.966 1.469 . . . . 10.0 114.966 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -86.09 143.78 27.88 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 107.538 -1.282 . . . . 10.0 107.538 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 2.1 mttt -140.17 118.8 12.32 Favored 'General case' 0 C--N 1.322 -0.612 0 O-C-N 124.081 0.863 . . . . 10.0 111.539 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -111.02 130.01 55.72 Favored 'General case' 0 C--O 1.244 0.811 0 O-C-N 125.068 1.48 . . . . 10.0 113.106 -179.491 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 4.8 t -97.58 127.12 50.22 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-O 122.302 1.048 . . . . 10.0 111.516 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . 0.455 ' CZ ' ' HE2' ' A' ' 10' ' ' MET . 0.0 OUTLIER -121.39 155.7 34.24 Favored 'General case' 0 N--CA 1.443 -0.793 0 C-N-CA 126.156 1.782 . . . . 10.0 110.646 179.952 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 4.9 tptt -125.59 120.45 30.85 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 105.128 -2.175 . . . . 10.0 105.128 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.81 116.14 8.15 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 120.928 1.694 . . . . 10.0 111.182 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 27.6 m -122.98 52.29 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 113.772 1.027 . . . . 10.0 113.772 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 . . . . . 0 C--O 1.242 0.7 0 CA-C-N 114.639 -1.164 . . . . 10.0 113.701 -180.0 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 . . . . . 0 C--O 1.226 -0.14 0 CA-C-O 120.993 0.425 . . . . 10.0 110.394 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.524 ' CZ ' HD13 ' A' ' 93' ' ' LEU . 2.9 m-85 -128.74 -39.3 1.63 Allowed 'General case' 0 C--O 1.241 0.629 0 N-CA-C 117.531 2.419 . . . . 10.0 117.531 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -50.24 137.91 17.32 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 115.665 1.728 . . . . 10.0 115.665 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -167.04 -97.33 0.11 Allowed Glycine 0 C--N 1.341 0.827 0 CA-C-O 125.011 2.451 . . . . 10.0 112.903 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.492 ' CB ' ' CG1' ' A' ' 133' ' ' VAL . 0.1 OUTLIER 178.4 178.28 0.4 Allowed 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 104.626 -2.361 . . . . 10.0 104.626 -179.833 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.566 ' CD2' ' HB2' ' A' ' 39' ' ' ASP 0.297 36.0 p-90 -147.4 -179.6 6.97 Favored 'General case' 0 C--N 1.317 -0.809 0 O-C-N 127.403 2.939 . . . . 10.0 113.846 -178.384 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.2 ptmm? 166.42 99.8 0.0 OUTLIER 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 111.756 -2.475 . . . . 10.0 108.564 178.678 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.48 148.54 48.36 Favored 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 125.139 1.525 . . . . 10.0 114.44 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.501 HD13 ' HB2' ' A' ' 131' ' ' LYS . 0.1 OUTLIER -113.25 -10.93 13.29 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.263 -0.881 . . . . 10.0 109.572 179.973 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 42.3 t -172.06 168.19 5.89 Favored 'General case' 0 CA--C 1.515 -0.377 0 N-CA-C 115.199 1.555 . . . . 10.0 115.199 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.4 t-20 -163.76 122.97 2.02 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 105.198 -2.149 . . . . 10.0 105.198 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -125.28 178.09 5.78 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 119.734 1.152 . . . . 10.0 111.278 -179.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 37.7 m-20 34.22 33.59 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.478 0 O-C-N 127.057 2.723 . . . . 10.0 112.298 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.645 ' HE2' ' HB1' ' A' ' 33' ' ' ALA . 6.0 t80 -68.42 -42.87 78.31 Favored 'General case' 0 CA--C 1.546 0.796 0 O-C-N 120.018 -1.676 . . . . 10.0 112.939 179.607 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 74.7 mt-10 -71.22 -34.48 70.87 Favored 'General case' 0 N--CA 1.464 0.238 0 O-C-N 120.317 -1.489 . . . . 10.0 112.55 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -74.58 -34.43 62.89 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 106.968 -1.493 . . . . 10.0 106.968 179.524 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -69.63 -27.9 65.46 Favored 'General case' 0 C--O 1.245 0.832 0 O-C-N 126.04 2.088 . . . . 10.0 109.079 179.587 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 44.5 mt -79.0 -25.59 43.33 Favored 'General case' 0 C--O 1.22 -0.479 0 N-CA-C 112.652 0.612 . . . . 10.0 112.652 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 17.3 tpt180 -79.11 -20.37 48.82 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 113.629 -1.623 . . . . 10.0 109.437 179.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.68 -44.42 96.3 Favored 'General case' 0 C--O 1.213 -0.847 0 C-N-CA 126.383 1.873 . . . . 10.0 113.228 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -84.88 -21.56 29.69 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 123.714 1.721 . . . . 10.0 109.712 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.9 t0 74.45 67.73 0.09 Allowed 'General case' 0 N--CA 1.48 1.027 0 CA-C-N 113.404 -1.725 . . . . 10.0 113.519 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 5.8 m -98.44 -176.89 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.469 0 N-CA-C 105.316 -2.105 . . . . 10.0 105.316 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.43 133.54 55.17 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-O 123.617 1.675 . . . . 10.0 113.411 -179.771 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 4.2 m -63.69 -31.77 54.34 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 N-CA-C 116.409 2.003 . . . . 10.0 116.409 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -74.14 -30.22 62.18 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-O 123.593 1.663 . . . . 10.0 108.829 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 60.8 tp -73.63 -22.06 60.11 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 113.325 -1.761 . . . . 10.0 112.686 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.5 ttp-105 -71.97 -31.02 65.87 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 114.931 -1.031 . . . . 10.0 111.917 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 14.8 tttm -74.2 -39.13 63.36 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-O 122.943 1.354 . . . . 10.0 113.872 -179.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.615 ' N ' HD13 ' A' ' 32' ' ' ILE . 1.2 mm -72.61 -33.21 44.1 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.747 0 O-C-N 119.619 -1.926 . . . . 10.0 112.074 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.645 ' HB1' ' HE2' ' A' ' 16' ' ' PHE . . . -69.77 -33.15 72.01 Favored 'General case' 0 C--O 1.217 -0.654 0 CA-C-O 118.348 -0.834 . . . . 10.0 111.659 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.405 ' C ' HD23 ' A' ' 35' ' ' LEU . 26.8 t-20 -60.21 -14.3 16.93 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 118.04 -1.464 . . . . 10.0 113.109 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.534 HD23 ' N ' ' A' ' 35' ' ' LEU . 5.9 mt -93.8 -18.6 21.87 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 118.517 -1.273 . . . . 10.0 111.86 -179.793 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -91.28 134.39 34.62 Favored 'General case' 0 N--CA 1.48 1.05 0 O-C-N 124.654 1.221 . . . . 10.0 109.033 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 16.8 mtpp -123.33 103.93 35.13 Favored Pre-proline 0 N--CA 1.475 0.783 0 N-CA-C 104.785 -2.302 . . . . 10.0 104.785 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -60.69 136.64 68.02 Favored 'Trans proline' 0 C--N 1.357 1.009 0 N-CA-C 117.796 2.191 . . . . 10.0 117.796 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.566 ' HB2' ' CD2' ' A' ' 8' ' ' TRP . 0.4 OUTLIER -100.05 174.66 6.06 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 104.876 -2.268 . . . . 10.0 104.876 179.455 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.408 ' C ' ' CD1' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -167.77 119.05 0.85 Allowed 'General case' 0 CA--C 1.497 -1.075 0 C-N-CA 116.82 -1.952 . . . . 10.0 112.681 179.839 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.413 ' HA ' ' HD1' ' A' ' 8' ' ' TRP . 9.0 tt0 -103.71 137.6 41.51 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 107.084 -1.45 . . . . 10.0 107.084 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 16.0 mt -112.64 153.23 14.28 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-O 117.427 -1.273 . . . . 10.0 107.709 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -147.75 126.32 3.79 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.734 0 N-CA-C 105.523 -2.029 . . . . 10.0 105.523 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 6.5 mm100 -131.86 113.44 13.47 Favored 'General case' 0 C--N 1.314 -0.977 0 O-C-N 125.605 1.816 . . . . 10.0 110.404 179.667 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -104.66 -11.77 16.73 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 105.089 -2.189 . . . . 10.0 105.089 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 166.47 -123.89 1.18 Allowed Glycine 0 CA--C 1.511 -0.171 0 N-CA-C 108.958 -1.657 . . . . 10.0 108.958 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -84.37 -8.13 59.08 Favored 'General case' 0 C--O 1.216 -0.701 0 CA-C-N 121.242 2.521 . . . . 10.0 108.308 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -96.02 118.03 31.82 Favored 'General case' 0 C--O 1.219 -0.524 0 N-CA-C 105.907 -1.886 . . . . 10.0 105.907 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 17.9 ttp -115.46 127.29 55.22 Favored 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 115.216 1.561 . . . . 10.0 115.216 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 15.0 mt -113.5 145.37 19.48 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.057 0 N-CA-C 105.175 -2.157 . . . . 10.0 105.175 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.6 mt -136.75 114.15 13.66 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-O 122.956 1.36 . . . . 10.0 107.807 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -95.92 84.32 3.84 Favored 'General case' 0 CA--C 1.503 -0.83 0 CA-C-N 112.911 -1.95 . . . . 10.0 111.555 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.415 ' HB ' ' HB3' ' A' ' 60' ' ' TYR . 98.5 m -89.35 115.91 27.16 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 100.203 -3.999 . . . . 10.0 100.203 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 43.9 mt -117.47 73.79 0.9 Allowed 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 119.174 3.028 . . . . 10.0 119.174 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 4.3 m -69.01 101.09 1.32 Allowed 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 102.572 -3.122 . . . . 10.0 102.572 179.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.8 t -60.16 96.35 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 119.991 1.269 . . . . 10.0 108.466 -179.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER 160.08 -42.6 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 126.713 2.005 . . . . 10.0 106.247 -179.865 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -144.11 105.16 4.21 Favored 'General case' 0 CA--C 1.511 -0.55 0 O-C-N 126.117 2.135 . . . . 10.0 112.517 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.92 125.38 23.78 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 120.079 -1.638 . . . . 10.0 108.637 179.848 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.415 ' HB3' ' HB ' ' A' ' 53' ' ' THR . 0.3 OUTLIER -109.01 125.92 52.57 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 102.403 -3.184 . . . . 10.0 102.403 -179.817 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 5.1 mt -132.81 129.55 58.25 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.722 0 N-CA-C 112.931 0.715 . . . . 10.0 112.931 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -134.0 164.32 27.58 Favored 'General case' 0 C--O 1.216 -0.7 0 N-CA-C 108.033 -1.099 . . . . 10.0 108.033 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -157.61 77.21 0.83 Allowed 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 101.041 -3.689 . . . . 10.0 101.041 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 1.8 m-30 -91.59 -178.07 4.97 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 117.212 2.301 . . . . 10.0 117.212 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -132.69 145.04 50.72 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 107.099 -1.445 . . . . 10.0 107.099 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 95.3 t -81.74 85.41 1.63 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.207 0 O-C-N 124.669 1.231 . . . . 10.0 113.335 -179.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 110.16 55.21 0.54 Allowed Glycine 0 C--O 1.221 -0.676 0 C-N-CA 120.547 -0.835 . . . . 10.0 113.367 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 34.4 ttmt -157.93 138.46 12.85 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-N 118.663 1.231 . . . . 10.0 112.6 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -78.2 123.15 26.58 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-O 123.197 1.475 . . . . 10.0 110.142 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -106.54 178.04 4.68 Favored 'General case' 0 C--O 1.244 0.79 0 CA-C-N 112.737 -2.028 . . . . 10.0 108.444 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -145.84 81.82 1.61 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 113.265 -1.789 . . . . 10.0 109.439 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -75.31 139.99 42.82 Favored 'General case' 0 C--O 1.219 -0.545 0 O-C-N 124.768 1.293 . . . . 10.0 112.068 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -112.32 70.88 0.72 Allowed 'General case' 0 N--CA 1.456 -0.154 0 CA-C-O 124.082 1.896 . . . . 10.0 106.007 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.434 HD22 ' HA ' ' A' ' 74' ' ' LEU . 0.2 OUTLIER -65.63 129.96 41.61 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 123.789 1.757 . . . . 10.0 111.625 179.778 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -135.19 65.75 1.55 Allowed 'General case' 0 CA--C 1.51 -0.589 0 N-CA-C 105.806 -1.924 . . . . 10.0 105.806 179.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -159.5 -178.89 33.91 Favored Glycine 0 N--CA 1.438 -1.207 0 CA-C-O 117.334 -1.814 . . . . 10.0 109.705 -179.621 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.631 HD13 ' N ' ' A' ' 77' ' ' ILE . 0.0 OUTLIER 37.7 -93.99 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.51 -0.589 0 O-C-N 127.179 2.34 . . . . 10.0 110.035 -179.848 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -87.94 -31.19 19.55 Favored 'General case' 0 CA--C 1.51 -0.578 0 N-CA-C 114.963 1.468 . . . . 10.0 114.963 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.4 t0 77.91 116.25 0.06 Allowed 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 127.451 2.3 . . . . 10.0 113.587 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 3.6 mtt180 169.15 161.96 0.05 Allowed 'General case' 0 C--N 1.315 -0.899 0 O-C-N 120.676 -1.265 . . . . 10.0 109.152 -179.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.04 165.78 11.22 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 108.802 -0.814 . . . . 10.0 108.802 -179.732 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -135.13 -174.8 3.71 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 122.522 1.153 . . . . 10.0 110.179 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -145.86 44.49 1.27 Allowed 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 101.44 -3.541 . . . . 10.0 101.44 179.868 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.41 ' HA ' ' HA ' ' A' ' 97' ' ' GLN . 0.9 OUTLIER -42.14 150.13 0.13 Allowed 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 118.931 2.937 . . . . 10.0 118.931 179.869 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 87.6 m -139.16 104.36 4.99 Favored 'General case' 0 CA--C 1.506 -0.746 0 N-CA-C 104.785 -2.302 . . . . 10.0 104.785 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -91.53 107.02 18.26 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.068 0 N-CA-C 102.795 -3.039 . . . . 10.0 102.795 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 15.6 p -139.97 135.41 32.73 Favored 'General case' 0 C--O 1.243 0.724 0 C-N-CA 119.001 -1.08 . . . . 10.0 111.562 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -65.94 110.74 3.01 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-O 123.072 1.415 . . . . 10.0 108.21 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -84.96 -24.12 28.47 Favored 'General case' 0 C--O 1.248 1.001 0 N-CA-C 102.76 -3.052 . . . . 10.0 102.76 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 146.05 70.74 0.02 OUTLIER Glycine 0 C--N 1.317 -0.525 0 N-CA-C 103.175 -3.97 . . . . 10.0 103.175 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 86.56 -57.23 0.06 Allowed 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 124.812 1.245 . . . . 10.0 108.113 -179.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.7 ttpp -55.86 105.29 0.17 Allowed 'General case' 0 C--O 1.236 0.36 0 N-CA-C 106.112 -1.81 . . . . 10.0 106.112 -179.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.524 HD13 ' CZ ' ' A' ' 4' ' ' PHE . 4.2 tp -67.97 99.48 0.86 Allowed 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 103.935 -2.617 . . . . 10.0 103.935 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -88.44 113.62 24.22 Favored 'General case' 0 C--O 1.218 -0.598 0 N-CA-C 114.858 1.429 . . . . 10.0 114.858 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 27.1 m -104.83 98.43 8.16 Favored 'General case' 0 N--CA 1.443 -0.787 0 O-C-N 126.044 2.09 . . . . 10.0 110.068 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -108.24 116.89 52.6 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 N-CA-C 105.061 -2.2 . . . . 10.0 105.061 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.41 ' HA ' ' HA ' ' A' ' 84' ' ' THR . 1.4 pt20 -110.45 118.4 36.16 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 126.727 2.517 . . . . 10.0 112.942 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 12.0 mtmt -74.61 119.53 18.92 Favored 'General case' 0 C--O 1.215 -0.754 0 O-C-N 124.276 0.985 . . . . 10.0 112.431 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -173.99 -160.69 22.72 Favored Glycine 0 C--N 1.338 0.669 0 N-CA-C 109.683 -1.367 . . . . 10.0 109.683 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -82.54 -172.15 3.88 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-O 116.204 -1.855 . . . . 10.0 111.568 179.86 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 81.05 -157.07 0.02 OUTLIER 'General case' 0 C--N 1.317 -0.84 0 O-C-N 127.087 2.742 . . . . 10.0 111.319 -179.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -136.29 -41.34 0.64 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.983 0.897 . . . . 10.0 113.087 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -97.61 1.39 60.02 Favored Glycine 0 CA--C 1.526 0.78 0 CA-C-O 116.108 -2.496 . . . . 10.0 117.041 -179.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 1.8 mtt180 -53.16 129.69 32.01 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 123.289 1.518 . . . . 10.0 109.692 -179.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 134.88 133.29 3.26 Favored Glycine 0 C--O 1.219 -0.829 0 CA-C-N 113.493 -1.685 . . . . 10.0 109.558 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -110.75 -169.47 1.46 Allowed 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 108.812 -0.81 . . . . 10.0 108.812 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -162.03 132.94 5.06 Favored 'General case' 0 C--O 1.211 -0.933 0 O-C-N 125.684 1.865 . . . . 10.0 108.713 -179.753 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -115.74 95.3 5.06 Favored 'General case' 0 C--N 1.316 -0.877 0 O-C-N 125.69 1.869 . . . . 10.0 109.846 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' TRP . . . . . 0.461 ' CD1' ' C ' ' A' ' 109' ' ' TRP . 1.3 t90 -109.73 114.18 27.56 Favored 'General case' 0 C--O 1.221 -0.414 0 CA-C-N 114.592 -1.185 . . . . 10.0 108.859 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.623 HG23 ' O ' ' A' ' 114' ' ' GLU . 88.3 mt -91.52 140.08 16.67 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 CA-C-N 113.412 -1.722 . . . . 10.0 114.041 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -116.67 64.45 0.71 Allowed 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 104.143 -2.54 . . . . 10.0 104.143 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 66.68 -119.24 11.93 Favored Glycine 0 N--CA 1.467 0.744 0 N-CA-C 108.294 -1.923 . . . . 10.0 108.294 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -63.15 -4.37 2.36 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 121.121 -1.223 . . . . 10.0 113.247 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.623 ' O ' HG23 ' A' ' 110' ' ' ILE . 10.3 mt-10 -118.14 156.66 28.32 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 119.388 0.994 . . . . 10.0 110.047 179.848 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.406 HD12 ' C ' ' A' ' 115' ' ' LEU . 0.2 OUTLIER -124.19 105.86 9.85 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 105.299 -2.111 . . . . 10.0 105.299 179.755 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 18.8 m80 -97.81 85.96 3.66 Favored 'General case' 0 CA--C 1.505 -0.788 0 O-C-N 119.55 -1.969 . . . . 10.0 109.049 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.82 115.15 24.05 Favored 'General case' 0 N--CA 1.447 -0.599 0 O-C-N 125.271 1.607 . . . . 10.0 110.869 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -117.16 90.68 3.39 Favored 'General case' 0 CA--C 1.498 -1.055 0 CA-C-O 118.47 -0.776 . . . . 10.0 111.264 -179.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 34.6 mtm -82.28 162.22 22.37 Favored 'General case' 0 CA--C 1.514 -0.414 0 C-N-CA 119.193 -1.003 . . . . 10.0 110.425 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 3.8 ttm180 -150.53 150.24 30.99 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 122.396 1.093 . . . . 10.0 112.38 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -166.62 124.75 1.39 Allowed 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 114.338 -1.301 . . . . 10.0 108.457 -179.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 53.58 34.74 19.25 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 117.952 2.575 . . . . 10.0 117.952 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 91.01 -6.97 81.69 Favored Glycine 0 C--N 1.336 0.546 0 N-CA-C 117.551 1.78 . . . . 10.0 117.551 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 15.1 t -108.72 117.97 55.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 CA-C-N 118.213 1.007 . . . . 10.0 112.469 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 22.7 m -92.37 119.28 31.76 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 126.009 2.068 . . . . 10.0 112.352 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -107.96 139.29 42.8 Favored 'General case' 0 C--N 1.322 -0.595 0 O-C-N 127.513 3.008 . . . . 10.0 106.175 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.42 149.58 34.98 Favored 'General case' 0 C--N 1.319 -0.745 0 C-N-CA 118.759 -1.176 . . . . 10.0 112.926 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -132.96 117.7 17.97 Favored 'General case' 0 C--N 1.318 -0.78 0 O-C-N 127.877 3.236 . . . . 10.0 109.509 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 38.9 t -78.39 87.42 1.1 Allowed 'Isoleucine or valine' 0 C--O 1.217 -0.636 0 C-N-CA 118.549 -1.26 . . . . 10.0 110.227 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -73.42 167.68 20.78 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 108.451 -0.944 . . . . 10.0 108.451 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.501 ' HB2' HD13 ' A' ' 11' ' ' LEU . 1.0 OUTLIER -139.04 88.25 2.27 Favored 'General case' 0 C--O 1.241 0.616 0 N-CA-C 106.343 -1.725 . . . . 10.0 106.343 -179.962 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 9.2 ttpt -61.67 98.82 0.1 Allowed 'General case' 0 C--N 1.32 -0.702 0 O-C-N 121.95 -0.469 . . . . 10.0 110.017 179.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' VAL . . . . . 0.492 ' CG1' ' CB ' ' A' ' 7' ' ' TYR . 9.5 p -43.96 -31.18 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 C-N-CA 124.76 1.224 . . . . 10.0 111.275 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 54.7 t-80 . . . . . 0 C--O 1.245 0.826 0 O-C-N 126.189 2.181 . . . . 10.0 110.981 -179.72 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 . . . . . 0 C--O 1.24 0.601 0 N-CA-C 110.715 -0.106 . . . . 10.0 110.715 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.42 ' HB3' HG21 ' A' ' 42' ' ' ILE . 8.1 m-85 -74.08 -15.9 61.04 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 123.989 0.806 . . . . 10.0 112.652 179.747 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -58.01 115.38 2.84 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 122.493 1.14 . . . . 10.0 112.766 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -162.3 -101.33 0.16 Allowed Glycine 0 C--N 1.344 0.986 0 N-CA-C 118.87 2.308 . . . . 10.0 118.87 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.414 ' HA ' ' CE3' ' A' ' 8' ' ' TRP . 6.4 m-85 -167.9 163.28 13.85 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 102.535 -3.135 . . . . 10.0 102.535 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.566 ' CZ3' ' CG ' ' A' ' 41' ' ' GLU 0.285 29.6 p90 -144.41 -176.39 5.02 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 125.683 1.593 . . . . 10.0 113.51 -179.492 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 164.41 93.52 0.0 OUTLIER 'General case' 0 C--O 1.232 0.173 0 CA-C-N 111.984 -2.371 . . . . 10.0 107.999 179.3 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.402 ' HG3' ' HB3' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -41.68 153.36 0.06 Allowed 'General case' 0 C--N 1.311 -1.083 0 N-CA-C 115.164 1.542 . . . . 10.0 115.164 179.435 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.462 HD22 ' CG1' ' A' ' 129' ' ' VAL . 0.3 OUTLIER -118.61 -49.0 2.47 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 108.065 -1.087 . . . . 10.0 108.065 -179.976 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.8 t -161.76 164.36 29.01 Favored 'General case' 0 C--O 1.242 0.68 0 N-CA-C 115.079 1.511 . . . . 10.0 115.079 179.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -129.25 151.36 50.0 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 105.121 -2.177 . . . . 10.0 105.121 179.837 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -151.47 137.53 18.26 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 116.839 2.163 . . . . 10.0 116.839 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 74.1 m-20 55.56 19.97 3.54 Favored 'General case' 0 N--CA 1.444 -0.754 0 O-C-N 125.793 1.933 . . . . 10.0 112.657 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.421 ' CZ ' ' HA ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -69.01 -20.43 64.15 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 114.551 1.315 . . . . 10.0 114.551 179.723 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -78.58 -40.14 35.5 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 119.794 -1.816 . . . . 10.0 111.576 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -75.55 -20.89 58.35 Favored 'General case' 0 CA--C 1.51 -0.581 0 N-CA-C 108.256 -1.016 . . . . 10.0 108.256 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -72.93 -34.2 66.43 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 105.964 -1.865 . . . . 10.0 105.964 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 41.5 mt -78.81 -23.31 45.2 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 120.82 1.646 . . . . 10.0 108.858 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.5 ttm-85 -69.33 -30.39 68.43 Favored 'General case' 0 N--CA 1.447 -0.617 0 O-C-N 126.127 2.142 . . . . 10.0 108.652 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.86 -38.95 83.75 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 125.152 1.381 . . . . 10.0 110.923 -179.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 33.4 mt -75.9 -28.17 57.98 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 117.51 -1.233 . . . . 10.0 109.454 179.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.4 t70 78.51 45.96 0.06 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 126.762 2.539 . . . . 10.0 113.042 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 3.2 m -85.64 -162.65 0.08 OUTLIER 'Isoleucine or valine' 0 C--O 1.243 0.748 0 N-CA-C 106.998 -1.482 . . . . 10.0 106.998 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -93.4 170.83 9.32 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 116.599 2.074 . . . . 10.0 116.599 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.5 m -75.89 -35.46 29.99 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 CA-C-N 112.847 -1.979 . . . . 10.0 111.733 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.05 -34.19 74.79 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 122.884 1.326 . . . . 10.0 111.293 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.734 HD13 ' O ' ' A' ' 29' ' ' LEU . 1.7 tm? -76.9 -40.85 45.95 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.492 -1.231 . . . . 10.0 111.553 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.5 ttp85 -61.38 -29.08 69.69 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 125.432 1.493 . . . . 10.0 113.948 179.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.48 -41.47 39.37 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 106.495 -1.669 . . . . 10.0 106.495 179.75 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.452 HD13 ' HA ' ' A' ' 32' ' ' ILE . 2.1 mm -62.25 -40.57 88.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 O-C-N 120.204 -1.56 . . . . 10.0 112.196 -179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -73.79 -48.25 32.9 Favored 'General case' 0 N--CA 1.476 0.83 0 O-C-N 125.245 1.591 . . . . 10.0 110.943 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.421 ' HA ' ' CZ ' ' A' ' 16' ' ' PHE . 0.0 OUTLIER -67.79 175.24 3.09 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-O 115.381 -2.247 . . . . 10.0 107.976 179.085 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.412 ' N ' ' CG ' ' A' ' 34' ' ' ASN . 0.3 OUTLIER 84.0 -43.6 0.09 Allowed 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 114.957 1.466 . . . . 10.0 114.957 179.831 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.479 HD11 ' HB3' ' A' ' 57' ' ' PHE . 51.9 mt -83.79 152.13 24.81 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 126.626 2.454 . . . . 10.0 111.182 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.402 ' HB3' ' HG3' ' A' ' 10' ' ' MET . 6.9 mttt -125.52 96.22 39.06 Favored Pre-proline 0 C--N 1.318 -0.797 0 O-C-N 127.374 2.921 . . . . 10.0 107.132 -179.737 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -63.6 -170.35 0.11 Allowed 'Trans proline' 0 C--O 1.219 -0.447 0 O-C-N 124.806 1.95 . . . . 10.0 116.261 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.551 ' HB3' ' CD1' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -141.93 171.36 14.16 Favored 'General case' 0 C--O 1.235 0.33 0 O-C-N 126.665 2.478 . . . . 10.0 108.024 179.942 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.441 ' HB2' ' CZ ' ' A' ' 130' ' ' PHE . 0.8 OUTLIER -149.21 90.93 1.78 Allowed 'General case' 0 CA--C 1.498 -1.046 0 CA-C-O 123.63 1.681 . . . . 10.0 112.398 -179.698 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.566 ' CG ' ' CZ3' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -88.98 142.72 27.4 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 103.609 -2.737 . . . . 10.0 103.609 -179.793 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.42 HG21 ' HB3' ' A' ' 4' ' ' PHE . 7.7 mm -127.31 149.97 32.8 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.736 0 CA-C-N 119.403 1.001 . . . . 10.0 108.51 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.413 HG23 ' O ' ' A' ' 42' ' ' ILE . 16.9 t -153.82 132.43 2.95 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 N-CA-C 104.963 -2.236 . . . . 10.0 104.963 179.853 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -141.7 130.03 22.37 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 124.178 1.942 . . . . 10.0 107.397 179.625 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -88.8 -9.21 52.62 Favored 'General case' 0 C--N 1.313 -0.995 0 C-N-CA 126.399 1.88 . . . . 10.0 107.98 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 145.49 -96.1 0.18 Allowed Glycine 0 N--CA 1.468 0.786 0 O-C-N 127.333 2.896 . . . . 10.0 108.888 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -90.57 -23.67 20.8 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 118.555 1.177 . . . . 10.0 110.586 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.4 t-160 -85.51 116.8 24.03 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 104.447 -2.427 . . . . 10.0 104.447 179.866 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 58.3 ttp -101.81 147.11 26.88 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 113.637 -1.62 . . . . 10.0 114.179 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 31.9 mt -137.79 115.46 12.81 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.735 0 O-C-N 119.113 -2.242 . . . . 10.0 107.852 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.6 mp -105.89 127.63 60.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 105.415 -2.068 . . . . 10.0 105.415 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 83.4 mtt180 -116.33 138.48 51.29 Favored 'General case' 0 C--O 1.212 -0.88 0 O-C-N 126.687 2.492 . . . . 10.0 111.799 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.421 ' HB ' ' O ' ' A' ' 59' ' ' ASN . 5.8 m -131.19 134.28 46.33 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 100.547 -3.871 . . . . 10.0 100.547 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.2 mp -126.48 63.81 1.27 Allowed 'General case' 0 C--N 1.321 -0.636 1 N-CA-C 121.845 4.017 . . . . 10.0 121.845 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.3 m -84.57 153.05 23.47 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 105.376 -2.083 . . . . 10.0 105.376 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -63.54 -29.16 70.46 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 107.249 -1.389 . . . . 10.0 107.249 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.479 ' HB3' HD11 ' A' ' 36' ' ' LEU . 2.1 t80 -112.41 123.74 50.95 Favored 'General case' 0 C--O 1.243 0.76 0 O-C-N 125.831 1.957 . . . . 10.0 107.945 -179.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 53.53 91.67 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 113.813 1.042 . . . . 10.0 113.813 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . 0.503 ' HB3' ' CD1' ' A' ' 61' ' ' ILE . 6.0 m-20 -58.32 -52.39 65.81 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 115.126 -0.943 . . . . 10.0 110.736 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER 76.42 84.95 0.09 Allowed 'General case' 0 C--N 1.311 -1.105 0 C-N-CA 126.325 1.85 . . . . 10.0 106.105 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.503 ' CD1' ' HB3' ' A' ' 59' ' ' ASN . 1.7 mp -105.75 135.54 43.55 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.81 0 O-C-N 120.834 -1.166 . . . . 10.0 110.33 -179.868 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 7.8 mtt -125.58 166.58 16.43 Favored 'General case' 0 C--O 1.214 -0.802 0 N-CA-C 107.692 -1.225 . . . . 10.0 107.692 179.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -146.02 89.61 1.9 Allowed 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 100.301 -3.963 . . . . 10.0 100.301 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.654 ' CD2' HG21 ' A' ' 86' ' ' VAL . 3.7 m-30 -100.63 157.43 16.68 Favored 'General case' 0 C--N 1.32 -0.714 0 O-C-N 126.168 2.168 . . . . 10.0 113.999 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -120.22 104.47 10.09 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 105.504 -2.035 . . . . 10.0 105.504 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.433 ' O ' HG12 ' A' ' 66' ' ' VAL . 1.7 t -59.48 113.12 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.921 0 CA-C-N 115.423 -0.808 . . . . 10.0 109.49 -179.678 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 103.2 22.01 9.56 Favored Glycine 0 C--O 1.224 -0.5 0 CA-C-O 117.613 -1.659 . . . . 10.0 114.98 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.1 tttm -140.95 159.36 42.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 121.055 2.428 . . . . 10.0 115.951 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.86 144.19 35.22 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 107.765 -1.198 . . . . 10.0 107.765 -179.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -144.02 98.69 3.26 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-O 123.543 1.639 . . . . 10.0 112.686 179.735 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -70.33 103.4 2.39 Favored 'General case' 0 C--O 1.22 -0.474 0 O-C-N 119.364 -2.085 . . . . 10.0 105.639 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.458 ' HB3' ' HG ' ' A' ' 74' ' ' LEU . 3.5 mt-10 -75.86 -34.39 60.04 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-O 117.214 -1.374 . . . . 10.0 114.342 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 41.53 73.65 0.12 Allowed 'General case' 0 C--N 1.317 -0.816 0 O-C-N 126.409 2.318 . . . . 10.0 109.702 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.458 ' HG ' ' HB3' ' A' ' 72' ' ' GLU . 1.2 mt -95.55 126.77 41.07 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 115.742 1.756 . . . . 10.0 115.742 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 35.6 p -123.84 41.56 3.45 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 103.845 -2.65 . . . . 10.0 103.845 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -155.0 165.99 32.36 Favored Glycine 0 N--CA 1.446 -0.668 0 N-CA-C 109.733 -1.347 . . . . 10.0 109.733 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.472 HD13 ' N ' ' A' ' 77' ' ' ILE . 3.0 mm 64.21 -73.81 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 O-C-N 126.089 1.699 . . . . 10.0 107.772 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 23.7 p30 -139.09 39.02 2.12 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 117.548 -1.215 . . . . 10.0 108.567 179.635 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 4.26 91.16 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.646 0 O-C-N 127.523 3.014 . . . . 10.0 117.528 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.46 112.59 8.59 Favored 'General case' 0 CA--C 1.506 -0.726 0 CA-C-O 121.645 0.736 . . . . 10.0 112.828 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 7.3 pttt -80.25 121.54 25.76 Favored 'General case' 0 N--CA 1.438 -1.074 0 N-CA-C 103.515 -2.772 . . . . 10.0 103.515 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 28.2 p -153.21 -178.59 7.06 Favored 'General case' 0 C--O 1.216 -0.705 0 CA-C-N 114.906 -1.043 . . . . 10.0 108.204 -179.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.1 ptt? -130.48 132.78 45.83 Favored 'General case' 0 CA--C 1.505 -0.773 1 N-CA-C 99.003 -4.443 . . . . 10.0 99.003 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 25.6 m -132.64 120.71 22.12 Favored 'General case' 0 CA--C 1.505 -0.769 0 N-CA-C 118.179 2.659 . . . . 10.0 118.179 -179.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.12 118.6 36.83 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 112.313 -2.221 . . . . 10.0 108.471 -179.811 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.654 HG21 ' CD2' ' A' ' 64' ' ' PHE . 96.5 t -104.66 120.3 54.89 Favored 'Isoleucine or valine' 0 C--O 1.24 0.561 0 N-CA-C 105.795 -1.928 . . . . 10.0 105.795 -179.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -127.15 -159.14 0.91 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 123.94 1.829 . . . . 10.0 109.821 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 7.4 p-90 -148.77 123.59 9.93 Favored 'General case' 0 CA--C 1.51 -0.573 0 O-C-N 120.569 -1.332 . . . . 10.0 107.9 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -80.0 -38.33 32.33 Favored 'General case' 0 N--CA 1.447 -0.62 1 N-CA-C 98.862 -4.495 . . . . 10.0 98.862 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 134.4 126.81 2.67 Favored Glycine 0 N--CA 1.44 -1.034 0 N-CA-C 103.857 -3.697 . . . . 10.0 103.857 -179.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 58.14 20.44 7.01 Favored 'General case' 0 N--CA 1.468 0.426 0 O-C-N 120.706 -1.467 . . . . 10.0 110.247 179.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 5.0 ttpt -156.7 143.47 18.55 Favored 'General case' 0 C--N 1.341 0.211 0 O-C-N 125.879 1.987 . . . . 10.0 108.501 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 2.9 tp -111.45 82.94 1.69 Allowed 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 106.137 -1.801 . . . . 10.0 106.137 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -86.79 145.31 26.67 Favored 'General case' 0 CA--C 1.505 -0.769 0 O-C-N 119.716 -1.865 . . . . 10.0 111.303 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -144.07 141.72 30.23 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-N 114.392 -1.277 . . . . 10.0 109.777 179.75 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 1.6 t -122.62 142.71 38.08 Favored 'Isoleucine or valine' 0 C--O 1.242 0.702 0 N-CA-C 105.217 -2.142 . . . . 10.0 105.217 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 31.3 mt-30 -125.15 100.01 6.36 Favored 'General case' 0 C--O 1.246 0.881 0 CA-C-N 114.074 -1.421 . . . . 10.0 112.247 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 28.8 mmtt -63.45 113.49 3.3 Favored 'General case' 0 CA--C 1.505 -0.77 0 N-CA-C 115.396 1.628 . . . . 10.0 115.396 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -145.99 -114.11 0.85 Allowed Glycine 0 C--O 1.217 -0.953 0 C-N-CA 118.584 -1.769 . . . . 10.0 113.357 -179.651 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 18.8 tp10 -126.8 -9.02 6.1 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 115.348 1.611 . . . . 10.0 115.348 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 21.5 mmtt -107.57 158.26 17.38 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 117.699 2.481 . . . . 10.0 117.699 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -51.55 -63.07 1.25 Allowed 'General case' 0 C--O 1.238 0.48 0 O-C-N 119.674 -1.891 . . . . 10.0 109.948 -179.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -78.09 -82.76 0.6 Allowed Glycine 0 CA--C 1.505 -0.558 0 C-N-CA 121.14 -0.552 . . . . 10.0 114.143 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 46.2 81.85 0.04 OUTLIER 'General case' 0 N--CA 1.44 -0.956 0 CA-C-O 124.524 2.107 . . . . 10.0 114.398 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 179.23 174.57 45.46 Favored Glycine 0 C--O 1.219 -0.841 0 CA-C-N 112.686 -2.052 . . . . 10.0 111.191 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' TRP . . . . . 0.673 ' CE3' HD11 ' A' ' 117' ' ' LEU . 15.5 m0 -123.02 144.47 49.24 Favored 'General case' 0 C--O 1.217 -0.613 0 N-CA-C 108.077 -1.083 . . . . 10.0 108.077 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -131.1 133.34 45.55 Favored 'General case' 0 C--O 1.21 -0.979 0 N-CA-C 106.252 -1.759 . . . . 10.0 106.252 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.484 ' NE2' HD13 ' A' ' 115' ' ' LEU . 9.5 tp60 -141.97 112.79 7.32 Favored 'General case' 0 C--N 1.323 -0.569 0 O-C-N 125.706 1.879 . . . . 10.0 113.462 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -126.46 104.11 7.98 Favored 'General case' 0 C--O 1.212 -0.89 0 CA-C-O 122.929 1.347 . . . . 10.0 112.102 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 14.6 mt -55.21 109.29 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 112.968 -1.924 . . . . 10.0 112.614 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -96.46 -175.96 3.49 Favored 'General case' 0 C--N 1.333 -0.123 0 O-C-N 126.685 2.491 . . . . 10.0 106.865 -179.745 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -52.5 94.31 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.638 0 O-C-N 126.103 2.127 . . . . 10.0 111.378 179.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 44.86 33.42 0.99 Allowed 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 123.555 1.645 . . . . 10.0 111.669 -179.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -139.39 124.17 18.56 Favored 'General case' 0 C--O 1.241 0.613 0 N-CA-C 115.539 1.681 . . . . 10.0 115.539 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.484 HD13 ' NE2' ' A' ' 108' ' ' GLN . 0.5 OUTLIER -84.96 125.51 32.74 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 103.643 -2.725 . . . . 10.0 103.643 179.797 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -129.13 91.62 3.23 Favored 'General case' 0 N--CA 1.445 -0.689 0 O-C-N 121.784 -0.573 . . . . 10.0 110.239 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.673 HD11 ' CE3' ' A' ' 106' ' ' TRP . 1.1 tp -95.79 122.17 38.29 Favored 'General case' 0 N--CA 1.442 -0.857 0 O-C-N 124.988 1.43 . . . . 10.0 110.722 179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -122.23 108.0 12.79 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 117.999 -1.0 . . . . 10.0 109.085 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -98.32 136.51 38.39 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 118.571 0.623 . . . . 10.0 112.124 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -113.65 146.63 39.48 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 113.022 0.749 . . . . 10.0 113.022 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -162.44 113.54 1.56 Allowed 'General case' 0 C--N 1.32 -0.699 0 O-C-N 125.527 1.767 . . . . 10.0 109.639 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 52.72 46.7 26.23 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 117.279 -1.343 . . . . 10.0 112.899 179.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 74.13 14.49 80.45 Favored Glycine 0 N--CA 1.469 0.888 0 O-C-N 125.72 1.888 . . . . 10.0 117.205 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 97.3 t -116.31 112.98 41.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 N-CA-C 106.974 -1.491 . . . . 10.0 106.974 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 37.0 m -90.97 87.65 6.7 Favored 'General case' 0 N--CA 1.444 -0.736 0 O-C-N 125.169 1.543 . . . . 10.0 114.508 179.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 8.6 t -76.31 136.28 39.58 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 105.148 -2.168 . . . . 10.0 105.148 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -127.46 157.46 40.0 Favored 'General case' 0 N--CA 1.474 0.773 0 O-C-N 125.284 1.615 . . . . 10.0 112.055 -179.61 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -140.38 97.1 3.15 Favored 'General case' 0 CA--C 1.503 -0.846 0 CA-C-O 122.478 1.132 . . . . 10.0 110.044 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.462 ' CG1' HD22 ' A' ' 11' ' ' LEU . 40.7 t -72.93 129.09 36.11 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 O-C-N 120.62 -1.3 . . . . 10.0 107.92 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . 0.441 ' CZ ' ' HB2' ' A' ' 40' ' ' LYS . 0.6 OUTLIER -128.21 160.13 33.05 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 113.614 -1.63 . . . . 10.0 110.218 179.776 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.448 ' CG ' HD11 ' A' ' 11' ' ' LEU . 4.4 mmtt -132.54 127.78 35.87 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 105.817 -1.92 . . . . 10.0 105.817 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 12.7 tttt -90.7 102.84 15.59 Favored 'General case' 0 C--O 1.219 -0.536 0 O-C-N 125.178 1.549 . . . . 10.0 108.904 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' VAL . . . . . 0.43 ' H ' HG23 ' A' ' 133' ' ' VAL . 16.5 t -41.83 -55.17 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 127.491 2.994 . . . . 10.0 114.257 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.445 -0.699 0 O-C-N 125.508 1.755 . . . . 10.0 111.463 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.241 0.615 0 N-CA-C 108.936 -0.765 . . . . 10.0 108.936 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.541 ' CD1' ' CD1' ' A' ' 110' ' ' ILE . 20.8 m-30 -59.0 -14.85 10.52 Favored 'General case' 0 C--O 1.22 -0.486 0 N-CA-C 112.828 0.677 . . . . 10.0 112.828 -179.751 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.49 124.9 21.55 Favored 'General case' 0 C--O 1.244 0.765 0 N-CA-C 114.347 1.24 . . . . 10.0 114.347 -179.704 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -155.91 -105.39 0.23 Allowed Glycine 0 CA--C 1.532 1.106 0 C-N-CA 118.447 -1.835 . . . . 10.0 116.198 -179.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -166.11 166.38 17.14 Favored 'General case' 0 C--O 1.241 0.619 0 N-CA-C 102.445 -3.169 . . . . 10.0 102.445 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.529 ' CZ3' ' HB2' ' A' ' 41' ' ' GLU 0.302 18.1 p90 -144.3 -173.71 4.1 Favored 'General case' 0 C--N 1.314 -0.942 0 C-N-CA 126.591 1.957 . . . . 10.0 113.458 179.964 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.59 ' HD2' HG22 ' A' ' 133' ' ' VAL . 0.0 OUTLIER 162.5 72.71 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.575 0 O-C-N 127.428 2.955 . . . . 10.0 106.271 177.757 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.414 ' CE ' ' HB2' ' A' ' 37' ' ' LYS . 0.0 OUTLIER 0.51 -58.46 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.924 0 O-C-N 127.697 3.123 . . . . 10.0 117.57 -179.459 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.449 ' N ' ' O ' ' A' ' 9' ' ' LYS . 0.2 OUTLIER 81.71 -58.17 0.24 Allowed 'General case' 0 C--O 1.246 0.92 0 C-N-CA 127.421 2.288 . . . . 10.0 107.671 179.83 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -163.71 159.3 21.34 Favored 'General case' 0 C--N 1.323 -0.574 0 O-C-N 125.178 1.549 . . . . 10.0 114.114 179.844 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 4.6 p-10 -157.57 164.16 37.59 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 112.429 -2.169 . . . . 10.0 108.291 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -144.31 -178.92 6.21 Favored 'General case' 0 C--O 1.219 -0.515 0 O-C-N 125.623 1.827 . . . . 10.0 111.88 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 28.09 44.13 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.555 0 O-C-N 126.458 2.349 . . . . 10.0 114.119 179.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -72.13 -45.79 59.16 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-O 117.88 -1.057 . . . . 10.0 110.608 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -78.4 -22.51 47.69 Favored 'General case' 0 C--O 1.218 -0.567 0 CA-C-O 123.488 1.613 . . . . 10.0 110.358 179.82 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -76.55 -27.06 55.77 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 123.499 1.619 . . . . 10.0 107.11 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -77.25 -33.65 55.98 Favored 'General case' 0 CA--C 1.55 0.947 0 CA-C-N 113.475 -1.693 . . . . 10.0 110.49 -179.856 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 83.5 mt -70.55 -31.28 68.27 Favored 'General case' 0 C--O 1.215 -0.712 0 O-C-N 124.501 1.126 . . . . 10.0 110.561 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.56 -22.77 58.83 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 114.972 -1.013 . . . . 10.0 110.383 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.93 -31.34 67.92 Favored 'General case' 0 C--O 1.214 -0.807 0 CA-C-N 119.154 0.888 . . . . 10.0 112.287 179.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.8 mt -92.26 -21.36 20.37 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 124.658 1.224 . . . . 10.0 109.175 179.568 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 34.9 t0 76.98 49.36 0.05 Allowed 'General case' 0 C--O 1.244 0.788 0 N-CA-C 115.849 1.796 . . . . 10.0 115.849 -179.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 33.1 m -80.12 -179.2 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.815 0 O-C-N 118.716 -2.49 . . . . 10.0 108.406 179.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -60.54 155.48 18.48 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 119.093 -1.043 . . . . 10.0 111.769 179.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.6 m -75.91 -26.09 17.51 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.921 0 N-CA-C 116.834 2.161 . . . . 10.0 116.834 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -77.52 -25.26 50.09 Favored 'General case' 0 C--O 1.243 0.755 0 O-C-N 121.047 -1.033 . . . . 10.0 109.866 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.38 -31.14 65.33 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 114.625 -1.171 . . . . 10.0 111.757 -179.693 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.4 ttm180 -68.39 -33.3 74.0 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 125.791 1.636 . . . . 10.0 110.223 179.667 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -74.39 -40.29 62.15 Favored 'General case' 0 CA--C 1.508 -0.65 0 CA-C-N 113.168 -1.833 . . . . 10.0 111.535 -179.746 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.468 HG21 ' CE1' ' A' ' 57' ' ' PHE . 0.4 OUTLIER -73.58 -52.57 20.74 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 CA-C-O 122.471 1.129 . . . . 10.0 112.975 179.968 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -56.06 -21.8 23.96 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 112.511 -2.131 . . . . 10.0 112.659 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -66.87 -47.67 71.16 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-O 118.231 -0.89 . . . . 10.0 112.656 -179.742 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.422 ' O ' HD12 ' A' ' 35' ' ' LEU . 1.2 pp -73.01 -2.53 21.48 Favored 'General case' 0 CA--C 1.517 -0.303 0 O-C-N 125.091 1.494 . . . . 10.0 114.088 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -103.66 156.04 18.1 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 122.928 1.347 . . . . 10.0 112.748 179.504 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.414 ' HB2' ' CE ' ' A' ' 10' ' ' MET . 17.4 mttt -140.32 126.94 12.08 Favored Pre-proline 0 N--CA 1.466 0.347 0 N-CA-C 105.689 -1.967 . . . . 10.0 105.689 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_exo -86.27 153.14 9.4 Favored 'Trans proline' 0 CA--C 1.538 0.715 0 C-N-CA 124.836 3.69 . . . . 10.0 116.632 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.48 ' HB2' ' NE1' ' A' ' 8' ' ' TRP . 0.5 OUTLIER -114.63 166.74 11.41 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 125.571 1.548 . . . . 10.0 106.974 179.872 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.4 ttmt -161.36 104.93 1.27 Allowed 'General case' 0 CA--C 1.496 -1.103 0 C-N-CA 116.697 -2.001 . . . . 10.0 112.148 -179.643 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.529 ' HB2' ' CZ3' ' A' ' 8' ' ' TRP . 27.6 tt0 -94.79 135.64 36.04 Favored 'General case' 0 C--O 1.24 0.556 0 N-CA-C 102.41 -3.182 . . . . 10.0 102.41 179.881 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.435 HG23 HD12 ' A' ' 51' ' ' ILE . 62.4 mt -120.62 150.78 23.42 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 CA-C-N 120.291 1.405 . . . . 10.0 109.319 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -141.84 127.19 17.87 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 N-CA-C 103.898 -2.63 . . . . 10.0 103.898 -179.882 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -132.62 103.52 6.18 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 125.203 1.564 . . . . 10.0 110.953 -179.757 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -69.45 -63.05 1.14 Allowed 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 106.262 -1.755 . . . . 10.0 106.262 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -163.67 -78.75 0.03 OUTLIER Glycine 0 CA--C 1.532 1.108 0 N-CA-C 109.614 -1.394 . . . . 10.0 109.614 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -107.24 53.71 0.69 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 123.351 1.548 . . . . 10.0 109.089 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -163.43 168.52 20.16 Favored 'General case' 0 C--O 1.215 -0.733 0 N-CA-C 105.041 -2.207 . . . . 10.0 105.041 -179.846 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.481 ' HE1' HD21 ' A' ' 93' ' ' LEU . 6.6 ttp -163.41 102.54 0.95 Allowed 'General case' 0 C--O 1.216 -0.659 0 O-C-N 126.112 2.132 . . . . 10.0 112.317 179.66 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.592 HD12 ' N ' ' A' ' 50' ' ' ILE . 2.3 mp -93.98 100.6 11.43 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.759 0 O-C-N 124.483 1.115 . . . . 10.0 108.177 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.466 ' N ' HD13 ' A' ' 51' ' ' ILE . 0.4 OUTLIER -95.59 114.82 33.12 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.805 0 CA-C-O 123.722 1.725 . . . . 10.0 106.745 -179.897 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -115.03 125.97 54.19 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 112.926 -1.943 . . . . 10.0 111.843 179.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 26.7 m -112.32 121.71 45.66 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 100.908 -3.738 . . . . 10.0 100.908 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.9 mt -94.64 12.82 26.3 Favored 'General case' 0 CA--C 1.513 -0.467 0 N-CA-C 121.597 3.925 . . . . 10.0 121.597 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.2 p -68.19 129.08 38.86 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 103.908 -2.627 . . . . 10.0 103.908 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -83.32 156.53 23.0 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 107.869 -1.16 . . . . 10.0 107.869 -179.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.468 ' CE1' HG21 ' A' ' 32' ' ' ILE . 3.9 t80 83.75 10.77 0.46 Allowed 'General case' 0 C--N 1.324 -0.506 0 O-C-N 126.468 2.355 . . . . 10.0 105.308 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.759 ' HG2' HD11 ' A' ' 77' ' ' ILE . 5.7 mtp85 -151.45 -69.01 0.17 Allowed 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 126.066 1.747 . . . . 10.0 111.235 -179.795 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 24.49 88.91 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.775 0 O-C-N 128.441 3.588 . . . . 10.0 112.139 179.66 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 46.3 p90 -121.78 148.85 44.14 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 106.86 -1.533 . . . . 10.0 106.86 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.417 HG22 ' N ' ' A' ' 62' ' ' MET . 3.2 mp -133.27 158.87 43.14 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.869 0 N-CA-C 112.475 0.546 . . . . 10.0 112.475 180.0 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . 0.417 ' N ' HG22 ' A' ' 61' ' ' ILE . 0.7 OUTLIER -141.86 158.31 43.94 Favored 'General case' 0 C--O 1.215 -0.715 0 N-CA-C 107.031 -1.47 . . . . 10.0 107.031 -179.672 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 29.9 t0 -125.63 77.73 1.68 Allowed 'General case' 0 N--CA 1.441 -0.876 0 N-CA-C 104.279 -2.489 . . . . 10.0 104.279 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 8.4 m-30 -76.8 177.03 7.95 Favored 'General case' 0 C--O 1.242 0.686 0 N-CA-C 115.898 1.814 . . . . 10.0 115.898 -179.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 56.5 mt-30 -151.61 123.65 8.14 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 125.038 1.461 . . . . 10.0 108.089 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 53.2 t -58.16 137.79 19.96 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 C-N-CA 125.848 1.659 . . . . 10.0 109.156 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 65.74 9.89 47.59 Favored Glycine 0 N--CA 1.439 -1.108 0 CA-C-O 118.418 -1.212 . . . . 10.0 114.506 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.06 165.58 12.49 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 120.714 2.257 . . . . 10.0 112.442 179.668 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -122.34 149.11 44.22 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 108.09 -1.078 . . . . 10.0 108.09 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -152.38 -170.66 3.7 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 122.98 1.371 . . . . 10.0 110.528 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -143.73 110.38 5.56 Favored 'General case' 0 C--N 1.319 -0.73 0 C-N-CA 119.139 -1.024 . . . . 10.0 110.468 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -95.8 72.77 3.07 Favored 'General case' 0 N--CA 1.441 -0.877 0 O-C-N 120.385 -1.447 . . . . 10.0 111.172 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.419 ' HA ' ' CB ' ' A' ' 81' ' ' LYS . 6.0 p-10 -44.59 137.33 3.86 Favored 'General case' 0 C--N 1.315 -0.929 0 O-C-N 128.945 3.903 . . . . 10.0 105.815 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.71 HD13 ' O ' ' A' ' 74' ' ' LEU . 0.8 OUTLIER 63.85 119.72 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 116.748 2.129 . . . . 10.0 116.748 -179.717 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.533 ' N ' HD22 ' A' ' 74' ' ' LEU . 1.7 m -104.6 102.42 12.03 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 106.794 -1.558 . . . . 10.0 106.794 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -57.9 101.35 0.18 Allowed Glycine 0 CA--C 1.531 1.054 0 CA-C-O 115.945 -2.586 . . . . 10.0 110.216 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.759 HD11 ' HG2' ' A' ' 58' ' ' ARG . 7.0 mt 134.32 -68.53 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.954 0 O-C-N 127.748 2.675 . . . . 10.0 109.81 179.522 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -103.41 8.29 38.03 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 112.908 0.707 . . . . 10.0 112.908 -179.526 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.404 ' N ' ' O ' ' A' ' 75' ' ' THR . 0.0 OUTLIER 44.02 -166.71 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 127.136 2.174 . . . . 10.0 116.472 -179.694 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.402 ' HG3' ' N ' ' A' ' 81' ' ' LYS . 0.0 OUTLIER 78.08 156.52 0.17 Allowed 'General case' 0 CA--C 1.505 -0.766 0 CA-C-O 122.35 1.072 . . . . 10.0 110.998 179.761 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.419 ' CB ' ' HA ' ' A' ' 73' ' ' ASP . 1.4 pttm -96.11 136.61 36.34 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 105.32 -2.104 . . . . 10.0 105.32 179.804 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -120.45 137.71 54.19 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 125.651 1.58 . . . . 10.0 107.481 179.701 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.3 mtp -100.95 91.48 4.6 Favored 'General case' 0 N--CA 1.441 -0.897 0 N-CA-C 102.926 -2.99 . . . . 10.0 102.926 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 68.7 m -91.83 129.13 37.85 Favored 'General case' 0 C--O 1.215 -0.761 0 N-CA-C 114.121 1.156 . . . . 10.0 114.121 179.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 40.9 m -127.2 118.02 23.48 Favored 'General case' 0 N--CA 1.44 -0.94 0 O-C-N 126.564 2.415 . . . . 10.0 104.594 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 22.9 m -91.42 -175.75 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 N-CA-C 104.084 -2.561 . . . . 10.0 104.084 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 172.2 132.76 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.86 0 O-C-N 124.256 0.973 . . . . 10.0 111.268 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . 0.627 ' CD1' ' HA ' ' A' ' 91' ' ' ASP . 0.7 OUTLIER -78.74 80.83 5.08 Favored 'General case' 0 C--O 1.22 -0.469 0 N-CA-C 105.209 -2.145 . . . . 10.0 105.209 179.873 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -95.22 105.47 17.41 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 103.986 -2.598 . . . . 10.0 103.986 179.777 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 67.13 31.62 78.13 Favored Glycine 0 CA--C 1.504 -0.608 0 N-CA-C 108.552 -1.819 . . . . 10.0 108.552 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.627 ' HA ' ' CD1' ' A' ' 88' ' ' TRP . 0.5 OUTLIER 73.81 -11.59 0.94 Allowed 'General case' 0 C--O 1.236 0.394 0 CA-C-N 119.694 1.747 . . . . 10.0 114.768 179.911 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.502 ' HD3' ' CZ3' ' A' ' 109' ' ' TRP . 11.0 pttm -90.45 151.76 21.25 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 106.797 -1.557 . . . . 10.0 106.797 -179.863 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.481 HD21 ' HE1' ' A' ' 49' ' ' MET . 0.2 OUTLIER -82.41 92.73 7.07 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 106.104 -1.813 . . . . 10.0 106.104 179.962 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -98.41 95.88 7.63 Favored 'General case' 0 C--O 1.214 -0.789 0 O-C-N 120.515 -1.366 . . . . 10.0 110.003 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 30.8 p -106.25 143.87 33.76 Favored 'General case' 0 CA--C 1.507 -0.693 0 CA-C-O 124.382 2.039 . . . . 10.0 114.102 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -123.02 138.91 51.44 Favored 'Isoleucine or valine' 0 C--O 1.245 0.827 0 N-CA-C 104.551 -2.389 . . . . 10.0 104.551 179.801 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -123.41 76.23 1.38 Allowed 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.33 1.019 . . . . 10.0 112.642 -179.802 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 3.5 mmmt -46.39 124.92 6.24 Favored 'General case' 0 CA--C 1.512 -0.492 0 N-CA-C 113.753 1.02 . . . . 10.0 113.753 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 172.34 62.48 0.04 OUTLIER Glycine 0 CA--C 1.501 -0.82 0 O-C-N 126.081 2.113 . . . . 10.0 112.337 179.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 75.88 -172.44 0.1 Allowed 'General case' 0 C--N 1.316 -0.864 0 O-C-N 126.433 1.902 . . . . 10.0 114.574 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 13.0 mmtt 65.34 -177.25 0.18 Allowed 'General case' 0 N--CA 1.442 -0.873 0 CA-C-O 123.689 1.709 . . . . 10.0 113.184 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -124.3 49.6 1.77 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 113.519 -1.673 . . . . 10.0 114.231 179.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 153.21 36.59 0.03 OUTLIER Glycine 0 C--O 1.218 -0.885 0 N-CA-C 118.814 2.285 . . . . 10.0 118.814 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 43.3 mtp180 -75.95 163.64 26.97 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 116.951 0.375 . . . . 10.0 110.11 179.592 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 119.29 144.54 7.38 Favored Glycine 0 N--CA 1.437 -1.27 0 C-N-CA 118.956 -1.592 . . . . 10.0 110.225 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 19.1 m0 -111.27 173.89 6.12 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-O 117.123 -1.418 . . . . 10.0 109.267 179.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 2.7 m -147.96 135.73 20.94 Favored 'General case' 0 C--O 1.209 -1.07 0 O-C-N 124.908 1.38 . . . . 10.0 108.384 179.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -120.56 131.25 54.57 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 125.758 1.911 . . . . 10.0 107.974 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' TRP . . . . . 0.502 ' CZ3' ' HD3' ' A' ' 92' ' ' LYS . 2.6 t-105 -146.37 124.87 12.4 Favored 'General case' 0 CA--C 1.5 -0.959 0 CA-C-O 122.453 1.121 . . . . 10.0 110.134 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.541 ' CD1' ' CD1' ' A' ' 4' ' ' PHE . 43.2 mt -99.16 124.6 52.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 116.281 1.956 . . . . 10.0 116.281 179.63 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -129.78 110.25 11.6 Favored 'General case' 0 CA--C 1.509 -0.611 0 O-C-N 126.318 2.261 . . . . 10.0 105.514 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 53.97 -104.4 0.23 Allowed Glycine 0 N--CA 1.459 0.227 0 N-CA-C 108.682 -1.767 . . . . 10.0 108.682 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -114.86 4.0 14.75 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 125.331 1.253 . . . . 10.0 110.683 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 73.5 tt0 -102.96 101.52 11.54 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 115.176 1.547 . . . . 10.0 115.176 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.648 HD12 ' C ' ' A' ' 115' ' ' LEU . 0.2 OUTLIER -67.48 107.65 2.54 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 103.574 -2.75 . . . . 10.0 103.574 179.764 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . 0.405 ' N ' HD12 ' A' ' 115' ' ' LEU . 0.3 OUTLIER -99.34 103.63 15.46 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 119.671 -1.893 . . . . 10.0 110.372 -179.902 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.856 HD21 ' CE ' ' A' ' 119' ' ' MET . 0.0 OUTLIER -103.73 143.06 33.3 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 124.228 1.966 . . . . 10.0 111.534 179.814 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -141.01 120.14 12.88 Favored 'General case' 0 CA--C 1.5 -0.98 0 O-C-N 120.507 -1.37 . . . . 10.0 108.758 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.856 ' CE ' HD21 ' A' ' 117' ' ' LEU . 3.5 mtm -95.53 -174.85 3.29 Favored 'General case' 0 N--CA 1.439 -1.007 0 N-CA-C 113.779 1.029 . . . . 10.0 113.779 179.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 9.2 tpt180 -167.84 129.8 1.51 Allowed 'General case' 0 N--CA 1.445 -0.695 0 O-C-N 124.238 0.961 . . . . 10.0 112.912 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . 0.614 ' O ' HG22 ' A' ' 124' ' ' VAL . . . -156.91 121.16 4.36 Favored 'General case' 0 CA--C 1.503 -0.832 0 CA-C-O 122.936 1.35 . . . . 10.0 110.037 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 59.99 14.52 4.39 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 124.022 1.868 . . . . 10.0 115.338 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 105.9 9.55 32.22 Favored Glycine 0 C--O 1.241 0.591 0 O-C-N 120.818 -1.176 . . . . 10.0 115.775 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.614 HG22 ' O ' ' A' ' 121' ' ' ALA . 20.1 m -101.69 164.32 3.05 Favored 'Isoleucine or valine' 0 C--O 1.239 0.539 0 CA-C-N 118.77 1.285 . . . . 10.0 110.061 179.776 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 1.3 m -131.41 108.67 9.78 Favored 'General case' 0 N--CA 1.447 -0.599 0 O-C-N 125.3 1.625 . . . . 10.0 114.558 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -111.47 137.45 49.26 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 104.753 -2.314 . . . . 10.0 104.753 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.88 166.98 23.15 Favored 'General case' 0 CA--C 1.509 -0.618 0 O-C-N 125.362 1.664 . . . . 10.0 114.913 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -139.99 163.76 31.83 Favored 'General case' 0 C--O 1.242 0.7 0 O-C-N 125.902 2.001 . . . . 10.0 108.665 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 6.9 m -125.98 66.95 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 N-CA-C 105.713 -1.958 . . . . 10.0 105.713 179.735 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . 0.528 ' HB3' ' HB3' ' A' ' 115' ' ' LEU . 0.1 OUTLIER -56.22 132.34 50.33 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 125.576 1.55 . . . . 10.0 109.309 -179.927 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 37.4 tptt -111.48 104.78 13.22 Favored 'General case' 0 C--O 1.242 0.68 0 N-CA-C 106.387 -1.708 . . . . 10.0 106.387 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 1.4 ttpt -73.72 97.62 2.74 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 105.467 -2.049 . . . . 10.0 105.467 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' VAL . . . . . 0.59 HG22 ' HD2' ' A' ' 9' ' ' LYS . 2.6 t -42.97 -31.9 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 124.546 1.154 . . . . 10.0 112.947 -179.865 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 10.1 t60 . . . . . 0 C--N 1.317 -0.837 0 O-C-N 127.372 2.92 . . . . 10.0 110.924 179.677 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.0 t0 . . . . . 0 C--O 1.233 0.235 0 CA-C-O 118.69 -0.671 . . . . 10.0 111.268 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.524 ' HE2' HD13 ' A' ' 93' ' ' LEU . 2.2 m-85 -175.45 -49.38 0.01 OUTLIER 'General case' 0 C--O 1.244 0.776 0 N-CA-C 116.356 1.984 . . . . 10.0 116.356 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 35.0 t-20 -35.91 104.5 0.03 OUTLIER 'General case' 0 C--O 1.241 0.655 0 N-CA-C 115.659 1.726 . . . . 10.0 115.659 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -148.06 -137.04 2.83 Favored Glycine 0 C--O 1.217 -0.906 0 N-CA-C 117.61 1.804 . . . . 10.0 117.61 179.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 15.4 t80 -156.26 101.08 2.04 Favored 'General case' 0 C--O 1.242 0.691 0 N-CA-C 102.964 -2.976 . . . . 10.0 102.964 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.668 ' CE3' ' CE2' ' A' ' 130' ' ' PHE . 0.0 OUTLIER -90.59 121.93 32.95 Favored 'General case' 0 C--N 1.312 -1.04 0 N-CA-C 114.657 1.354 . . . . 10.0 114.657 -179.972 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.69 132.25 42.54 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 103.033 -2.951 . . . . 10.0 103.033 178.825 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.98 150.52 31.97 Favored 'General case' 0 C--N 1.312 -1.049 0 N-CA-C 116.386 1.995 . . . . 10.0 116.386 -179.419 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.9 tp -124.02 -59.21 1.51 Allowed 'General case' 0 CA--C 1.505 -0.778 0 CA-C-N 113.265 -1.789 . . . . 10.0 111.535 -179.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -131.73 172.38 12.34 Favored 'General case' 0 C--O 1.221 -0.413 0 N-CA-C 115.958 1.836 . . . . 10.0 115.958 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -161.57 135.32 6.62 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 111.375 -2.648 . . . . 10.0 109.037 179.814 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -107.05 -77.13 0.6 Allowed 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 115.818 1.784 . . . . 10.0 115.818 -179.828 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 36.1 m120 -96.4 58.51 1.77 Allowed 'General case' 0 C--N 1.32 -0.683 0 O-C-N 126.525 2.391 . . . . 10.0 111.389 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -70.06 -58.56 3.68 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 113.651 0.982 . . . . 10.0 113.651 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.614 ' HA ' HD12 ' A' ' 20' ' ' LEU . 64.3 mt-10 -67.86 -29.06 68.1 Favored 'General case' 0 C--O 1.243 0.719 0 C-N-CA 123.758 0.823 . . . . 10.0 112.74 -179.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -76.39 -23.33 54.08 Favored 'General case' 0 C--O 1.218 -0.561 0 C-N-CA 119.118 -1.033 . . . . 10.0 109.652 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -73.98 -41.91 61.24 Favored 'General case' 0 CA--C 1.557 1.235 0 C-N-CA 124.455 1.102 . . . . 10.0 109.146 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.614 HD12 ' HA ' ' A' ' 17' ' ' GLU . 1.8 mt -70.7 -28.27 64.62 Favored 'General case' 0 C--O 1.217 -0.645 0 O-C-N 126.35 2.281 . . . . 10.0 112.891 -179.839 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.8 ttm-85 -73.61 -29.3 62.28 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 113.464 -1.698 . . . . 10.0 108.517 -179.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.3 -29.89 67.85 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 120.625 -1.297 . . . . 10.0 113.678 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.4 HD21 ' HB1' ' A' ' 121' ' ' ALA . 20.4 mt -105.45 1.2 27.49 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 125.35 1.656 . . . . 10.0 114.529 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 43.64 82.83 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.01 0 O-C-N 126.158 2.161 . . . . 10.0 110.164 -179.757 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 15.5 m -113.79 46.02 0.31 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.54 0 CA-C-N 113.344 -1.753 . . . . 10.0 111.167 -179.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 65.44 138.47 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 114.676 1.361 . . . . 10.0 114.676 179.781 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 31.1 m -64.12 -31.26 52.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 117.181 2.289 . . . . 10.0 117.181 -179.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -73.64 -41.48 62.69 Favored 'General case' 0 C--O 1.245 0.85 0 CA-C-N 114.373 -1.285 . . . . 10.0 111.748 -179.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.406 HD11 HH12 ' A' ' 58' ' ' ARG . 0.5 OUTLIER -64.54 -34.73 78.92 Favored 'General case' 0 C--O 1.223 -0.333 0 C-N-CA 123.628 0.771 . . . . 10.0 112.646 -179.604 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.93 -33.41 51.73 Favored 'General case' 0 CA--C 1.542 0.636 0 O-C-N 125.074 1.484 . . . . 10.0 111.488 179.718 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 33.1 ttmt -77.67 -33.71 53.28 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 123.064 1.411 . . . . 10.0 108.502 179.347 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -78.28 -38.93 23.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 N-CA-C 108.446 -0.946 . . . . 10.0 108.446 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -73.15 -20.1 60.98 Favored 'General case' 0 C--N 1.317 -0.814 0 O-C-N 124.386 1.054 . . . . 10.0 110.314 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -77.35 -33.11 55.41 Favored 'General case' 0 C--N 1.32 -0.689 0 O-C-N 121.46 -0.775 . . . . 10.0 111.677 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 73.3 mt -95.0 31.79 1.8 Allowed 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 122.24 1.019 . . . . 10.0 108.611 179.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 10.3 tp -153.83 140.59 19.06 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.495 1.118 . . . . 10.0 109.35 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -122.02 119.43 28.8 Favored Pre-proline 0 N--CA 1.47 0.57 0 N-CA-C 105.348 -2.093 . . . . 10.0 105.348 179.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -76.43 111.49 3.27 Favored 'Trans proline' 0 N--CA 1.446 -1.313 1 C-N-CA 126.365 4.71 . . . . 10.0 118.925 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -83.41 122.01 27.93 Favored 'General case' 0 C--O 1.219 -0.518 0 N-CA-C 104.329 -2.471 . . . . 10.0 104.329 179.12 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.598 ' HE3' ' CH2' ' A' ' 8' ' ' TRP . 2.5 ttpt -104.62 131.84 51.56 Favored 'General case' 0 C--O 1.209 -1.067 0 CA-C-O 123.293 1.521 . . . . 10.0 112.905 -179.511 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -115.88 129.34 56.37 Favored 'General case' 0 C--O 1.239 0.522 0 N-CA-C 104.841 -2.281 . . . . 10.0 104.841 179.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.5 mt -102.76 144.62 13.42 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 C-N-CA 119.012 -1.075 . . . . 10.0 113.331 179.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 92.8 t -140.73 124.2 16.83 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.938 0 N-CA-C 104.427 -2.434 . . . . 10.0 104.427 179.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -111.04 154.19 24.56 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 108.718 -0.845 . . . . 10.0 108.718 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -131.75 53.71 1.98 Allowed 'General case' 0 C--O 1.236 0.359 0 CA-C-O 123.163 1.459 . . . . 10.0 107.352 179.834 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 77.03 -92.45 1.04 Allowed Glycine 0 C--N 1.339 0.708 0 N-CA-C 105.602 -2.999 . . . . 10.0 105.602 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -92.48 -49.2 6.25 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 108.138 -1.06 . . . . 10.0 108.138 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 43.4 m170 -60.52 141.73 56.18 Favored 'General case' 0 C--O 1.218 -0.581 0 CA-C-O 122.482 1.134 . . . . 10.0 108.556 179.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 33.1 ttp -135.1 141.95 46.15 Favored 'General case' 0 N--CA 1.437 -1.101 0 CA-C-N 113.635 -1.62 . . . . 10.0 111.493 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 3.2 mt -130.19 136.73 58.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 106.701 -1.592 . . . . 10.0 106.701 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.7 mm -119.93 105.36 17.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 122.998 1.38 . . . . 10.0 108.759 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.514 ' HB3' HD23 ' A' ' 54' ' ' LEU . 21.5 mtp85 -89.98 113.36 25.01 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 113.7 -1.591 . . . . 10.0 109.423 179.859 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.447 HG23 ' HE2' ' A' ' 40' ' ' LYS . 4.3 m -108.83 95.52 5.71 Favored 'General case' 0 C--O 1.239 0.543 0 N-CA-C 100.286 -3.968 . . . . 10.0 100.286 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.514 HD23 ' HB3' ' A' ' 52' ' ' ARG . 2.8 mm? -95.33 146.09 24.63 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 117.531 2.419 . . . . 10.0 117.531 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -159.19 174.49 14.77 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 113.008 -1.905 . . . . 10.0 106.898 179.817 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 19.9 p -95.47 -8.71 34.61 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 121.647 -0.658 . . . . 10.0 110.82 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 6.4 t80 -92.6 -50.33 5.66 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 124.996 1.319 . . . . 10.0 109.461 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.406 HH12 HD11 ' A' ' 29' ' ' LEU . 0.0 OUTLIER -162.89 -177.1 5.29 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 125.332 1.645 . . . . 10.0 111.052 179.714 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -138.68 156.83 47.08 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-O 124.276 1.989 . . . . 10.0 113.883 179.631 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -123.87 112.79 17.67 Favored 'General case' 0 C--O 1.211 -0.928 0 N-CA-C 104.904 -2.258 . . . . 10.0 104.904 179.827 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 19.9 mm -114.19 129.86 69.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 O-C-N 124.184 0.928 . . . . 10.0 110.65 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 3.0 mtt -130.19 156.3 44.82 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 107.134 -1.432 . . . . 10.0 107.134 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -141.43 75.13 1.48 Allowed 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 103.797 -2.668 . . . . 10.0 103.797 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.525 ' CD2' HG21 ' A' ' 86' ' ' VAL . 2.6 m-30 -76.66 162.87 27.38 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 114.378 1.251 . . . . 10.0 114.378 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -131.32 107.1 8.72 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 113.322 -1.763 . . . . 10.0 108.34 -179.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -64.29 135.19 28.31 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 N-CA-C 108.255 -1.017 . . . . 10.0 108.255 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 56.39 36.25 69.08 Favored Glycine 0 N--CA 1.437 -1.257 0 O-C-N 126.016 2.073 . . . . 10.0 117.254 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -156.42 139.23 15.21 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 115.256 1.576 . . . . 10.0 115.256 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -52.7 138.83 27.88 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-O 119.16 -0.448 . . . . 10.0 111.786 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -140.75 96.22 2.98 Favored 'General case' 0 C--O 1.243 0.753 0 CA-C-O 123.209 1.48 . . . . 10.0 113.02 179.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -74.86 137.82 42.06 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 105.003 -2.221 . . . . 10.0 105.003 -179.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -138.58 130.53 28.16 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 124.228 1.011 . . . . 10.0 113.288 -179.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 20.9 p-10 -104.6 118.42 36.53 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-O 125.233 2.444 . . . . 10.0 111.684 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -124.66 126.62 46.04 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 116.658 2.096 . . . . 10.0 116.658 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -144.04 104.68 4.17 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 107.955 -1.128 . . . . 10.0 107.955 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 140.66 -80.42 0.26 Allowed Glycine 0 N--CA 1.442 -0.951 0 C-N-CA 119.766 -1.207 . . . . 10.0 111.047 -179.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -84.74 96.18 4.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 N-CA-C 106.302 -1.74 . . . . 10.0 106.302 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.48 -19.33 0.4 Allowed 'General case' 0 C--O 1.243 0.741 0 N-CA-C 115.16 1.541 . . . . 10.0 115.16 -179.919 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.0 p30 49.75 -164.25 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 125.756 1.622 . . . . 10.0 114.733 -179.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 8.6 ttm-85 83.82 143.74 0.07 Allowed 'General case' 0 C--N 1.32 -0.7 0 O-C-N 125.303 1.627 . . . . 10.0 110.906 179.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 5.5 pttt -93.98 165.34 12.7 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 102.412 -3.181 . . . . 10.0 102.412 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -155.1 144.42 21.12 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 120.89 -1.131 . . . . 10.0 108.695 179.848 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 31.2 mtt -114.34 52.05 0.85 Allowed 'General case' 0 N--CA 1.439 -1.001 0 N-CA-C 102.865 -3.013 . . . . 10.0 102.865 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 50.2 m -52.23 126.09 17.84 Favored 'General case' 0 N--CA 1.442 -0.862 0 N-CA-C 117.44 2.385 . . . . 10.0 117.44 -179.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 9.3 m -125.46 112.74 16.61 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 103.668 -2.716 . . . . 10.0 103.668 179.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.525 HG21 ' CD2' ' A' ' 64' ' ' PHE . 31.6 t -85.06 159.55 3.34 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.594 0 N-CA-C 101.095 -3.669 . . . . 10.0 101.095 -179.805 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -156.0 165.75 35.53 Favored 'General case' 0 C--N 1.318 -0.789 0 O-C-N 125.022 1.451 . . . . 10.0 113.296 179.857 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . 0.465 ' CD1' ' C ' ' A' ' 88' ' ' TRP . 0.0 OUTLIER -115.41 125.37 53.06 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 105.308 -2.108 . . . . 10.0 105.308 179.922 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -142.77 103.75 4.25 Favored 'General case' 0 CA--C 1.506 -0.726 0 N-CA-C 101.559 -3.497 . . . . 10.0 101.559 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 74.63 -146.94 36.27 Favored Glycine 0 CA--C 1.501 -0.796 0 N-CA-C 109.271 -1.531 . . . . 10.0 109.271 179.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -97.32 20.32 11.73 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-O 122.446 1.117 . . . . 10.0 109.681 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 6.6 mtmm -104.58 -174.67 2.59 Favored 'General case' 0 CA--C 1.508 -0.647 0 O-C-N 120.741 -1.225 . . . . 10.0 109.633 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.524 HD13 ' HE2' ' A' ' 4' ' ' PHE . 8.1 tp -131.36 128.6 39.99 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 103.125 -2.917 . . . . 10.0 103.125 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 6.6 mp0 -128.07 125.66 39.71 Favored 'General case' 0 C--N 1.316 -0.873 0 O-C-N 124.941 1.401 . . . . 10.0 112.515 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -124.7 125.62 44.38 Favored 'General case' 0 C--N 1.321 -0.667 0 O-C-N 121.9 -0.5 . . . . 10.0 109.845 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 71.1 t -120.8 142.95 34.57 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 N-CA-C 107.326 -1.361 . . . . 10.0 107.326 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 11.2 mt-30 -126.47 146.31 50.15 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 117.702 -1.142 . . . . 10.0 110.983 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 25.6 mmtt -86.24 -96.95 0.08 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 117.426 -1.273 . . . . 10.0 110.183 -179.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 51.4 -166.52 0.75 Allowed Glycine 0 CA--C 1.503 -0.674 0 O-C-N 124.126 0.891 . . . . 10.0 111.307 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -82.13 -170.11 2.73 Favored 'General case' 0 N--CA 1.447 -0.603 0 N-CA-C 112.788 0.662 . . . . 10.0 112.788 179.747 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 4.3 mttm 71.18 -158.75 0.13 Allowed 'General case' 0 N--CA 1.442 -0.867 0 CA-C-O 122.878 1.323 . . . . 10.0 113.178 179.78 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -146.75 18.2 1.29 Allowed 'General case' 0 CA--C 1.506 -0.736 0 O-C-N 119.861 -1.775 . . . . 10.0 115.272 -179.845 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -156.55 27.12 0.53 Allowed Glycine 0 C--O 1.226 -0.386 0 N-CA-C 118.226 2.05 . . . . 10.0 118.226 -179.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 8.6 mtm180 -86.07 117.78 25.12 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 121.492 -1.005 . . . . 10.0 109.641 179.621 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 163.24 151.58 6.48 Favored Glycine 0 N--CA 1.437 -1.242 0 O-C-N 125.66 1.85 . . . . 10.0 110.57 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 1.8 m0 -114.1 161.27 17.97 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 108.035 -1.098 . . . . 10.0 108.035 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.9 m -142.31 131.23 23.0 Favored 'General case' 0 C--O 1.212 -0.92 0 O-C-N 124.628 1.205 . . . . 10.0 110.984 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.463 ' NE2' HD21 ' A' ' 115' ' ' LEU . 3.0 mt-30 -119.3 131.57 55.77 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.602 1.161 . . . . 10.0 109.603 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' TRP . . . . . 0.492 ' CD1' ' C ' ' A' ' 109' ' ' TRP . 0.0 OUTLIER -137.47 113.71 10.04 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 106.871 -1.529 . . . . 10.0 106.871 179.977 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -86.27 146.41 6.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 N-CA-C 116.38 1.992 . . . . 10.0 116.38 179.76 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -149.94 127.49 11.57 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-O 116.072 -1.918 . . . . 10.0 107.575 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 46.61 -129.23 11.37 Favored Glycine 0 CA--C 1.534 1.233 0 N-CA-C 106.24 -2.744 . . . . 10.0 106.24 179.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -95.51 29.11 2.68 Favored 'General case' 0 C--N 1.321 -0.659 0 O-C-N 124.829 0.958 . . . . 10.0 113.304 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -140.71 151.8 44.8 Favored 'General case' 0 C--O 1.24 0.595 0 CA-C-N 119.801 1.182 . . . . 10.0 111.634 179.855 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.655 ' HG ' ' CE2' ' A' ' 130' ' ' PHE . 0.7 OUTLIER -108.99 130.8 55.48 Favored 'General case' 0 C--N 1.316 -0.869 0 O-C-N 125.949 2.03 . . . . 10.0 108.992 179.882 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . 0.644 ' N ' HD12 ' A' ' 115' ' ' LEU . 13.0 m80 -111.59 98.77 7.67 Favored 'General case' 0 CA--C 1.503 -0.83 0 N-CA-C 108.369 -0.974 . . . . 10.0 108.369 -179.809 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 15.7 tp -80.49 121.9 26.34 Favored 'General case' 0 CA--C 1.51 -0.567 0 C-N-CA 118.141 -1.424 . . . . 10.0 113.606 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -113.34 88.13 2.76 Favored 'General case' 0 C--O 1.214 -0.79 0 N-CA-C 104.239 -2.504 . . . . 10.0 104.239 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.47 149.96 26.31 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-N 114.387 -1.278 . . . . 10.0 111.447 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 24.4 mtt180 -144.56 137.52 26.84 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 120.466 1.485 . . . . 10.0 114.237 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . 0.4 ' HB1' HD21 ' A' ' 23' ' ' LEU . . . -150.18 133.61 16.49 Favored 'General case' 0 CA--C 1.507 -0.701 0 N-CA-C 107.073 -1.454 . . . . 10.0 107.073 -179.84 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 40.74 44.73 1.93 Allowed 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 116.943 2.201 . . . . 10.0 116.943 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 91.95 -11.96 70.76 Favored Glycine 0 CA--C 1.533 1.201 0 O-C-N 120.711 -1.243 . . . . 10.0 115.935 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 92.7 t -90.28 154.74 3.13 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 N-CA-C 107.385 -1.339 . . . . 10.0 107.385 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 34.5 m -144.57 92.35 2.29 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-O 124.728 2.204 . . . . 10.0 111.062 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -79.93 144.18 33.58 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-N 112.847 -1.978 . . . . 10.0 106.615 -179.839 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.18 101.01 5.4 Favored 'General case' 0 CA--C 1.504 -0.818 0 O-C-N 125.127 1.517 . . . . 10.0 110.948 -179.806 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.79 156.47 18.02 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 122.715 1.245 . . . . 10.0 108.625 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 11.0 p -143.73 137.29 24.67 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-O 117.296 -1.335 . . . . 10.0 107.756 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . 0.668 ' CE2' ' CE3' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -138.61 -169.98 2.73 Favored 'General case' 0 C--N 1.315 -0.894 0 O-C-N 125.138 1.524 . . . . 10.0 108.751 -179.858 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . 0.287 16.3 tptp -142.97 129.43 20.08 Favored 'General case' 0 C--N 1.32 -0.714 0 O-C-N 119.362 -2.086 . . . . 10.0 105.962 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 11.5 mtpt -81.47 110.55 16.98 Favored 'General case' 0 CA--C 1.503 -0.84 0 CA-C-O 123.464 1.602 . . . . 10.0 111.856 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 2.5 t -92.53 -0.45 10.02 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 114.773 -1.103 . . . . 10.0 109.091 179.679 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 12.1 m80 . . . . . 0 N--CA 1.434 -1.271 0 CA-C-N 113.938 -1.483 . . . . 10.0 111.572 179.79 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.54 0.587 0 CA-C-O 122.738 1.256 . . . . 10.0 108.934 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -70.73 -33.71 71.12 Favored 'General case' 0 C--O 1.224 -0.26 0 C-N-CA 125.653 1.581 . . . . 10.0 112.363 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 30.1 t-20 -46.38 94.49 0.01 OUTLIER 'General case' 0 C--O 1.243 0.711 0 O-C-N 124.613 1.196 . . . . 10.0 111.305 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -148.96 -114.23 0.73 Allowed Glycine 0 N--CA 1.443 -0.859 0 N-CA-C 119.2 2.44 . . . . 10.0 119.2 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -155.64 -166.37 2.21 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 104.912 -2.255 . . . . 10.0 104.912 -179.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.464 ' NE1' ' CB ' ' A' ' 39' ' ' ASP 0.359 41.9 p90 -157.93 -170.44 3.16 Favored 'General case' 0 C--N 1.311 -1.077 0 C-N-CA 125.228 1.411 . . . . 10.0 113.966 -178.104 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.501 ' HE3' ' CG1' ' A' ' 133' ' ' VAL . 5.7 ttmt 166.19 98.95 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 111.733 -2.485 . . . . 10.0 109.07 176.676 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.49 ' HA ' ' CD1' ' A' ' 130' ' ' PHE . 0.0 OUTLIER -53.85 137.49 38.43 Favored 'General case' 0 N--CA 1.442 -0.836 0 N-CA-C 115.72 1.748 . . . . 10.0 115.72 -179.746 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -108.65 -55.53 2.38 Favored 'General case' 0 C--O 1.246 0.878 0 N-CA-C 108.394 -0.965 . . . . 10.0 108.394 -179.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -169.24 145.62 3.39 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 123.646 1.688 . . . . 10.0 115.337 -179.985 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -119.17 157.31 28.2 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 111.407 -2.633 . . . . 10.0 104.094 179.735 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -152.58 170.86 19.16 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 117.353 -1.308 . . . . 10.0 111.711 179.867 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 47.87 38.19 8.58 Favored 'General case' 0 C--O 1.243 0.738 0 O-C-N 125.063 1.477 . . . . 10.0 111.699 -179.855 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -76.0 -33.67 59.7 Favored 'General case' 0 C--N 1.34 0.178 0 CA-C-N 114.342 -1.299 . . . . 10.0 114.328 -179.546 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -77.08 -34.88 56.93 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 122.344 1.069 . . . . 10.0 112.557 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -76.89 -25.37 52.96 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 113.754 -1.566 . . . . 10.0 109.124 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.408 ' HA ' HG11 ' A' ' 124' ' ' VAL . 2.6 t80 -65.91 -44.29 85.63 Favored 'General case' 0 CA--C 1.55 0.948 0 O-C-N 126.122 2.139 . . . . 10.0 110.01 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.803 HD12 ' HG2' ' A' ' 30' ' ' ARG . 19.6 mt -76.37 -23.58 54.14 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 119.578 1.081 . . . . 10.0 112.825 -179.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.43 -25.56 67.58 Favored 'General case' 0 C--O 1.244 0.807 0 O-C-N 125.479 1.737 . . . . 10.0 109.001 -179.752 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.7 -45.06 72.62 Favored 'General case' 0 N--CA 1.466 0.341 0 O-C-N 124.829 1.331 . . . . 10.0 111.47 -179.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.9 mt -85.07 -15.85 42.62 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 120.018 -1.676 . . . . 10.0 112.115 -179.669 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 19.3 t0 65.79 70.93 0.43 Allowed 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 114.642 1.349 . . . . 10.0 114.642 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.628 HG21 HD23 ' A' ' 29' ' ' LEU . 0.9 OUTLIER -103.65 167.34 2.64 Favored 'Isoleucine or valine' 0 C--N 1.344 0.367 0 N-CA-C 108.996 -0.742 . . . . 10.0 108.996 -179.825 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -51.57 160.02 0.68 Allowed 'General case' 0 C--O 1.244 0.77 0 O-C-N 125.148 1.53 . . . . 10.0 114.331 -179.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 39.3 t -76.18 -25.54 16.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 115.038 1.495 . . . . 10.0 115.038 -179.762 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -74.81 -33.62 62.24 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 114.482 -1.235 . . . . 10.0 112.629 179.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.628 HD23 HG21 ' A' ' 25' ' ' VAL . 13.1 tp -68.75 -26.25 65.14 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 122.003 0.906 . . . . 10.0 112.737 179.782 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.803 ' HG2' HD12 ' A' ' 20' ' ' LEU . 0.0 OUTLIER -77.54 -22.21 51.43 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 113.395 -1.729 . . . . 10.0 113.682 179.869 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.9 tptm -73.13 -46.72 49.49 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 124.621 1.168 . . . . 10.0 110.195 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.449 HG21 ' CE2' ' A' ' 57' ' ' PHE . 5.8 mm -61.69 -57.29 12.77 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 O-C-N 125.531 1.769 . . . . 10.0 111.498 -179.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -48.87 -66.23 0.43 Allowed 'General case' 0 C--N 1.319 -0.725 0 O-C-N 126.524 2.39 . . . . 10.0 113.255 179.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -59.74 83.3 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.453 0 O-C-N 119.481 -2.012 . . . . 10.0 115.194 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.511 HD12 HD23 ' A' ' 36' ' ' LEU . 0.8 OUTLIER 159.69 -29.87 0.0 OUTLIER 'General case' 0 N--CA 1.445 -0.696 0 O-C-N 125.407 1.692 . . . . 10.0 109.61 179.95 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.511 HD23 HD12 ' A' ' 35' ' ' LEU . 35.0 mt -79.39 145.21 33.5 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 119.581 -0.848 . . . . 10.0 112.964 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.2 mttt -129.89 103.11 17.36 Favored Pre-proline 0 N--CA 1.466 0.346 0 N-CA-C 107.129 -1.434 . . . . 10.0 107.129 -179.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 0.2 OUTLIER -82.66 155.5 15.85 Favored 'Trans proline' 0 N--CA 1.448 -1.198 1 C-N-CA 126.599 4.866 . . . . 10.0 117.384 179.999 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.464 ' CB ' ' NE1' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -107.86 159.4 16.55 Favored 'General case' 0 C--N 1.313 -0.984 0 O-C-N 128.661 3.725 . . . . 10.0 106.538 179.752 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.418 ' HG3' ' CZ ' ' A' ' 130' ' ' PHE . 2.4 mtpm? -144.82 109.98 5.15 Favored 'General case' 0 N--CA 1.435 -1.197 0 C-N-CA 117.837 -1.545 . . . . 10.0 113.54 -179.543 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.429 ' OE1' HG23 ' A' ' 43' ' ' VAL . 1.0 OUTLIER -96.19 146.71 24.46 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 102.602 -3.11 . . . . 10.0 102.602 179.086 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 13.0 mt -132.26 139.44 50.11 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 O-C-N 124.902 1.376 . . . . 10.0 111.007 179.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.429 HG23 ' OE1' ' A' ' 41' ' ' GLU . 49.5 t -132.18 114.04 22.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 113.03 -1.896 . . . . 10.0 106.248 179.742 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.448 ' HG2' ' CG ' ' A' ' 49' ' ' MET . 0.0 OUTLIER -115.86 135.17 54.25 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 108.043 -1.095 . . . . 10.0 108.043 179.603 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -142.52 101.29 3.85 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 107.148 -1.426 . . . . 10.0 107.148 -179.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 61.14 -121.33 26.09 Favored Glycine 0 C--O 1.243 0.717 0 CA-C-O 123.154 1.419 . . . . 10.0 110.228 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -103.01 37.49 1.95 Allowed 'General case' 0 N--CA 1.472 0.668 0 O-C-N 121.907 -0.761 . . . . 10.0 109.259 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 20.5 m80 -147.39 129.35 15.38 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 106.955 -1.498 . . . . 10.0 106.955 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.561 ' HE1' HD11 ' A' ' 93' ' ' LEU . 2.6 ttm -133.89 158.11 44.27 Favored 'General case' 0 C--O 1.215 -0.728 0 N-CA-C 114.279 1.215 . . . . 10.0 114.279 179.802 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.401 ' N ' ' HG2' ' A' ' 49' ' ' MET . 35.1 mt -134.19 136.48 53.25 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.98 0 N-CA-C 105.191 -2.152 . . . . 10.0 105.191 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.2 mp -122.18 143.86 33.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 N-CA-C 104.528 -2.397 . . . . 10.0 104.528 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 5.1 mtt180 -133.37 109.96 9.71 Favored 'General case' 0 C--O 1.212 -0.913 0 O-C-N 125.79 1.932 . . . . 10.0 115.295 -179.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.9 m -90.23 125.14 35.38 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 100.554 -3.869 . . . . 10.0 100.554 -179.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -120.2 33.56 5.55 Favored 'General case' 0 C--N 1.319 -0.723 1 N-CA-C 122.555 4.28 . . . . 10.0 122.555 -179.631 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 43.0 t -69.45 177.86 2.7 Favored 'General case' 0 C--N 1.323 -0.572 0 O-C-N 120.143 -1.598 . . . . 10.0 107.046 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.5 m -108.61 64.36 0.61 Allowed 'General case' 0 C--N 1.328 -0.356 0 O-C-N 125.819 1.949 . . . . 10.0 112.05 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.449 ' CE2' HG21 ' A' ' 32' ' ' ILE . 0.8 OUTLIER -173.47 -62.23 0.02 OUTLIER 'General case' 0 C--N 1.347 0.475 0 CA-C-N 113.758 -1.565 . . . . 10.0 107.504 -179.891 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 5.6 mtp180 -118.81 110.4 17.17 Favored 'General case' 0 C--N 1.328 -0.345 0 O-C-N 124.569 1.168 . . . . 10.0 112.412 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -114.71 91.44 3.62 Favored 'General case' 0 C--N 1.327 -0.381 0 O-C-N 124.807 1.317 . . . . 10.0 112.258 -179.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.563 ' C ' HD12 ' A' ' 61' ' ' ILE . 54.4 p90 -110.82 134.22 52.7 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 103.07 -2.937 . . . . 10.0 103.07 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.563 HD12 ' C ' ' A' ' 60' ' ' TYR . 1.4 mp -112.11 158.18 12.63 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.362 0 O-C-N 123.98 0.8 . . . . 10.0 111.912 179.801 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 1.2 mmm -134.93 152.0 51.35 Favored 'General case' 0 C--N 1.322 -0.614 0 O-C-N 125.056 1.472 . . . . 10.0 107.517 179.774 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -134.38 90.44 2.67 Favored 'General case' 0 C--N 1.309 -1.156 0 N-CA-C 102.182 -3.266 . . . . 10.0 102.182 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -81.88 171.06 14.92 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 117.106 2.262 . . . . 10.0 117.106 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.98 93.09 2.21 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 103.812 -2.662 . . . . 10.0 103.812 -179.78 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.437 ' CG1' ' HB2' ' A' ' 88' ' ' TRP . 22.6 t -49.47 145.53 1.22 Allowed 'Isoleucine or valine' 0 C--O 1.246 0.901 0 CA-C-N 114.439 -1.255 . . . . 10.0 109.407 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 69.78 -3.17 9.84 Favored Glycine 0 C--O 1.213 -1.205 0 N-CA-C 116.571 1.389 . . . . 10.0 116.571 179.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.5 tttt -109.9 146.94 34.3 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 119.212 1.506 . . . . 10.0 111.846 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.36 164.98 3.87 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 107.479 -1.304 . . . . 10.0 107.479 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -166.96 117.32 0.89 Allowed 'General case' 0 N--CA 1.439 -1.006 0 O-C-N 124.629 1.206 . . . . 10.0 113.473 -179.79 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -76.89 154.1 34.06 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 117.454 -1.698 . . . . 10.0 106.722 -179.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -140.92 72.37 1.39 Allowed 'General case' 0 C--O 1.22 -0.494 0 N-CA-C 115.537 1.68 . . . . 10.0 115.537 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -78.22 121.51 24.47 Favored 'General case' 0 N--CA 1.439 -0.977 0 N-CA-C 106.552 -1.647 . . . . 10.0 106.552 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 5.7 mt -110.96 67.79 0.65 Allowed 'General case' 0 C--N 1.318 -0.777 0 O-C-N 126.628 2.455 . . . . 10.0 114.692 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 1.4 p -88.44 66.39 8.26 Favored 'General case' 0 C--O 1.241 0.635 0 N-CA-C 105.527 -2.027 . . . . 10.0 105.527 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -156.25 -43.46 0.02 OUTLIER Glycine 0 C--O 1.241 0.583 0 C-N-CA 117.608 -2.234 . . . . 10.0 112.318 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 55.4 mt -113.5 -29.66 2.25 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.912 0 CA-C-N 119.257 1.529 . . . . 10.0 110.96 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -145.67 15.09 1.41 Allowed 'General case' 0 C--O 1.239 0.506 0 N-CA-C 114.053 1.131 . . . . 10.0 114.053 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 38.27 83.34 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 115.253 1.575 . . . . 10.0 115.253 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -141.49 -176.08 4.6 Favored 'General case' 0 C--N 1.316 -0.876 0 O-C-N 127.344 2.903 . . . . 10.0 111.965 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.14 156.82 27.34 Favored 'General case' 0 N--CA 1.445 -0.707 0 N-CA-C 103.656 -2.72 . . . . 10.0 103.656 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 1.5 p -166.84 -176.8 3.58 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 106.08 -1.822 . . . . 10.0 106.08 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 33.0 mtp -127.66 95.63 4.29 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 100.243 -3.984 . . . . 10.0 100.243 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 59.6 m -95.87 139.3 32.28 Favored 'General case' 0 CA--C 1.513 -0.471 0 N-CA-C 117.149 2.277 . . . . 10.0 117.149 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 19.8 m -133.21 97.47 3.99 Favored 'General case' 0 N--CA 1.437 -1.122 0 N-CA-C 106.89 -1.522 . . . . 10.0 106.89 179.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 2.5 t -76.64 97.87 1.71 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.466 0 N-CA-C 104.657 -2.349 . . . . 10.0 104.657 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.0 t -89.7 170.39 10.49 Favored 'General case' 0 C--N 1.316 -0.857 0 O-C-N 124.946 1.404 . . . . 10.0 108.959 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . 0.437 ' HB2' ' CG1' ' A' ' 66' ' ' VAL . 5.8 t90 -123.88 96.7 5.05 Favored 'General case' 0 C--O 1.24 0.579 0 N-CA-C 107.203 -1.406 . . . . 10.0 107.203 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -57.3 -64.51 0.86 Allowed 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 103.433 -2.803 . . . . 10.0 103.433 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 141.88 115.1 1.11 Allowed Glycine 0 CA--C 1.499 -0.914 0 N-CA-C 103.973 -3.651 . . . . 10.0 103.973 179.79 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 20.1 t0 87.9 -30.83 0.04 OUTLIER 'General case' 0 N--CA 1.448 -0.55 0 O-C-N 125.894 1.585 . . . . 10.0 109.834 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 8.5 mtmt -125.06 139.82 53.46 Favored 'General case' 0 C--N 1.32 -0.682 0 O-C-N 121.215 -0.928 . . . . 10.0 110.239 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.561 HD11 ' HE1' ' A' ' 49' ' ' MET . 0.4 OUTLIER -91.04 108.38 19.83 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 103.107 -2.923 . . . . 10.0 103.107 -179.899 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -121.29 138.64 54.15 Favored 'General case' 0 C--O 1.216 -0.706 0 O-C-N 125.136 1.522 . . . . 10.0 114.077 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 19.3 p -138.42 152.75 48.64 Favored 'General case' 0 C--N 1.321 -0.667 0 O-C-N 125.022 1.451 . . . . 10.0 108.396 -179.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 2.9 t -109.66 -54.83 5.3 Favored 'Isoleucine or valine' 0 C--O 1.247 0.922 0 N-CA-C 107.143 -1.429 . . . . 10.0 107.143 179.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.406 ' CG ' ' HB3' ' A' ' 104' ' ' ARG . 0.0 OUTLIER 71.08 111.99 0.06 Allowed 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 123.802 1.763 . . . . 10.0 109.263 179.926 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.33 67.2 7.18 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-O 123.578 1.656 . . . . 10.0 115.012 179.711 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -92.04 147.91 18.95 Favored Glycine 0 C--O 1.218 -0.86 0 N-CA-C 107.754 -2.138 . . . . 10.0 107.754 179.759 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -48.38 -25.99 1.86 Allowed 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 116.993 2.22 . . . . 10.0 116.993 179.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.55 -158.56 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.804 0 CA-C-N 119.788 1.176 . . . . 10.0 113.688 179.799 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -117.01 -24.93 7.38 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 126.186 1.795 . . . . 10.0 114.0 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -117.0 10.58 15.26 Favored Glycine 0 C--N 1.342 0.865 0 N-CA-C 116.757 1.463 . . . . 10.0 116.757 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.406 ' HB3' ' CG ' ' A' ' 97' ' ' GLN . 24.2 mmm-85 -55.34 143.16 29.4 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 119.031 1.416 . . . . 10.0 113.404 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 120.07 146.02 7.59 Favored Glycine 0 C--O 1.217 -0.922 0 O-C-N 124.576 1.173 . . . . 10.0 111.376 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -124.96 176.34 6.72 Favored 'General case' 0 CA--C 1.509 -0.623 0 O-C-N 120.854 -1.38 . . . . 10.0 109.961 179.871 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 76.7 m -145.74 132.74 20.27 Favored 'General case' 0 CA--C 1.509 -0.63 0 CA-C-O 118.799 -0.62 . . . . 10.0 109.593 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -123.92 126.58 46.61 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 123.929 0.891 . . . . 10.0 111.741 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 8.5 p90 -145.4 149.34 34.56 Favored 'General case' 0 C--O 1.213 -0.848 0 C-N-CA 124.301 1.04 . . . . 10.0 110.919 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 44.1 mt -89.82 147.18 5.38 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 O-C-N 125.541 1.776 . . . . 10.0 114.81 -179.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -131.74 75.05 1.62 Allowed 'General case' 0 C--O 1.24 0.589 0 N-CA-C 107.047 -1.464 . . . . 10.0 107.047 179.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 43.53 81.73 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.544 0 CA-C-O 118.176 -1.346 . . . . 10.0 110.71 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 71.15 23.78 4.04 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 118.277 -0.868 . . . . 10.0 110.947 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -143.0 103.1 4.12 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 114.774 1.398 . . . . 10.0 114.774 -179.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.437 ' CB ' ' HB2' ' A' ' 130' ' ' PHE . 0.8 OUTLIER -63.18 123.89 19.78 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 103.86 -2.644 . . . . 10.0 103.86 -179.97 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . 0.466 ' CE1' HG22 ' A' ' 129' ' ' VAL . 3.4 t-160 -134.32 99.43 4.38 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 106.906 -1.516 . . . . 10.0 106.906 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 13.8 tp -89.23 149.22 23.2 Favored 'General case' 0 C--N 1.314 -0.935 0 O-C-N 125.665 1.853 . . . . 10.0 113.43 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -133.96 124.09 25.74 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 104.999 -2.223 . . . . 10.0 104.999 -179.856 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.01 131.77 53.36 Favored 'General case' 0 C--N 1.319 -0.757 0 O-C-N 120.834 -1.166 . . . . 10.0 108.423 -179.693 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 77.2 mtm-85 -125.88 145.66 50.16 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 122.568 1.175 . . . . 10.0 110.49 179.712 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -153.62 115.04 4.18 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 106.465 -1.68 . . . . 10.0 106.465 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 45.95 57.08 5.43 Favored 'General case' 0 C--O 1.245 0.843 0 O-C-N 126.154 2.159 . . . . 10.0 116.697 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 87.69 -22.18 18.64 Favored Glycine 0 CA--C 1.534 1.278 0 N-CA-C 116.543 1.377 . . . . 10.0 116.543 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.408 HG11 ' HA ' ' A' ' 19' ' ' TYR . 2.6 t -75.64 151.73 6.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 CA-C-N 119.478 1.639 . . . . 10.0 109.556 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' THR . . . . . 0.479 ' O ' HG22 ' A' ' 125' ' ' THR . 12.8 m -136.56 86.12 2.19 Favored 'General case' 0 C--N 1.318 -0.782 0 O-C-N 124.473 1.108 . . . . 10.0 110.811 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 30.6 p -98.66 154.48 17.92 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 112.337 -2.21 . . . . 10.0 105.062 -179.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.01 146.38 27.75 Favored 'General case' 0 C--O 1.221 -0.445 0 CA-C-O 123.374 1.559 . . . . 10.0 114.397 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -113.11 124.58 52.9 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 114.035 -1.439 . . . . 10.0 111.133 179.902 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.466 HG22 ' CE1' ' A' ' 116' ' ' HIS . 55.2 t -105.57 138.4 30.86 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.82 0 CA-C-N 113.41 -1.723 . . . . 10.0 107.203 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . 0.49 ' CD1' ' HA ' ' A' ' 10' ' ' MET . 15.3 m-85 -128.93 -177.68 4.31 Favored 'General case' 0 C--O 1.215 -0.72 0 C-N-CA 124.996 1.319 . . . . 10.0 110.452 -179.619 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.416 ' CB ' ' HD2' ' A' ' 9' ' ' LYS . 0.0 OUTLIER -134.1 99.37 4.39 Favored 'General case' 0 C--O 1.24 0.597 0 CA-C-N 113.972 -1.467 . . . . 10.0 107.454 179.852 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -68.07 98.3 0.76 Allowed 'General case' 0 CA--C 1.508 -0.659 0 C-N-CA 117.345 -1.742 . . . . 10.0 107.623 179.888 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' VAL . . . . . 0.501 ' CG1' ' HE3' ' A' ' 9' ' ' LYS . 20.2 m -76.15 -4.26 5.95 Favored 'Isoleucine or valine' 0 C--O 1.241 0.62 0 C-N-CA 118.689 -1.204 . . . . 10.0 112.574 -179.696 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 66.5 t-80 . . . . . 0 C--N 1.325 -0.493 0 O-C-N 125.623 1.827 . . . . 10.0 111.751 179.766 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . 0.4 ' O ' ' N ' ' A' ' 5' ' ' ASN . 0.4 OUTLIER . . . . . 0 C--O 1.216 -0.661 0 N-CA-C 110.859 -0.052 . . . . 10.0 110.859 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.468 ' CE1' HD12 ' A' ' 93' ' ' LEU . 43.1 m-85 62.72 -67.11 0.08 Allowed 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 115.968 1.84 . . . . 10.0 115.968 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.4 ' N ' ' O ' ' A' ' 3' ' ' ASP . 0.1 OUTLIER -49.64 149.05 2.58 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.1 0.96 . . . . 10.0 111.854 179.981 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 170.15 -61.9 0.18 Allowed Glycine 0 N--CA 1.438 -1.203 0 O-C-N 125.082 1.489 . . . . 10.0 116.386 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -177.18 -166.65 0.14 Allowed 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 102.805 -3.035 . . . . 10.0 102.805 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.622 ' CZ3' ' HB3' ' A' ' 39' ' ' ASP 0.257 0.5 OUTLIER -153.36 -44.57 0.09 Allowed 'General case' 0 N--CA 1.442 -0.857 0 CA-C-O 116.663 -1.637 . . . . 10.0 115.108 -178.036 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.465 ' HA ' ' CE3' ' A' ' 8' ' ' TRP . 1.3 pttt 12.46 98.94 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.001 1 O-C-N 129.45 4.218 . . . . 10.0 111.859 -177.201 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.72 157.58 17.5 Favored 'General case' 0 N--CA 1.441 -0.878 0 O-C-N 118.087 -2.883 . . . . 10.0 116.058 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.421 ' HA ' HD22 ' A' ' 11' ' ' LEU . 0.2 OUTLIER -111.89 -51.01 2.88 Favored 'General case' 0 C--O 1.245 0.859 0 CA-C-N 112.703 -2.044 . . . . 10.0 107.311 -179.692 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.1 p -146.45 -172.9 4.06 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 115.51 1.67 . . . . 10.0 115.51 179.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -169.16 133.84 1.48 Allowed 'General case' 0 C--O 1.22 -0.497 0 O-C-N 126.92 2.638 . . . . 10.0 106.961 -179.621 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -155.39 159.4 39.86 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-O 122.38 1.086 . . . . 10.0 111.497 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.453 ' HB3' ' HA ' ' A' ' 126' ' ' CYS . 0.9 OUTLIER 72.16 5.7 5.37 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 116.103 1.89 . . . . 10.0 116.103 179.983 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -57.58 -23.75 52.48 Favored 'General case' 0 CA--C 1.551 0.991 0 N-CA-C 115.054 1.501 . . . . 10.0 115.054 179.577 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -79.54 -41.54 27.07 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-O 123.979 1.847 . . . . 10.0 110.762 -179.757 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.99 -27.2 63.53 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 122.486 1.136 . . . . 10.0 110.343 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -67.84 -58.11 5.14 Favored 'General case' 0 C--O 1.242 0.706 0 C-N-CA 124.521 1.128 . . . . 10.0 108.951 -179.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.444 HD13 ' HB2' ' A' ' 30' ' ' ARG . 0.3 OUTLIER -67.59 -22.49 65.37 Favored 'General case' 0 C--O 1.211 -0.93 0 O-C-N 120.034 -1.666 . . . . 10.0 111.491 179.573 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.7 ttm-85 -75.4 -35.0 61.11 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 106.866 -1.531 . . . . 10.0 106.866 -179.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.14 -44.67 91.45 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 127.123 2.764 . . . . 10.0 112.435 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 26.5 mt -78.33 -34.15 48.75 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 125.493 1.517 . . . . 10.0 112.02 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 80.64 48.33 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.108 0 O-C-N 127.011 2.694 . . . . 10.0 113.529 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 27.9 m -82.85 164.46 2.77 Favored 'Isoleucine or valine' 0 C--O 1.242 0.71 0 O-C-N 124.996 1.435 . . . . 10.0 107.141 -179.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 9.0 m-20 -36.71 148.37 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.436 0 O-C-N 125.778 1.923 . . . . 10.0 115.213 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -70.63 -35.68 62.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 116.412 2.005 . . . . 10.0 116.412 -179.67 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -72.53 -21.06 61.23 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 123.517 1.627 . . . . 10.0 110.851 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.89 -41.96 77.59 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 119.31 -2.119 . . . . 10.0 111.733 179.632 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.444 ' HB2' HD13 ' A' ' 20' ' ' LEU . 15.8 ttp180 -56.5 -36.41 69.12 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 127.016 2.126 . . . . 10.0 113.51 179.695 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.8 tmtp? -68.53 -38.79 81.14 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 112.855 -1.975 . . . . 10.0 111.234 179.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 66.8 mt -75.36 -58.84 3.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 114.035 -1.439 . . . . 10.0 109.94 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -48.98 -31.97 8.35 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 116.335 1.976 . . . . 10.0 116.335 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -65.68 -18.24 65.18 Favored 'General case' 0 CA--C 1.516 -0.332 0 O-C-N 125.084 1.49 . . . . 10.0 110.888 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 53.1 mt -105.96 -7.38 18.17 Favored 'General case' 0 N--CA 1.448 -0.552 0 O-C-N 125.358 1.661 . . . . 10.0 113.44 -179.544 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -96.26 154.69 17.12 Favored 'General case' 0 C--O 1.219 -0.525 0 N-CA-C 114.203 1.186 . . . . 10.0 114.203 179.754 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 3.6 mtmt -139.93 100.32 7.29 Favored Pre-proline 0 C--N 1.327 -0.413 0 N-CA-C 104.717 -2.327 . . . . 10.0 104.717 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_exo -70.02 167.47 24.7 Favored 'Trans proline' 0 C--O 1.24 0.6 1 C-N-CA 125.74 4.293 . . . . 10.0 116.322 -179.711 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.622 ' HB3' ' CZ3' ' A' ' 8' ' ' TRP . 2.9 p30 -124.71 166.72 15.66 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 106.207 -1.775 . . . . 10.0 106.207 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.94 90.04 1.43 Allowed 'General case' 0 N--CA 1.434 -1.254 0 CA-C-O 122.93 1.348 . . . . 10.0 112.848 179.903 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.405 ' HA ' ' CD1' ' A' ' 8' ' ' TRP . 15.4 tt0 -85.72 103.94 14.97 Favored 'General case' 0 N--CA 1.442 -0.859 0 N-CA-C 105.232 -2.136 . . . . 10.0 105.232 179.825 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 10.2 mt -91.28 146.56 6.08 Favored 'Isoleucine or valine' 0 C--O 1.248 0.979 0 CA-C-N 113.691 -1.595 . . . . 10.0 109.384 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -151.44 121.53 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.817 0 CA-C-O 123.875 1.798 . . . . 10.0 109.466 -179.849 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.11 147.42 40.24 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 119.31 -2.119 . . . . 10.0 110.969 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -131.74 73.74 1.55 Allowed 'General case' 0 C--O 1.225 -0.217 0 CA-C-O 124.387 2.041 . . . . 10.0 106.375 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 88.81 -117.1 4.79 Favored Glycine 0 CA--C 1.533 1.189 0 N-CA-C 107.381 -2.288 . . . . 10.0 107.381 179.596 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -91.83 -13.83 30.77 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 118.142 -1.423 . . . . 10.0 108.062 -179.898 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 45.4 t-80 -81.01 138.38 36.04 Favored 'General case' 0 CA--C 1.518 -0.272 0 O-C-N 120.831 -1.168 . . . . 10.0 108.262 179.641 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 3.1 ttt -134.78 142.1 46.61 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.45 1.094 . . . . 10.0 110.923 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 8.8 mt -127.02 124.48 64.61 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.682 0 N-CA-C 106.573 -1.64 . . . . 10.0 106.573 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.438 ' CD1' ' N ' ' A' ' 51' ' ' ILE . 0.3 OUTLIER -106.84 100.17 10.11 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.901 0 N-CA-C 106.939 -1.504 . . . . 10.0 106.939 179.686 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.693 ' HG2' HD12 ' A' ' 61' ' ' ILE . 0.0 OUTLIER -93.58 127.55 39.3 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-O 122.136 0.969 . . . . 10.0 111.107 -179.868 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 57.5 m -106.69 121.43 44.33 Favored 'General case' 0 C--O 1.219 -0.507 0 N-CA-C 102.789 -3.041 . . . . 10.0 102.789 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.42 ' HB2' ' CG ' ' A' ' 39' ' ' ASP . 5.2 mp -104.1 58.05 0.72 Allowed 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 119.57 3.174 . . . . 10.0 119.57 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.8 t -83.36 172.53 12.41 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 104.475 -2.417 . . . . 10.0 104.475 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 9.6 t -106.09 -39.4 5.98 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.874 0.845 . . . . 10.0 109.648 179.873 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 48.1 m-85 -72.38 -21.8 61.23 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 116.949 -1.501 . . . . 10.0 108.12 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.448 ' NE ' HD11 ' A' ' 77' ' ' ILE . 18.7 ptt-85 -151.7 -170.84 3.76 Favored 'General case' 0 C--N 1.328 -0.361 0 O-C-N 126.678 2.486 . . . . 10.0 111.698 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -179.51 82.21 0.01 OUTLIER 'General case' 0 C--O 1.243 0.733 0 CA-C-N 114.479 -1.237 . . . . 10.0 111.257 -179.624 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.413 ' CD1' ' O ' ' A' ' 60' ' ' TYR . 0.1 OUTLIER -93.22 127.84 38.95 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 124.991 2.329 . . . . 10.0 106.797 -179.702 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.693 HD12 ' HG2' ' A' ' 52' ' ' ARG . 17.9 mm -108.67 137.69 39.29 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.818 0 O-C-N 118.201 -2.812 . . . . 10.0 111.001 -179.746 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 20.4 mtm -110.66 162.83 14.36 Favored 'General case' 0 CA--C 1.515 -0.37 0 O-C-N 126.411 2.32 . . . . 10.0 108.983 179.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -144.48 78.3 1.57 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 102.126 -3.287 . . . . 10.0 102.126 179.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 1.9 m-30 -85.53 125.11 32.82 Favored 'General case' 0 N--CA 1.445 -0.699 0 O-C-N 126.045 2.091 . . . . 10.0 114.657 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 25.8 tt0 -105.72 139.55 40.14 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 111.94 -2.391 . . . . 10.0 105.703 -179.821 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.574 HG21 ' CD1' ' A' ' 88' ' ' TRP . 0.3 OUTLIER -93.85 121.25 44.34 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-O 123.726 1.727 . . . . 10.0 108.67 -179.79 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 97.56 -12.74 64.62 Favored Glycine 0 C--O 1.213 -1.212 0 O-C-N 120.422 -1.423 . . . . 10.0 113.993 179.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.77 138.98 41.06 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 115.948 1.832 . . . . 10.0 115.948 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -80.16 135.95 36.4 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-O 122.317 1.056 . . . . 10.0 110.579 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -116.12 167.63 10.82 Favored 'General case' 0 C--O 1.248 1.0 0 CA-C-O 118.256 -0.878 . . . . 10.0 110.263 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 19.8 tt0 -137.44 82.63 1.94 Allowed 'General case' 0 C--N 1.317 -0.828 0 O-C-N 125.89 1.994 . . . . 10.0 108.443 -179.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -73.18 133.59 44.1 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 116.677 2.103 . . . . 10.0 116.677 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -104.46 -13.8 15.93 Favored 'General case' 0 C--O 1.221 -0.414 0 N-CA-C 106.372 -1.714 . . . . 10.0 106.372 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.43 HD12 ' HA ' ' A' ' 74' ' ' LEU . 0.9 OUTLIER 61.09 -84.36 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 118.812 -0.613 . . . . 10.0 112.066 -179.984 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 29.4 m 55.05 60.8 3.24 Favored 'General case' 0 C--N 1.32 -0.704 0 O-C-N 126.169 2.168 . . . . 10.0 108.682 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 172.26 137.47 2.35 Favored Glycine 0 N--CA 1.44 -1.056 0 O-C-N 126.886 2.616 . . . . 10.0 108.123 -179.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.448 HD11 ' NE ' ' A' ' 58' ' ' ARG . 11.3 mt 72.46 -64.91 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 N-CA-C 104.21 -2.515 . . . . 10.0 104.21 179.902 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -107.52 -80.05 0.57 Allowed 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 117.017 -1.468 . . . . 10.0 112.186 -179.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 21.1 p-10 122.39 28.83 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.699 0 O-C-N 128.203 3.439 . . . . 10.0 117.779 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.95 164.48 13.63 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 123.081 1.419 . . . . 10.0 111.096 179.614 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 38.3 mttt -114.74 179.16 4.03 Favored 'General case' 0 CA--C 1.509 -0.606 0 O-C-N 119.72 -1.862 . . . . 10.0 107.805 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 5.6 p 175.79 170.67 0.37 Allowed 'General case' 0 CA--C 1.503 -0.848 0 CA-C-O 123.288 1.518 . . . . 10.0 110.475 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -117.55 108.72 15.83 Favored 'General case' 0 N--CA 1.443 -0.824 0 N-CA-C 100.692 -3.818 . . . . 10.0 100.692 179.629 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 3.0 m -115.1 150.25 36.26 Favored 'General case' 0 CA--C 1.499 -1.019 0 N-CA-C 118.608 2.818 . . . . 10.0 118.608 -179.348 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 2.8 m -142.5 114.4 8.12 Favored 'General case' 0 CA--C 1.5 -0.967 0 CA-C-N 114.249 -1.341 . . . . 10.0 108.613 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 5.6 t -89.22 136.08 24.37 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 N-CA-C 101.591 -3.485 . . . . 10.0 101.591 -179.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 46.9 t -134.48 176.24 8.8 Favored 'General case' 0 N--CA 1.444 -0.728 0 O-C-N 124.989 1.43 . . . . 10.0 109.358 -179.772 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . 0.574 ' CD1' HG21 ' A' ' 66' ' ' VAL . 0.0 OUTLIER -125.96 92.13 3.53 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 104.495 -2.409 . . . . 10.0 104.495 -179.995 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -87.52 83.56 7.25 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 100.885 -3.746 . . . . 10.0 100.885 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 62.9 -105.62 1.06 Allowed Glycine 0 C--O 1.237 0.3 0 N-CA-C 106.456 -2.658 . . . . 10.0 106.456 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -114.33 60.62 0.67 Allowed 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 114.123 -1.038 . . . . 10.0 112.133 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 7.3 mtmt -158.83 139.08 12.27 Favored 'General case' 0 C--O 1.24 0.595 0 O-C-N 120.441 -1.412 . . . . 10.0 110.191 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.468 HD12 ' CE1' ' A' ' 4' ' ' PHE . 0.2 OUTLIER -95.47 94.58 7.88 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 105.931 -1.877 . . . . 10.0 105.931 179.91 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -104.03 137.81 41.46 Favored 'General case' 0 CA--C 1.506 -0.741 0 O-C-N 126.215 2.197 . . . . 10.0 110.519 179.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 19.1 m -142.89 129.16 19.89 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 126.655 2.472 . . . . 10.0 113.678 -179.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 96.2 t -116.28 122.98 70.91 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 N-CA-C 105.583 -2.006 . . . . 10.0 105.583 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -105.6 107.72 18.87 Favored 'General case' 0 C--O 1.238 0.452 0 O-C-N 125.783 1.927 . . . . 10.0 107.994 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 40.3 tttt -87.22 120.74 28.82 Favored 'General case' 0 C--O 1.221 -0.419 0 C-N-CA 120.088 -0.645 . . . . 10.0 112.453 179.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -143.22 -151.28 5.45 Favored Glycine 0 N--CA 1.447 -0.577 0 CA-C-O 123.252 1.473 . . . . 10.0 110.302 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -81.22 -1.49 45.02 Favored 'General case' 0 C--O 1.243 0.723 0 O-C-N 119.917 -1.931 . . . . 10.0 114.576 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.415 ' HB2' ' HG2' ' A' ' 104' ' ' ARG . 14.2 mttp -93.37 -166.72 1.57 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 124.599 2.142 . . . . 10.0 113.486 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -132.96 30.97 3.94 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 114.015 -1.448 . . . . 10.0 112.074 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 177.51 33.63 0.05 OUTLIER Glycine 0 N--CA 1.443 -0.861 0 CA-C-O 116.835 -2.092 . . . . 10.0 118.118 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.415 ' HG2' ' HB2' ' A' ' 101' ' ' LYS . 0.0 OUTLIER -95.37 135.86 36.46 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 119.168 1.484 . . . . 10.0 109.304 179.732 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 148.17 148.16 4.69 Favored Glycine 0 N--CA 1.446 -0.686 0 N-CA-C 109.25 -1.54 . . . . 10.0 109.25 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -116.03 -178.67 3.46 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 117.538 0.669 . . . . 10.0 110.057 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.1 m -158.49 126.92 5.35 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 105.068 -2.197 . . . . 10.0 105.068 179.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.658 ' CD ' HD21 ' A' ' 115' ' ' LEU . 0.8 OUTLIER -110.35 127.97 55.33 Favored 'General case' 0 C--O 1.219 -0.503 0 O-C-N 125.908 2.005 . . . . 10.0 110.306 -179.839 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 1.6 t-105 -135.54 146.39 48.0 Favored 'General case' 0 C--O 1.214 -0.801 0 N-CA-C 107.465 -1.309 . . . . 10.0 107.465 -179.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 17.7 mt -113.81 116.89 53.92 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 N-CA-C 117.662 2.468 . . . . 10.0 117.662 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -81.72 179.17 7.94 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 112.595 -2.093 . . . . 10.0 106.321 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -52.51 99.57 0.04 OUTLIER Glycine 0 C--O 1.221 -0.715 0 N-CA-C 108.375 -1.89 . . . . 10.0 108.375 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 53.75 30.64 11.52 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 123.62 1.676 . . . . 10.0 112.848 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -146.77 109.96 4.76 Favored 'General case' 0 CA--C 1.502 -0.894 0 CA-C-O 124.925 2.297 . . . . 10.0 113.409 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.658 HD21 ' CD ' ' A' ' 108' ' ' GLN . 2.6 tm? -74.92 131.19 40.51 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 104.315 -2.476 . . . . 10.0 104.315 -179.849 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 9.3 t-160 -128.41 91.11 3.18 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 107.725 -1.213 . . . . 10.0 107.725 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.612 ' C ' HD23 ' A' ' 117' ' ' LEU . 6.5 tt -95.19 142.77 27.24 Favored 'General case' 0 N--CA 1.44 -0.953 0 O-C-N 124.759 1.287 . . . . 10.0 111.498 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.574 ' N ' HD23 ' A' ' 117' ' ' LEU . 16.2 pm0 -128.56 133.91 48.5 Favored 'General case' 0 C--O 1.216 -0.708 0 N-CA-C 108.011 -1.107 . . . . 10.0 108.011 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 48.1 mtt -112.62 162.02 16.16 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-O 123.366 1.555 . . . . 10.0 108.164 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 2.7 mtm180 -158.65 148.5 19.47 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 113.952 -1.476 . . . . 10.0 109.49 179.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . 0.635 ' O ' HG22 ' A' ' 124' ' ' VAL . . . -171.17 122.34 0.56 Allowed 'General case' 0 CA--C 1.504 -0.801 0 O-C-N 123.588 0.555 . . . . 10.0 109.766 179.595 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 61.34 31.6 19.25 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 126.306 1.843 . . . . 10.0 114.486 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 97.9 -15.38 61.77 Favored Glycine 0 CA--C 1.536 1.404 0 CA-C-O 117.032 -1.982 . . . . 10.0 116.792 -179.702 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.635 HG22 ' O ' ' A' ' 121' ' ' ALA . 19.8 m -94.73 -179.78 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 CA-C-N 119.171 1.485 . . . . 10.0 111.003 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 1.1 m -149.93 133.89 16.99 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 122.19 0.995 . . . . 10.0 113.213 179.819 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . 0.453 ' HA ' ' HB3' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -123.12 142.39 50.93 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 105.126 -2.176 . . . . 10.0 105.126 179.911 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.26 145.86 36.09 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 114.176 1.176 . . . . 10.0 114.176 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.09 109.19 10.29 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 113.951 -1.477 . . . . 10.0 111.984 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 84.8 t -72.27 123.06 26.04 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 N-CA-C 105.142 -2.17 . . . . 10.0 105.142 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . 0.441 ' HB2' HD12 ' A' ' 115' ' ' LEU . 2.7 m-85 -103.25 161.97 13.37 Favored 'General case' 0 C--N 1.316 -0.866 0 C-N-CA 124.685 1.194 . . . . 10.0 108.73 -179.656 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -137.61 102.71 4.83 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 122.449 1.118 . . . . 10.0 108.217 -179.734 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.27 128.22 35.47 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-O 122.155 0.979 . . . . 10.0 110.253 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 1.3 t -101.38 -21.65 5.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 C-N-CA 124.641 1.176 . . . . 10.0 109.486 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 54.7 t60 . . . . . 0 C--O 1.251 1.164 0 O-C-N 124.746 1.279 . . . . 10.0 114.11 -179.985 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.24 0.571 0 CA-C-O 118.981 -0.533 . . . . 10.0 111.033 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -98.19 -20.77 17.09 Favored 'General case' 0 C--O 1.24 0.602 0 N-CA-C 115.687 1.736 . . . . 10.0 115.687 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -56.3 116.77 3.25 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 117.061 -1.447 . . . . 10.0 112.03 -179.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -132.22 -158.78 9.09 Favored Glycine 0 CA--C 1.534 1.227 0 CA-C-O 123.193 1.441 . . . . 10.0 115.681 -179.842 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.692 ' O ' HG12 ' A' ' 133' ' ' VAL . 0.3 OUTLIER -160.57 82.76 0.68 Allowed 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 100.377 -3.934 . . . . 10.0 100.377 179.97 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.649 ' CG ' ' N ' ' A' ' 9' ' ' LYS 0.284 0.2 OUTLIER -61.32 -160.09 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 127.106 2.163 . . . . 10.0 111.941 -179.706 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.649 ' N ' ' CG ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER 153.09 74.4 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.611 0 O-C-N 126.295 2.247 . . . . 10.0 106.174 176.539 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 27.9 ttm -36.26 139.89 0.15 Allowed 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 112.179 -2.282 . . . . 10.0 115.379 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.3 tp -95.09 -38.66 10.52 Favored 'General case' 0 C--N 1.317 -0.832 0 O-C-N 126.708 2.505 . . . . 10.0 106.424 -179.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -178.22 162.0 1.51 Allowed 'General case' 0 C--N 1.345 0.412 0 CA-C-O 123.528 1.632 . . . . 10.0 112.977 179.776 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -121.04 165.79 14.79 Favored 'General case' 0 CA--C 1.51 -0.569 0 CA-C-N 112.651 -2.068 . . . . 10.0 106.326 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -157.91 129.89 6.97 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.823 -0.626 . . . . 10.0 111.046 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 69.73 44.1 0.9 Allowed 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 125.443 1.497 . . . . 10.0 113.469 -179.813 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -76.92 -39.92 49.09 Favored 'General case' 0 CA--C 1.55 0.96 0 O-C-N 125.453 1.721 . . . . 10.0 109.231 179.771 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -71.14 -36.89 72.25 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 114.306 -1.315 . . . . 10.0 112.118 179.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.602 ' HB3' HG11 ' A' ' 124' ' ' VAL . 3.2 mt-10 -70.29 -33.18 71.26 Favored 'General case' 0 N--CA 1.442 -0.865 0 O-C-N 125.588 1.805 . . . . 10.0 108.948 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.424 ' O ' ' HB3' ' A' ' 22' ' ' ALA . 1.1 t80 -71.97 -38.22 69.77 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 113.758 -1.565 . . . . 10.0 110.439 179.851 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 80.4 mt -71.59 -25.8 62.34 Favored 'General case' 0 C--O 1.213 -0.832 0 O-C-N 121.645 -0.659 . . . . 10.0 110.583 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.26 -29.29 60.12 Favored 'General case' 0 C--O 1.243 0.714 0 CA-C-O 123.143 1.449 . . . . 10.0 107.775 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.424 ' HB3' ' O ' ' A' ' 19' ' ' TYR . . . -62.36 -28.41 69.74 Favored 'General case' 0 C--O 1.212 -0.872 0 C-N-CA 125.463 1.505 . . . . 10.0 112.722 179.725 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 22.3 mt -104.92 -6.19 20.36 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.631 1.172 . . . . 10.0 111.124 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 42.9 m-20 48.71 58.97 4.72 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 125.897 1.679 . . . . 10.0 114.177 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 26.2 m -93.39 161.29 2.58 Favored 'Isoleucine or valine' 0 C--O 1.243 0.754 0 N-CA-C 106.555 -1.646 . . . . 10.0 106.555 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -41.59 142.15 0.66 Allowed 'General case' 0 CA--C 1.544 0.745 0 CA-C-O 123.817 1.77 . . . . 10.0 113.452 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 52.9 t -67.07 -26.26 36.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 N-CA-C 115.875 1.805 . . . . 10.0 115.875 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.546 ' O ' HD13 ' A' ' 32' ' ' ILE . . . -73.89 -26.9 60.79 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 119.673 -0.811 . . . . 10.0 111.697 179.881 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.8 -44.3 73.86 Favored 'General case' 0 C--N 1.317 -0.813 0 O-C-N 125.774 1.921 . . . . 10.0 114.646 179.743 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.07 -31.28 69.92 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-O 123.864 1.792 . . . . 10.0 112.065 -179.49 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 14.8 mttt -77.3 -33.64 55.65 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 113.465 -1.698 . . . . 10.0 110.86 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.546 HD13 ' O ' ' A' ' 28' ' ' ALA . 1.4 mp -77.26 -39.77 28.78 Favored 'Isoleucine or valine' 0 C--O 1.243 0.759 0 CA-C-N 114.922 -1.036 . . . . 10.0 111.032 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -81.5 -19.35 42.44 Favored 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 116.069 1.877 . . . . 10.0 116.069 -179.711 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -76.37 -14.86 60.06 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 122.551 1.167 . . . . 10.0 110.63 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.413 ' HA ' HD23 ' A' ' 35' ' ' LEU . 14.6 mt -83.21 -9.67 59.02 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 123.793 0.837 . . . . 10.0 113.066 -179.64 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 21.0 mt -116.52 165.38 13.3 Favored 'General case' 0 CA--C 1.507 -0.675 0 CA-C-O 122.588 1.185 . . . . 10.0 109.066 -179.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.53 99.17 8.71 Favored Pre-proline 0 N--CA 1.481 1.099 0 N-CA-C 103.163 -2.902 . . . . 10.0 103.163 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_exo -51.16 -174.95 0.01 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.382 0 C-N-CA 124.693 3.596 . . . . 10.0 115.521 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.5 ' HB2' ' CZ2' ' A' ' 8' ' ' TRP . 0.5 OUTLIER -139.54 -174.77 3.98 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-N 113.096 -1.866 . . . . 10.0 108.222 -179.929 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.7 mttm -173.63 122.79 0.35 Allowed 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 119.109 0.868 . . . . 10.0 111.01 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -121.19 121.0 36.82 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 119.82 1.191 . . . . 10.0 108.424 179.388 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 2.4 mt -97.07 142.01 14.78 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.923 0 O-C-N 124.861 1.351 . . . . 10.0 111.223 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 56.1 t -147.28 138.14 17.73 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.998 0 N-CA-C 104.964 -2.235 . . . . 10.0 104.964 -179.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -143.29 126.08 16.1 Favored 'General case' 0 C--O 1.211 -0.93 0 N-CA-C 106.058 -1.83 . . . . 10.0 106.058 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -104.24 23.87 12.4 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-O 122.965 1.364 . . . . 10.0 107.568 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 87.83 106.27 0.94 Allowed Glycine 0 C--N 1.336 0.539 0 N-CA-C 110.138 -1.185 . . . . 10.0 110.138 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 57.27 31.58 20.33 Favored 'General case' 0 C--N 1.321 -0.654 0 O-C-N 124.829 0.958 . . . . 10.0 110.088 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -162.36 92.99 0.84 Allowed 'General case' 0 C--O 1.213 -0.818 0 N-CA-C 103.189 -2.893 . . . . 10.0 103.189 179.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.496 ' SD ' HD11 ' A' ' 51' ' ' ILE . 4.9 ttm -105.34 142.64 34.74 Favored 'General case' 0 C--N 1.316 -0.875 0 O-C-N 126.389 2.306 . . . . 10.0 116.588 -179.592 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 6.0 mm -128.28 130.91 69.5 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.732 0 N-CA-C 106.273 -1.751 . . . . 10.0 106.273 -179.751 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.496 HD11 ' SD ' ' A' ' 49' ' ' MET . 1.3 mp -121.58 113.61 39.89 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.07 0 O-C-N 126.87 2.607 . . . . 10.0 106.059 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.8 mtp180 -111.61 98.75 7.65 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 113.924 1.083 . . . . 10.0 113.924 -179.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 32.4 m -96.25 89.3 5.06 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 104.736 -2.32 . . . . 10.0 104.736 -179.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.73 44.43 0.01 OUTLIER 'General case' 0 C--N 1.315 -0.905 1 N-CA-C 122.824 4.379 . . . . 10.0 122.824 -179.709 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 36.1 t -64.95 138.56 58.44 Favored 'General case' 0 C--O 1.242 0.695 0 N-CA-C 103.622 -2.733 . . . . 10.0 103.622 -179.735 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 15.9 p -87.39 -37.27 17.21 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 121.389 1.904 . . . . 10.0 108.401 179.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 22.0 t80 -53.46 -35.81 60.92 Favored 'General case' 0 C--O 1.242 0.688 0 O-C-N 125.979 2.049 . . . . 10.0 110.076 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -174.82 90.04 0.06 Allowed 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 115.577 -0.738 . . . . 10.0 112.243 -179.845 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -46.16 144.58 1.91 Allowed 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.61 1.194 . . . . 10.0 113.554 179.775 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -122.72 89.19 3.07 Favored 'General case' 0 CA--C 1.503 -0.859 0 N-CA-C 103.236 -2.876 . . . . 10.0 103.236 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 19.7 mm -90.13 128.38 42.1 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 O-C-N 120.217 -1.552 . . . . 10.0 110.943 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 1.7 mtm -125.65 142.6 51.43 Favored 'General case' 0 C--N 1.341 0.226 0 N-CA-C 105.303 -2.11 . . . . 10.0 105.303 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -140.95 96.56 3.02 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 100.73 -3.804 . . . . 10.0 100.73 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 1.5 m-30 -110.86 167.27 10.36 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 117.623 2.453 . . . . 10.0 117.623 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -126.68 99.9 5.98 Favored 'General case' 0 C--O 1.241 0.624 0 CA-C-N 111.389 -2.642 . . . . 10.0 104.223 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 33.3 t -43.8 112.4 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 CA-C-N 114.225 -1.352 . . . . 10.0 112.424 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.99 30.9 60.55 Favored Glycine 0 CA--C 1.528 0.901 0 O-C-N 126.63 2.456 . . . . 10.0 115.758 -179.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.6 tmmm? -107.79 2.38 23.56 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 115.783 1.772 . . . . 10.0 115.783 -179.693 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 59.6 tt0 61.84 138.04 0.01 OUTLIER 'General case' 0 C--N 1.311 -1.074 0 O-C-N 128.354 3.534 . . . . 10.0 113.526 179.505 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 56.4 m-85 -141.26 143.89 34.37 Favored 'General case' 0 C--N 1.319 -0.721 0 O-C-N 121.046 -1.034 . . . . 10.0 110.47 -179.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -109.93 90.33 3.28 Favored 'General case' 0 C--N 1.321 -0.638 0 O-C-N 126.057 2.098 . . . . 10.0 110.23 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -78.89 134.98 36.87 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 113.982 -1.463 . . . . 10.0 114.672 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -129.82 95.23 3.91 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 106.205 -1.776 . . . . 10.0 106.205 179.779 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.406 ' HB3' ' HA ' ' A' ' 79' ' ' ASP . 1.0 OUTLIER -68.56 -167.23 0.09 Allowed 'General case' 0 C--N 1.322 -0.607 0 O-C-N 125.0 1.438 . . . . 10.0 112.718 -179.98 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -158.61 -70.55 0.09 Allowed 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 107.809 -1.182 . . . . 10.0 107.809 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -92.28 -173.41 41.88 Favored Glycine 0 N--CA 1.434 -1.448 0 O-C-N 126.965 2.666 . . . . 10.0 111.579 -179.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 78.5 mt 75.03 -92.03 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 O-C-N 126.225 1.779 . . . . 10.0 107.704 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -115.7 -48.58 2.76 Favored 'General case' 0 C--N 1.318 -0.775 0 C-N-CA 124.287 1.035 . . . . 10.0 109.967 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.406 ' HA ' ' HB3' ' A' ' 74' ' ' LEU . 0.0 OUTLIER 75.9 128.25 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 118.171 2.656 . . . . 10.0 118.171 179.785 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 6.4 ttm105 -177.81 144.49 0.36 Allowed 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 114.544 -1.207 . . . . 10.0 110.742 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 1.8 mtpp -96.18 148.78 22.35 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 104.327 -2.472 . . . . 10.0 104.327 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 1.8 p -168.23 168.72 11.39 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 107.224 -1.399 . . . . 10.0 107.224 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 7.0 mtt -115.29 92.12 3.82 Favored 'General case' 0 C--O 1.245 0.818 0 N-CA-C 102.051 -3.314 . . . . 10.0 102.051 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.2 m -88.37 115.57 25.96 Favored 'General case' 0 CA--C 1.504 -0.814 0 O-C-N 119.498 -2.001 . . . . 10.0 113.38 179.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 11.2 m -119.8 111.35 17.88 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-N 114.594 -1.184 . . . . 10.0 108.857 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 1.3 t -84.79 119.86 34.36 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 N-CA-C 101.296 -3.594 . . . . 10.0 101.296 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.4 p -145.03 141.93 29.32 Favored 'General case' 0 C--O 1.217 -0.621 0 CA-C-O 124.407 2.051 . . . . 10.0 114.82 -179.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -72.39 137.96 46.89 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 113.368 -1.742 . . . . 10.0 109.488 179.339 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -97.94 8.94 43.93 Favored 'General case' 0 CA--C 1.506 -0.716 0 N-CA-C 103.401 -2.815 . . . . 10.0 103.401 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 129.66 -29.8 3.72 Favored Glycine 0 CA--C 1.497 -1.062 0 N-CA-C 103.392 -3.883 . . . . 10.0 103.392 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -157.6 -51.28 0.07 Allowed 'General case' 0 C--O 1.24 0.563 0 CA-C-N 118.011 0.906 . . . . 10.0 109.857 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -61.39 160.92 10.04 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-O 117.396 -1.288 . . . . 10.0 110.442 -179.915 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 49.0 tp -104.26 116.06 31.51 Favored 'General case' 0 N--CA 1.442 -0.851 0 N-CA-C 104.757 -2.312 . . . . 10.0 104.757 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . 0.443 ' N ' HE21 ' A' ' 94' ' ' GLN . 0.0 OUTLIER -124.45 142.52 51.25 Favored 'General case' 0 CA--C 1.501 -0.942 0 N-CA-C 115.799 1.777 . . . . 10.0 115.799 -179.753 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -134.81 157.69 46.12 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 116.851 -1.547 . . . . 10.0 107.653 179.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 8.3 t -130.56 -67.1 0.58 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.755 0 C-N-CA 118.329 -1.348 . . . . 10.0 110.924 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 72.86 116.18 0.05 Allowed 'General case' 0 C--O 1.245 0.849 0 N-CA-C 105.506 -2.035 . . . . 10.0 105.506 -179.504 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 5.2 ptpp? -107.47 170.74 7.79 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 114.88 1.437 . . . . 10.0 114.88 -179.527 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 176.86 -124.14 0.94 Allowed Glycine 0 N--CA 1.447 -0.568 0 O-C-N 124.723 1.264 . . . . 10.0 110.653 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -130.31 22.07 5.21 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 114.977 1.473 . . . . 10.0 114.977 179.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -110.7 177.2 4.75 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 116.084 1.883 . . . . 10.0 116.084 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -90.9 120.6 32.05 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 128.625 2.77 . . . . 10.0 108.959 179.651 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 86.49 -97.49 2.24 Favored Glycine 0 C--O 1.22 -0.72 0 O-C-N 119.808 -1.807 . . . . 10.0 115.214 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 21.3 mtm-85 59.82 165.76 0.06 Allowed 'General case' 0 N--CA 1.441 -0.876 0 N-CA-C 114.896 1.443 . . . . 10.0 114.896 -179.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 74.43 166.52 15.59 Favored Glycine 0 N--CA 1.444 -0.792 0 CA-C-N 112.036 -2.347 . . . . 10.0 112.903 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -112.46 -173.81 2.33 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 124.565 1.146 . . . . 10.0 109.757 -179.793 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 55.9 m -162.35 123.34 2.57 Favored 'General case' 0 C--O 1.214 -0.814 0 CA-C-O 118.304 -0.855 . . . . 10.0 110.259 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 10.0 mt-30 -120.17 124.9 46.87 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 118.258 -0.877 . . . . 10.0 112.462 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -134.15 164.64 26.9 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 106.519 -1.66 . . . . 10.0 106.519 179.704 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 37.5 mt -129.28 136.21 59.99 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 N-CA-C 116.282 1.956 . . . . 10.0 116.282 -179.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -109.24 -162.17 0.8 Allowed 'General case' 0 CA--C 1.522 -0.117 0 C-N-CA 125.869 1.668 . . . . 10.0 107.356 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -77.48 103.11 1.8 Allowed Glycine 0 CA--C 1.528 0.868 0 O-C-N 125.741 1.901 . . . . 10.0 108.833 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 9.6 t70 50.07 17.41 0.3 Allowed 'General case' 0 C--N 1.324 -0.504 0 O-C-N 127.151 2.324 . . . . 10.0 111.812 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -137.28 88.8 2.38 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 120.5 1.5 . . . . 10.0 110.716 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.795 HD12 ' N ' ' A' ' 116' ' ' HIS . 0.9 OUTLIER -60.48 134.06 56.7 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 105.198 -2.149 . . . . 10.0 105.198 -179.946 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . 0.795 ' N ' HD12 ' A' ' 115' ' ' LEU . 3.6 t60 -119.2 99.05 6.47 Favored 'General case' 0 C--O 1.213 -0.859 0 O-C-N 118.96 -2.337 . . . . 10.0 109.156 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.29 149.15 21.99 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 114.449 -1.25 . . . . 10.0 111.197 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -146.01 128.56 16.05 Favored 'General case' 0 CA--C 1.505 -0.757 0 O-C-N 125.205 1.566 . . . . 10.0 108.621 179.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -113.51 125.73 54.53 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 114.117 -1.402 . . . . 10.0 108.026 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.416 ' HD3' ' N ' ' A' ' 120' ' ' ARG . 0.0 OUTLIER -121.43 160.8 23.38 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-O 125.584 2.611 . . . . 10.0 115.534 -179.943 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -179.03 137.49 0.14 Allowed 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 112.698 -2.046 . . . . 10.0 110.579 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 46.85 31.54 1.5 Allowed 'General case' 0 C--O 1.246 0.896 0 CA-C-N 113.596 -1.638 . . . . 10.0 114.5 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 93.61 -15.38 63.17 Favored Glycine 0 N--CA 1.444 -0.78 0 C-N-CA 124.36 0.981 . . . . 10.0 115.533 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.602 HG11 ' HB3' ' A' ' 18' ' ' GLU . 3.0 t -94.04 131.32 41.27 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 CA-C-N 119.589 1.695 . . . . 10.0 109.983 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 36.4 m -115.43 118.84 34.34 Favored 'General case' 0 N--CA 1.445 -0.709 0 O-C-N 125.991 2.057 . . . . 10.0 113.21 179.457 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -99.58 155.02 17.81 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 105.195 -2.15 . . . . 10.0 105.195 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 25.0 mtmt -145.54 159.29 43.32 Favored 'General case' 0 CA--C 1.507 -0.677 0 O-C-N 120.999 -1.063 . . . . 10.0 110.88 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -140.19 125.36 18.68 Favored 'General case' 0 C--N 1.321 -0.636 0 O-C-N 125.45 1.719 . . . . 10.0 108.235 -179.67 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 2.5 t -85.66 108.31 17.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 N-CA-C 105.873 -1.899 . . . . 10.0 105.873 179.561 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . 0.422 ' HB2' ' HB3' ' A' ' 115' ' ' LEU . 3.9 m-85 -86.06 151.98 23.26 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 115.631 -0.713 . . . . 10.0 110.781 -179.741 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 17.6 tptt -130.31 85.72 2.32 Favored 'General case' 0 C--N 1.321 -0.651 0 O-C-N 126.854 2.596 . . . . 10.0 108.991 -179.768 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.47 104.54 0.13 Allowed 'General case' 0 C--O 1.235 0.341 0 O-C-N 125.723 1.889 . . . . 10.0 109.837 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' VAL . . . . . 0.692 HG12 ' O ' ' A' ' 7' ' ' TYR . 1.4 p -73.88 -24.67 19.76 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.492 0 C-N-CA 118.593 -1.243 . . . . 10.0 110.662 179.599 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 35.1 t-80 . . . . . 0 N--CA 1.441 -0.913 0 CA-C-O 115.871 -2.014 . . . . 10.0 110.814 -179.853 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.443 -0.793 0 N-CA-C 112.742 0.645 . . . . 10.0 112.742 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 62.8 -73.2 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 O-C-N 125.469 1.73 . . . . 10.0 111.99 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -35.32 111.17 0.12 Allowed 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.457 1.503 . . . . 10.0 113.04 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -157.23 -140.7 3.0 Favored Glycine 0 N--CA 1.445 -0.7 0 C-N-CA 118.861 -1.638 . . . . 10.0 114.069 179.56 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 93.1 m-85 -160.36 65.8 0.33 Allowed 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 104.499 -2.408 . . . . 10.0 104.499 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.589 ' CD2' ' CD1' ' A' ' 115' ' ' LEU . 8.5 m0 -68.03 105.95 2.2 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 118.34 -1.344 . . . . 10.0 108.464 179.715 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.403 ' HG2' ' HB ' ' A' ' 133' ' ' VAL . 4.5 pttp -81.93 12.27 4.25 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 117.196 -1.383 . . . . 10.0 110.666 -179.763 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.477 ' HG2' ' N ' ' A' ' 11' ' ' LEU . 0.0 OUTLIER 62.94 140.26 0.02 OUTLIER 'General case' 0 C--N 1.311 -1.084 0 CA-C-O 124.199 1.952 . . . . 10.0 116.15 179.58 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.574 HD12 ' HB2' ' A' ' 131' ' ' LYS . 4.1 tt -108.83 -50.15 3.05 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 120.306 -1.496 . . . . 10.0 108.967 -179.847 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -174.15 157.6 2.87 Favored 'General case' 0 C--O 1.241 0.632 0 C-N-CA 119.544 -0.863 . . . . 10.0 112.773 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -116.2 161.0 19.61 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 127.205 2.202 . . . . 10.0 107.402 -179.711 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 -123.39 -89.39 0.59 Allowed 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 114.218 1.192 . . . . 10.0 114.218 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -80.61 46.82 0.89 Allowed 'General case' 0 N--CA 1.469 0.512 0 O-C-N 124.572 1.17 . . . . 10.0 113.271 -179.701 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -66.36 -36.76 83.69 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 113.85 1.056 . . . . 10.0 113.85 179.555 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -76.55 -32.93 58.5 Favored 'General case' 0 CA--C 1.515 -0.397 0 O-C-N 118.783 -2.448 . . . . 10.0 111.423 179.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -79.61 -24.74 41.76 Favored 'General case' 0 C--O 1.219 -0.502 0 N-CA-C 107.165 -1.421 . . . . 10.0 107.165 179.796 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.575 ' HA ' HG11 ' A' ' 124' ' ' VAL . 42.4 t80 -68.16 -41.12 82.0 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-O 117.44 -1.267 . . . . 10.0 110.848 -179.82 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.421 HD12 ' HG2' ' A' ' 30' ' ' ARG . 84.5 mt -78.35 -21.89 48.8 Favored 'General case' 0 C--O 1.214 -0.769 0 CA-C-O 123.69 1.71 . . . . 10.0 112.747 -179.909 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.411 ' CZ ' ' HA ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -66.25 -42.61 88.31 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 113.66 -1.609 . . . . 10.0 108.415 -179.774 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.57 -21.54 65.43 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 126.17 1.788 . . . . 10.0 110.795 -179.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.512 HD21 ' NH2' ' A' ' 104' ' ' ARG . 35.3 mt -95.78 -9.55 31.39 Favored 'General case' 0 C--O 1.241 0.622 0 C-N-CA 124.746 1.218 . . . . 10.0 108.981 179.79 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 62.59 38.57 12.21 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-O 116.697 -1.62 . . . . 10.0 112.086 179.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.935 HG11 HD22 ' A' ' 29' ' ' LEU . 2.1 t -91.18 154.33 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.82 0 N-CA-C 107.421 -1.326 . . . . 10.0 107.421 179.547 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.26 0.0 OUTLIER -58.08 163.17 2.96 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 127.071 2.732 . . . . 10.0 116.948 -179.687 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 68.9 t -71.97 -26.32 25.21 Favored 'Isoleucine or valine' 0 C--O 1.236 0.372 0 N-CA-C 113.964 1.098 . . . . 10.0 113.964 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.88 -38.16 76.29 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 123.615 0.766 . . . . 10.0 111.105 179.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.935 HD22 HG11 ' A' ' 25' ' ' VAL . 8.1 tt -79.32 -24.17 42.98 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 122.373 1.082 . . . . 10.0 108.562 179.448 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.421 ' HG2' HD12 ' A' ' 20' ' ' LEU . 0.2 OUTLIER -78.78 -41.92 29.27 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 114.837 -1.074 . . . . 10.0 108.881 179.787 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.4 tttt -63.76 -48.31 77.49 Favored 'General case' 0 N--CA 1.442 -0.865 0 C-N-CA 125.135 1.374 . . . . 10.0 113.504 -179.524 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 11.8 mm -72.37 -38.06 59.85 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.575 0 O-C-N 119.707 -1.871 . . . . 10.0 113.783 -179.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -68.15 -37.52 81.14 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 115.835 1.791 . . . . 10.0 115.835 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -57.98 -31.38 66.86 Favored 'General case' 0 C--O 1.216 -0.71 0 N-CA-C 115.075 1.509 . . . . 10.0 115.075 -179.806 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 40.4 mt -81.31 -25.32 36.56 Favored 'General case' 0 C--O 1.217 -0.647 0 CA-C-O 122.172 0.987 . . . . 10.0 113.553 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 11.6 mt -96.58 157.79 15.74 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.572 -0.74 . . . . 10.0 112.866 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 30.1 mttm -145.74 146.02 27.58 Favored Pre-proline 0 N--CA 1.48 1.039 0 N-CA-C 102.422 -3.177 . . . . 10.0 102.422 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 0.1 OUTLIER -100.46 -172.24 0.11 Allowed 'Trans proline' 0 CA--C 1.543 0.952 0 C-N-CA 122.636 2.224 . . . . 10.0 117.427 -179.785 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -142.96 136.69 28.78 Favored 'General case' 0 C--N 1.315 -0.921 0 O-C-N 127.54 3.025 . . . . 10.0 104.329 179.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.518 ' HB2' ' CE2' ' A' ' 130' ' ' PHE . 0.1 OUTLIER -119.58 112.13 18.95 Favored 'General case' 0 N--CA 1.438 -1.051 0 C-N-CA 119.417 -0.913 . . . . 10.0 112.503 -179.933 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -105.4 132.04 52.08 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 102.162 -3.273 . . . . 10.0 102.162 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.527 HG13 ' CH2' ' A' ' 8' ' ' TRP . 0.9 OUTLIER -115.01 161.97 13.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 118.554 0.616 . . . . 10.0 110.274 -179.918 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.607 HG12 HD12 ' A' ' 50' ' ' ILE . 2.6 t -144.5 123.17 6.33 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.854 0 N-CA-C 105.412 -2.07 . . . . 10.0 105.412 179.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -119.9 104.2 9.98 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 122.739 1.257 . . . . 10.0 111.584 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -99.69 86.16 3.27 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 104.498 -2.408 . . . . 10.0 104.498 -179.85 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 70.03 -112.41 4.37 Favored Glycine 0 C--N 1.34 0.803 0 N-CA-C 106.684 -2.566 . . . . 10.0 106.684 -179.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -107.17 -12.35 15.41 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 119.811 -0.756 . . . . 10.0 110.154 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 13.2 m170 -74.42 109.48 7.93 Favored 'General case' 0 N--CA 1.445 -0.723 0 O-C-N 120.88 -1.137 . . . . 10.0 109.043 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.539 ' HG2' HD13 ' A' ' 51' ' ' ILE . 2.8 ttt -87.84 140.02 29.93 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 114.395 1.257 . . . . 10.0 114.395 -179.876 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.607 HD12 HG12 ' A' ' 43' ' ' VAL . 6.9 mt -134.99 110.8 12.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 N-CA-C 102.913 -2.995 . . . . 10.0 102.913 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.539 HD13 ' HG2' ' A' ' 49' ' ' MET . 0.3 OUTLIER -100.69 132.96 45.37 Favored 'Isoleucine or valine' 0 C--O 1.241 0.612 0 N-CA-C 106.472 -1.677 . . . . 10.0 106.472 179.98 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.427 ' CZ ' ' HB3' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -135.16 88.44 2.42 Favored 'General case' 0 N--CA 1.438 -1.025 0 O-C-N 125.377 1.673 . . . . 10.0 110.426 179.695 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 24.3 m -80.2 112.75 17.82 Favored 'General case' 0 C--N 1.318 -0.78 1 N-CA-C 99.913 -4.106 . . . . 10.0 99.913 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.1 mt -78.85 61.91 3.2 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 117.317 2.34 . . . . 10.0 117.317 -179.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.7 m -90.61 84.6 5.93 Favored 'General case' 0 C--O 1.242 0.698 0 CA-C-N 112.143 -2.299 . . . . 10.0 106.044 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -66.36 111.03 3.31 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 106.248 -1.76 . . . . 10.0 106.248 179.814 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 68.8 t80 153.89 -62.34 0.0 OUTLIER 'General case' 0 C--O 1.241 0.646 0 O-C-N 128.06 3.35 . . . . 10.0 105.14 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 10.2 tpp180 -152.52 75.52 1.11 Allowed 'General case' 0 N--CA 1.444 -0.727 0 O-C-N 125.195 1.559 . . . . 10.0 110.072 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -63.13 177.84 0.56 Allowed 'General case' 0 CA--C 1.541 0.606 0 O-C-N 126.162 2.163 . . . . 10.0 114.053 -179.759 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 49.6 m-85 -102.25 -132.76 0.29 Allowed 'General case' 0 C--N 1.308 -1.196 0 O-C-N 128.613 3.696 . . . . 10.0 101.24 179.349 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 6.7 mt 108.56 122.33 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.3 -1.561 0 O-C-N 128.48 3.612 . . . . 10.0 111.306 179.548 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . 0.409 ' CE ' ' HG2' ' A' ' 72' ' ' GLU . 4.6 mmt -150.69 170.07 20.09 Favored 'General case' 0 CA--C 1.532 0.275 0 O-C-N 127.555 3.034 . . . . 10.0 104.376 -179.567 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -134.62 63.85 1.61 Allowed 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 101.459 -3.534 . . . . 10.0 101.459 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.403 ' O ' ' N ' ' A' ' 49' ' ' MET . 1.5 m-30 -65.11 165.68 10.82 Favored 'General case' 0 C--N 1.342 0.256 0 N-CA-C 116.908 2.188 . . . . 10.0 116.908 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 63.3 mt-30 -136.06 125.01 24.18 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 106.208 -1.775 . . . . 10.0 106.208 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.458 ' HA ' ' CG1' ' A' ' 86' ' ' VAL . 0.9 OUTLIER -69.41 134.9 29.38 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 CA-C-O 123.092 1.425 . . . . 10.0 112.291 -179.644 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.58 -16.33 41.16 Favored Glycine 0 N--CA 1.439 -1.135 0 O-C-N 120.002 -1.686 . . . . 10.0 114.307 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 4.1 mttp -91.42 132.33 36.29 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 122.433 1.111 . . . . 10.0 111.815 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -74.55 125.26 28.24 Favored 'General case' 0 CA--C 1.53 0.179 0 O-C-N 120.977 -1.077 . . . . 10.0 109.689 -179.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -121.0 -167.11 1.43 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.187 -0.46 . . . . 10.0 110.83 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -156.75 116.41 3.49 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-O 121.877 0.846 . . . . 10.0 109.408 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.409 ' HG2' ' CE ' ' A' ' 62' ' ' MET . 32.8 mt-10 -79.01 108.37 12.45 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 118.146 -1.421 . . . . 10.0 114.446 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -61.37 -29.7 70.07 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 124.889 1.368 . . . . 10.0 111.404 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 68.43 -78.38 0.04 OUTLIER 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 116.022 1.86 . . . . 10.0 116.022 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 1.7 m 15.68 82.65 0.01 OUTLIER 'General case' 0 C--N 1.313 -0.993 1 O-C-N 129.704 4.377 . . . . 10.0 111.601 -179.649 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 179.78 -57.38 0.08 OUTLIER Glycine 0 N--CA 1.438 -1.204 0 CA-C-O 117.122 -1.932 . . . . 10.0 110.37 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.1 mt -118.34 106.4 19.61 Favored 'Isoleucine or valine' 0 C--O 1.242 0.683 0 N-CA-C 104.135 -2.543 . . . . 10.0 104.135 -179.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.47 ' HB2' HG23 ' A' ' 25' ' ' VAL . 0.0 OUTLIER 82.33 -51.08 0.21 Allowed 'General case' 0 CA--C 1.54 0.573 0 O-C-N 125.734 1.896 . . . . 10.0 112.293 179.881 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 74.55 102.43 0.07 Allowed 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 116.09 1.885 . . . . 10.0 116.09 179.857 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 18.0 ttp85 -163.64 121.93 1.92 Allowed 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 122.159 0.98 . . . . 10.0 109.818 179.739 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.16 152.39 30.75 Favored 'General case' 0 CA--C 1.508 -0.665 0 N-CA-C 103.424 -2.806 . . . . 10.0 103.424 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 2.8 m -143.17 -168.55 2.83 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 124.145 0.978 . . . . 10.0 108.593 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 9.1 mmm -133.14 97.56 4.03 Favored 'General case' 0 C--N 1.315 -0.9 1 N-CA-C 98.333 -4.691 . . . . 10.0 98.333 179.674 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.2 m -108.93 131.71 54.77 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 116.937 2.199 . . . . 10.0 116.937 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 3.2 m -123.85 131.49 53.59 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 104.76 -2.311 . . . . 10.0 104.76 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.507 HG22 HD11 ' A' ' 93' ' ' LEU . 0.3 OUTLIER -98.86 150.35 5.03 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.999 0 N-CA-C 101.379 -3.563 . . . . 10.0 101.379 179.778 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.411 ' O ' HD22 ' A' ' 93' ' ' LEU . 3.3 m -157.4 160.23 38.18 Favored 'General case' 0 C--N 1.319 -0.75 0 O-C-N 125.564 1.79 . . . . 10.0 114.798 -179.82 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 7.6 p90 -118.3 136.23 53.82 Favored 'General case' 0 N--CA 1.465 0.311 0 O-C-N 124.083 0.864 . . . . 10.0 109.097 -179.69 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -101.33 -57.9 1.99 Allowed 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 103.075 -2.935 . . . . 10.0 103.075 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -155.3 -120.84 0.72 Allowed Glycine 0 N--CA 1.434 -1.441 0 N-CA-C 105.18 -3.168 . . . . 10.0 105.18 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -70.42 -18.37 63.01 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 118.971 1.386 . . . . 10.0 110.565 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.404 ' HB2' ' HE3' ' A' ' 92' ' ' LYS . 9.0 mtmt -88.41 -174.36 4.57 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 106.796 -1.557 . . . . 10.0 106.796 -179.802 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.507 HD11 HG22 ' A' ' 86' ' ' VAL . 1.2 tm? -151.18 124.83 9.03 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 104.698 -2.334 . . . . 10.0 104.698 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . 0.427 ' N ' HD13 ' A' ' 93' ' ' LEU . 8.9 mm-40 -111.52 160.68 16.93 Favored 'General case' 0 CA--C 1.502 -0.872 0 CA-C-N 113.51 -1.677 . . . . 10.0 113.914 -179.797 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 4.2 t -140.78 135.45 31.5 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 118.29 -0.862 . . . . 10.0 109.453 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 44.3 t -119.92 91.34 1.8 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.74 0 O-C-N 126.941 2.651 . . . . 10.0 106.919 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -91.94 72.24 5.61 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 123.901 1.81 . . . . 10.0 112.306 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 31.1 tttp -71.82 90.96 1.12 Allowed 'General case' 0 C--O 1.225 -0.23 0 O-C-N 120.194 -1.566 . . . . 10.0 109.409 179.588 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -139.83 82.17 0.25 Allowed Glycine 0 C--O 1.226 -0.396 0 N-CA-C 108.258 -1.937 . . . . 10.0 108.258 -179.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 59.12 178.36 0.08 Allowed 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 114.791 1.404 . . . . 10.0 114.791 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 37.5 mttt 55.26 175.24 0.03 OUTLIER 'General case' 0 C--O 1.24 0.563 0 N-CA-C 116.241 1.941 . . . . 10.0 116.241 179.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -107.12 116.65 32.29 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 126.383 1.873 . . . . 10.0 108.493 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 90.32 66.48 1.2 Allowed Glycine 0 C--O 1.224 -0.495 0 N-CA-C 116.22 1.248 . . . . 10.0 116.22 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.512 ' NH2' HD21 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -130.78 136.43 48.71 Favored 'General case' 0 N--CA 1.444 -0.749 0 O-C-N 124.356 0.68 . . . . 10.0 111.489 -179.895 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 143.66 163.31 9.8 Favored Glycine 0 N--CA 1.441 -0.972 0 O-C-N 126.411 2.32 . . . . 10.0 108.636 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 32.0 m0 -119.81 174.37 6.48 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 119.053 1.426 . . . . 10.0 112.43 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . 0.498 ' O ' HD12 ' A' ' 117' ' ' LEU . 16.0 m -151.64 128.33 10.84 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 109.561 -0.533 . . . . 10.0 109.561 179.894 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.551 ' NE2' HD13 ' A' ' 117' ' ' LEU . 59.8 mm-40 -106.44 156.6 18.37 Favored 'General case' 0 C--N 1.319 -0.729 0 O-C-N 125.95 2.031 . . . . 10.0 111.346 -179.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 1.5 t90 -171.98 119.3 0.42 Allowed 'General case' 0 N--CA 1.478 0.953 0 CA-C-O 123.297 1.523 . . . . 10.0 106.978 -179.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 60.6 mt -98.7 152.06 4.43 Favored 'Isoleucine or valine' 0 C--O 1.241 0.647 0 N-CA-C 117.367 2.358 . . . . 10.0 117.367 -179.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -130.15 -168.67 2.0 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 103.391 -2.818 . . . . 10.0 103.391 -179.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -68.0 -59.15 6.67 Favored Glycine 0 N--CA 1.469 0.856 0 O-C-N 120.678 -1.264 . . . . 10.0 110.035 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . 0.429 ' HA ' ' HG2' ' A' ' 132' ' ' LYS . 0.1 OUTLIER -117.8 9.63 13.01 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 119.655 1.727 . . . . 10.0 113.292 179.719 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -128.53 -159.75 0.97 Allowed 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 115.618 1.71 . . . . 10.0 115.618 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.589 ' CD1' ' CD2' ' A' ' 8' ' ' TRP . 0.4 OUTLIER -171.86 134.53 0.79 Allowed 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 106.451 -1.685 . . . . 10.0 106.451 179.904 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -117.38 86.64 2.55 Favored 'General case' 0 C--O 1.236 0.372 0 O-C-N 125.044 1.465 . . . . 10.0 109.41 -179.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.551 HD13 ' NE2' ' A' ' 108' ' ' GLN . 1.5 tp -95.26 148.0 22.87 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.059 -1.089 . . . . 10.0 108.059 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -127.12 157.22 40.27 Favored 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 106.924 -1.51 . . . . 10.0 106.924 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 18.9 mtm -142.68 114.42 8.07 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 123.715 1.721 . . . . 10.0 108.694 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 5.9 ttp180 -104.64 129.8 52.74 Favored 'General case' 0 CA--C 1.506 -0.734 0 CA-C-O 122.37 1.081 . . . . 10.0 112.9 179.405 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -148.39 118.87 7.4 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 114.423 -1.262 . . . . 10.0 107.799 -179.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 37.68 47.45 0.82 Allowed 'General case' 0 C--O 1.243 0.76 0 O-C-N 126.626 2.454 . . . . 10.0 117.344 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 91.06 -4.26 81.15 Favored Glycine 0 C--N 1.337 0.585 0 C-N-CA 119.022 -1.561 . . . . 10.0 114.011 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.575 HG11 ' HA ' ' A' ' 19' ' ' TYR . 0.3 OUTLIER -96.95 151.62 4.11 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.514 0 N-CA-C 107.624 -1.25 . . . . 10.0 107.624 179.695 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 2.9 m -134.66 102.54 5.32 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 113.954 -1.475 . . . . 10.0 111.875 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -115.1 134.41 55.19 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 105.844 -1.91 . . . . 10.0 105.844 179.892 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 14.0 mtmm -127.3 125.13 40.31 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 115.444 1.646 . . . . 10.0 115.444 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 1.2 mm100 -99.21 113.52 25.83 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-N 114.389 -1.278 . . . . 10.0 109.697 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 8.0 t -96.74 127.25 49.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 N-CA-C 104.666 -2.346 . . . . 10.0 104.666 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . 0.518 ' CE2' ' HB2' ' A' ' 40' ' ' LYS . 8.1 m-30 -110.25 144.67 38.59 Favored 'General case' 0 N--CA 1.441 -0.891 0 C-N-CA 124.188 0.995 . . . . 10.0 112.678 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.574 ' HB2' HD12 ' A' ' 11' ' ' LEU . 6.3 tptm -127.72 92.4 3.48 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 105.765 -1.939 . . . . 10.0 105.765 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . 0.429 ' HG2' ' HA ' ' A' ' 113' ' ' ASP . 11.0 ptpt -53.38 129.85 33.33 Favored 'General case' 0 CA--C 1.503 -0.83 0 CA-C-O 125.736 2.684 . . . . 10.0 111.259 -179.714 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' VAL . . . . . 0.413 ' O ' HG13 ' A' ' 133' ' ' VAL . 0.3 OUTLIER -83.7 -3.0 7.27 Favored 'Isoleucine or valine' 0 C--O 1.236 0.342 0 O-C-N 120.041 -1.662 . . . . 10.0 111.69 -179.92 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' HIS . . . . . 0.407 ' CD2' ' C ' ' A' ' 134' ' ' HIS . 4.5 t60 . . . . . 0 C--N 1.314 -0.937 0 O-C-N 125.47 1.731 . . . . 10.0 110.684 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 43.1 p-10 . . . . . 0 N--CA 1.47 0.551 0 CA-C-O 124.26 1.981 . . . . 10.0 109.286 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 41.9 m-85 -54.05 -13.51 0.82 Allowed 'General case' 0 C--O 1.242 0.662 0 CA-C-O 116.616 -1.659 . . . . 10.0 114.568 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -53.92 131.32 39.92 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-O 124.34 2.019 . . . . 10.0 113.793 179.623 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 155.14 165.0 13.58 Favored Glycine 0 CA--C 1.528 0.902 0 O-C-N 119.778 -1.826 . . . . 10.0 114.002 179.809 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.505 ' HA ' ' HA ' ' A' ' 41' ' ' GLU . 1.9 m-30 -104.73 121.78 44.31 Favored 'General case' 0 C--O 1.243 0.755 0 CA-C-O 116.565 -1.683 . . . . 10.0 106.756 179.61 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.769 ' CE2' ' HB2' ' A' ' 40' ' ' LYS . 1.1 p-90 -113.59 145.88 40.58 Favored 'General case' 0 N--CA 1.44 -0.955 0 CA-C-O 123.37 1.557 . . . . 10.0 115.042 179.601 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.5 ptpp? -121.85 120.0 33.24 Favored 'General case' 0 N--CA 1.437 -1.097 0 N-CA-C 105.16 -2.163 . . . . 10.0 105.16 -179.422 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.517 ' HB3' ' CZ3' ' A' ' 8' ' ' TRP . 6.7 ptm -68.66 142.14 55.16 Favored 'General case' 0 CA--C 1.506 -0.727 0 O-C-N 118.834 -2.416 . . . . 10.0 115.697 -179.596 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 12.1 tp -97.75 -33.88 11.11 Favored 'General case' 0 CA--C 1.508 -0.652 0 O-C-N 120.303 -1.498 . . . . 10.0 109.609 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -152.57 152.08 31.42 Favored 'General case' 0 CA--C 1.515 -0.399 0 N-CA-C 115.388 1.625 . . . . 10.0 115.388 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -134.9 132.6 38.7 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 106.807 -1.553 . . . . 10.0 106.807 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -132.29 162.59 30.63 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 119.249 0.931 . . . . 10.0 113.023 179.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 2.7 m120 37.65 25.81 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.472 0 O-C-N 126.918 2.636 . . . . 10.0 116.851 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -65.35 -31.99 73.4 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 118.862 -2.399 . . . . 10.0 114.218 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -65.77 -41.82 91.59 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 115.437 1.643 . . . . 10.0 115.437 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -79.82 -22.08 43.46 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 107.007 -1.479 . . . . 10.0 107.007 179.666 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.561 ' CZ ' HD11 ' A' ' 23' ' ' LEU . 2.9 t80 -66.84 -36.94 83.49 Favored 'General case' 0 CA--C 1.55 0.958 0 O-C-N 121.023 -1.048 . . . . 10.0 111.137 -179.582 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 20.5 mt -71.69 -39.18 70.38 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 125.356 1.462 . . . . 10.0 111.015 179.82 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 22.4 ttp180 -71.84 -28.18 63.38 Favored 'General case' 0 C--O 1.244 0.806 0 O-C-N 124.859 1.349 . . . . 10.0 110.704 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.36 -42.97 95.94 Favored 'General case' 0 C--O 1.212 -0.873 0 C-N-CA 124.266 1.026 . . . . 10.0 113.652 -179.814 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.561 HD11 ' CZ ' ' A' ' 19' ' ' TYR . 0.3 OUTLIER -91.84 -22.97 19.83 Favored 'General case' 0 C--N 1.345 0.374 0 CA-C-O 122.216 1.008 . . . . 10.0 113.461 -179.966 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.6 t0 66.29 70.55 0.41 Allowed 'General case' 0 N--CA 1.481 1.078 0 O-C-N 119.644 -1.91 . . . . 10.0 112.173 179.423 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.502 HG21 HD22 ' A' ' 29' ' ' LEU . 0.2 OUTLIER -93.34 -51.35 11.31 Favored 'Isoleucine or valine' 0 C--O 1.242 0.675 0 N-CA-C 106.337 -1.727 . . . . 10.0 106.337 -179.822 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 177.92 152.26 0.27 Allowed 'General case' 0 C--O 1.243 0.749 0 N-CA-C 116.788 2.144 . . . . 10.0 116.788 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.41 ' CG1' ' N ' ' A' ' 28' ' ' ALA . 0.3 OUTLIER -74.53 -37.76 44.62 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 C-N-CA 125.464 1.505 . . . . 10.0 113.75 -179.601 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.41 ' N ' ' CG1' ' A' ' 27' ' ' VAL . . . -76.4 -31.79 58.16 Favored 'General case' 0 C--N 1.319 -0.729 0 O-C-N 126.147 2.154 . . . . 10.0 112.959 179.896 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.502 HD22 HG21 ' A' ' 25' ' ' VAL . 2.1 tp -68.28 -29.57 68.39 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.9 0.704 . . . . 10.0 112.9 179.794 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.41 -30.5 70.28 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 113.307 0.855 . . . . 10.0 113.307 -179.803 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.62 -37.89 41.12 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 113.242 -1.799 . . . . 10.0 110.289 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.543 HD13 ' CZ ' ' A' ' 57' ' ' PHE . 48.1 mt -77.37 -48.38 24.63 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 O-C-N 119.746 -1.846 . . . . 10.0 112.821 -179.387 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -55.8 -33.91 64.84 Favored 'General case' 0 C--O 1.216 -0.692 0 CA-C-O 117.699 -1.143 . . . . 10.0 113.799 179.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -69.39 -9.57 54.11 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 115.078 1.51 . . . . 10.0 115.078 179.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.5 mt -104.57 14.17 30.39 Favored 'General case' 0 C--N 1.315 -0.907 0 O-C-N 124.973 1.421 . . . . 10.0 111.188 179.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -128.85 147.76 50.84 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.095 0.958 . . . . 10.0 110.572 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 4.6 mttt -129.88 73.35 81.51 Favored Pre-proline 0 C--O 1.218 -0.562 0 N-CA-C 106.27 -1.752 . . . . 10.0 106.27 -179.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 9.0 Cg_endo -52.93 128.52 29.15 Favored 'Trans proline' 0 N--CA 1.451 -1.004 0 O-C-N 125.418 2.272 . . . . 10.0 116.104 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -106.48 142.53 35.99 Favored 'General case' 0 C--N 1.316 -0.854 0 O-C-N 128.458 3.599 . . . . 10.0 104.724 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.769 ' HB2' ' CE2' ' A' ' 8' ' ' TRP . 1.4 ttmt -112.6 177.79 4.51 Favored 'General case' 0 C--O 1.21 -0.991 0 O-C-N 124.796 1.31 . . . . 10.0 112.262 -179.601 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.505 ' HA ' ' HA ' ' A' ' 7' ' ' TYR . 2.2 tt0 -158.26 120.7 3.71 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 104.887 -2.264 . . . . 10.0 104.887 -179.479 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 19.0 mm -103.14 152.6 5.89 Favored 'Isoleucine or valine' 0 C--O 1.242 0.69 0 O-C-N 125.555 1.785 . . . . 10.0 112.622 179.648 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 62.4 t -154.25 98.72 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 CA-C-N 113.369 -1.741 . . . . 10.0 108.538 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -98.61 118.61 35.7 Favored 'General case' 0 C--N 1.311 -1.068 0 C-N-CA 125.056 1.342 . . . . 10.0 107.532 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -93.58 18.76 9.46 Favored 'General case' 0 C--O 1.24 0.587 0 CA-C-O 117.429 -1.272 . . . . 10.0 108.032 -179.82 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 113.77 -100.28 1.04 Allowed Glycine 0 CA--C 1.523 0.536 0 N-CA-C 107.634 -2.187 . . . . 10.0 107.634 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.423 ' HA ' HG12 ' A' ' 66' ' ' VAL . 0.0 OUTLIER -86.1 -29.04 23.65 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 121.493 -1.004 . . . . 10.0 109.322 179.854 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -95.78 121.79 37.88 Favored 'General case' 0 CA--C 1.509 -0.609 0 N-CA-C 107.777 -1.194 . . . . 10.0 107.777 179.834 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 9.0 ttt -114.64 124.2 51.22 Favored 'General case' 0 CA--C 1.504 -0.827 0 CA-C-O 123.102 1.43 . . . . 10.0 112.285 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.484 ' C ' HD13 ' A' ' 51' ' ' ILE . 30.7 mm -108.81 122.05 62.83 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.29 0 N-CA-C 107.393 -1.336 . . . . 10.0 107.393 -179.764 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.53 ' N ' HD13 ' A' ' 51' ' ' ILE . 1.5 mm -107.87 135.97 44.78 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 N-CA-C 105.253 -2.129 . . . . 10.0 105.253 179.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 12.7 mtm-85 -133.7 122.58 23.6 Favored 'General case' 0 CA--C 1.51 -0.582 0 C-N-CA 119.978 -0.689 . . . . 10.0 112.361 -179.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 58.3 m -98.42 129.38 45.05 Favored 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 102.492 -3.151 . . . . 10.0 102.492 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 8.8 mt -117.71 54.24 0.91 Allowed 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 119.398 3.111 . . . . 10.0 119.398 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 60.6 p -73.54 -172.75 1.27 Allowed 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 103.864 -2.643 . . . . 10.0 103.864 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 8.0 p -120.56 -13.42 8.78 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-O 118.667 -0.682 . . . . 10.0 111.973 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.543 ' CZ ' HD13 ' A' ' 32' ' ' ILE . 19.5 t80 -81.16 -46.38 14.97 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.36 -0.978 . . . . 10.0 108.36 -179.928 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.37 143.21 16.25 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-O 123.906 1.813 . . . . 10.0 112.879 -179.856 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -87.82 142.84 27.49 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 114.067 -1.424 . . . . 10.0 107.964 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.404 ' C ' HD13 ' A' ' 61' ' ' ILE . 1.9 t80 -149.87 118.48 6.54 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 126.689 2.493 . . . . 10.0 105.206 -179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.445 HG22 ' H ' ' A' ' 62' ' ' MET . 0.0 OUTLIER -109.44 -175.13 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.313 -1.006 0 O-C-N 124.943 1.402 . . . . 10.0 112.598 179.92 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . 0.445 ' H ' HG22 ' A' ' 61' ' ' ILE . 2.3 mtm -143.21 -179.58 6.48 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 106.931 -1.507 . . . . 10.0 106.931 -179.772 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 64.7 t0 -162.12 80.92 0.55 Allowed 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 102.889 -3.004 . . . . 10.0 102.889 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 2.0 m-30 -88.67 166.15 14.29 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 125.2 1.562 . . . . 10.0 112.207 179.865 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.409 ' O ' HG13 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -144.25 126.0 15.17 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 103.8 -2.667 . . . . 10.0 103.8 179.988 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.423 HG12 ' HA ' ' A' ' 47' ' ' ASP . 2.0 p -89.88 133.8 30.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 O-C-N 124.658 1.224 . . . . 10.0 108.453 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 91.1 -12.3 69.56 Favored Glycine 0 C--O 1.219 -0.811 0 C-N-CA 120.168 -1.015 . . . . 10.0 115.251 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.2 mttm -109.3 -173.19 2.21 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 117.44 0.62 . . . . 10.0 112.359 179.844 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -131.32 139.93 49.65 Favored 'General case' 0 C--N 1.314 -0.94 0 O-C-N 125.223 1.577 . . . . 10.0 107.533 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 10.5 p90 -154.5 135.33 13.68 Favored 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 118.597 -1.241 . . . . 10.0 110.173 179.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.13 155.86 22.4 Favored 'General case' 0 C--O 1.222 -0.393 0 N-CA-C 106.316 -1.735 . . . . 10.0 106.316 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -156.24 116.76 3.71 Favored 'General case' 0 N--CA 1.438 -1.071 0 N-CA-C 117.614 2.45 . . . . 10.0 117.614 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 -83.29 91.65 7.34 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 105.236 -2.135 . . . . 10.0 105.236 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 13.0 mt -62.15 3.43 0.17 Allowed 'General case' 0 N--CA 1.438 -1.068 0 N-CA-C 117.88 2.548 . . . . 10.0 117.88 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.408 HG23 ' H ' ' A' ' 75' ' ' THR . 50.8 p -41.97 109.65 0.14 Allowed 'General case' 0 C--O 1.24 0.575 0 O-C-N 125.76 1.913 . . . . 10.0 108.98 179.699 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . 0.728 ' C ' HD13 ' A' ' 77' ' ' ILE . . . 134.9 -30.25 2.86 Favored Glycine 0 CA--C 1.525 0.706 0 CA-C-N 113.21 -1.813 . . . . 10.0 109.8 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.728 HD13 ' C ' ' A' ' 76' ' ' GLY . 2.5 mm -128.3 -17.1 2.36 Favored 'Isoleucine or valine' 0 C--O 1.247 0.938 0 CA-C-N 117.774 0.787 . . . . 10.0 111.43 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -144.44 -40.49 0.27 Allowed 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 117.641 -1.171 . . . . 10.0 113.195 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 93.53 -23.22 0.06 Allowed 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 126.987 2.115 . . . . 10.0 113.651 -179.824 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -94.7 166.71 11.87 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 117.367 -1.301 . . . . 10.0 112.932 -179.758 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.86 168.57 12.59 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 103.143 -2.91 . . . . 10.0 103.143 -179.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -153.06 -170.83 3.74 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 113.914 -1.494 . . . . 10.0 110.282 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.6 mmt -119.98 49.36 1.41 Allowed 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 101.387 -3.56 . . . . 10.0 101.387 179.772 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 42.3 m -44.93 104.23 0.04 OUTLIER 'General case' 0 N--CA 1.439 -1.003 0 N-CA-C 119.243 3.053 . . . . 10.0 119.243 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 22.7 m -102.34 133.99 46.37 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 105.359 -2.089 . . . . 10.0 105.359 -179.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.409 HG13 ' O ' ' A' ' 65' ' ' GLN . 0.2 OUTLIER -117.57 109.87 28.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 102.956 -2.979 . . . . 10.0 102.956 -179.828 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 17.3 m -104.05 166.42 10.42 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 115.888 -0.596 . . . . 10.0 111.484 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 11.5 p-90 -126.61 55.09 1.55 Allowed 'General case' 0 CA--C 1.511 -0.544 0 CA-C-O 125.027 2.346 . . . . 10.0 109.991 -179.744 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -66.4 109.25 2.65 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 101.343 -3.577 . . . . 10.0 101.343 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 81.93 -154.4 33.78 Favored Glycine 0 N--CA 1.446 -0.696 0 N-CA-C 108.273 -1.931 . . . . 10.0 108.273 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -103.46 42.42 1.17 Allowed 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 123.073 1.416 . . . . 10.0 109.846 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 7.2 mtmt -122.27 -166.16 1.37 Allowed 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 113.195 -1.821 . . . . 10.0 108.228 179.82 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 5.2 tt -141.33 102.57 4.25 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 105.573 -2.01 . . . . 10.0 105.573 -179.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -113.77 118.99 35.83 Favored 'General case' 0 CA--C 1.507 -0.674 0 O-C-N 120.81 -1.181 . . . . 10.0 112.84 179.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 19.9 p -127.51 148.41 50.32 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 112.828 0.677 . . . . 10.0 112.828 179.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 88.9 t -126.33 125.75 68.09 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.75 0 N-CA-C 106.399 -1.704 . . . . 10.0 106.399 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 59.3 mt-30 -107.84 57.96 0.62 Allowed 'General case' 0 C--N 1.317 -0.822 0 O-C-N 126.654 2.471 . . . . 10.0 110.997 -179.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 1.5 mmmm -9.41 -92.23 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.602 0 O-C-N 128.032 3.333 . . . . 10.0 115.754 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 43.73 38.06 4.16 Favored Glycine 0 N--CA 1.44 -1.044 0 CA-C-O 118.025 -1.431 . . . . 10.0 113.054 179.551 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 68.03 -141.01 0.11 Allowed 'General case' 0 C--N 1.32 -0.698 0 O-C-N 125.723 1.484 . . . . 10.0 111.09 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 2.1 mmmm 57.32 174.1 0.05 OUTLIER 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 117.293 2.331 . . . . 10.0 117.293 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 45.8 mm-40 -82.06 -44.26 16.82 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 126.589 1.956 . . . . 10.0 109.423 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -113.26 -102.33 2.55 Favored Glycine 0 N--CA 1.444 -0.812 0 CA-C-O 122.641 1.134 . . . . 10.0 115.776 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 2.4 mtt180 63.19 91.83 0.07 Allowed 'General case' 0 CA--C 1.535 0.383 0 O-C-N 120.765 -1.432 . . . . 10.0 114.166 179.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 166.3 155.68 9.01 Favored Glycine 0 N--CA 1.447 -0.631 0 O-C-N 126.284 2.24 . . . . 10.0 108.163 -179.796 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 1.6 m0 -114.43 169.29 9.15 Favored 'General case' 0 CA--C 1.505 -0.75 0 O-C-N 125.314 1.244 . . . . 10.0 109.969 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 2.2 m -149.65 118.38 6.6 Favored 'General case' 0 CA--C 1.506 -0.728 0 N-CA-C 107.577 -1.268 . . . . 10.0 107.577 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -112.55 117.07 31.31 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.986 -179.719 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 1.5 p90 -137.07 140.59 42.1 Favored 'General case' 0 C--O 1.217 -0.607 0 N-CA-C 107.201 -1.407 . . . . 10.0 107.201 179.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 60.7 mt -96.18 159.76 2.92 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.004 0 N-CA-C 114.506 1.299 . . . . 10.0 114.506 179.609 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -166.97 113.32 0.79 Allowed 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 116.939 -1.505 . . . . 10.0 107.208 -179.73 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 53.51 40.78 62.9 Favored Glycine 0 N--CA 1.464 0.544 0 N-CA-C 106.447 -2.661 . . . . 10.0 106.447 179.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 64.0 9.41 4.59 Favored 'General case' 0 CA--C 1.552 1.054 0 CA-C-O 117.396 -1.287 . . . . 10.0 111.035 179.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -100.27 90.61 4.4 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 124.06 0.85 . . . . 10.0 110.184 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.417 ' HB3' ' HB2' ' A' ' 130' ' ' PHE . 12.1 tp -57.83 118.96 5.87 Favored 'General case' 0 N--CA 1.444 -0.764 0 N-CA-C 106.887 -1.523 . . . . 10.0 106.887 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . 0.545 ' CE1' HG12 ' A' ' 129' ' ' VAL . 1.4 m-70 -112.83 103.22 11.21 Favored 'General case' 0 CA--C 1.5 -0.968 0 O-C-N 125.772 1.92 . . . . 10.0 107.401 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 42.4 tp -93.55 143.9 25.87 Favored 'General case' 0 C--O 1.241 0.615 0 O-C-N 119.282 -2.136 . . . . 10.0 113.385 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 66.6 tt0 -130.32 123.57 30.29 Favored 'General case' 0 C--O 1.217 -0.607 0 CA-C-O 117.636 -1.173 . . . . 10.0 109.661 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 6.5 mtt -116.63 153.45 32.26 Favored 'General case' 0 C--O 1.239 0.546 0 O-C-N 124.295 0.997 . . . . 10.0 110.599 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 1.1 mmm-85 -147.6 139.99 24.52 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 117.935 -1.031 . . . . 10.0 110.644 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -153.98 117.09 4.52 Favored 'General case' 0 N--CA 1.443 -0.805 0 O-C-N 124.527 1.142 . . . . 10.0 111.342 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 56.28 39.88 30.05 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 116.953 2.205 . . . . 10.0 116.953 179.789 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 87.79 -6.43 83.47 Favored Glycine 0 CA--C 1.539 1.546 0 CA-C-O 118.663 -1.076 . . . . 10.0 112.272 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 2.0 t -98.9 131.92 45.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 125.213 1.405 . . . . 10.0 108.206 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 94.3 m -111.67 140.2 46.5 Favored 'General case' 0 N--CA 1.446 -0.642 0 O-C-N 125.724 1.89 . . . . 10.0 110.822 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -129.16 145.46 51.31 Favored 'General case' 0 C--O 1.221 -0.417 0 N-CA-C 106.043 -1.836 . . . . 10.0 106.043 -179.911 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 2.2 mtmm -137.44 141.83 41.61 Favored 'General case' 0 C--N 1.328 -0.343 0 O-C-N 120.431 -1.418 . . . . 10.0 114.141 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -132.99 130.46 39.52 Favored 'General case' 0 CA--C 1.503 -0.854 0 O-C-N 125.209 1.568 . . . . 10.0 109.815 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.545 HG12 ' CE1' ' A' ' 116' ' ' HIS . 0.0 OUTLIER -106.15 96.33 4.52 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.379 0 C-N-CA 124.005 0.922 . . . . 10.0 110.543 179.92 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . 0.488 ' CZ ' ' CZ2' ' A' ' 8' ' ' TRP . 5.5 m-85 -83.86 175.98 9.23 Favored 'General case' 0 C--N 1.321 -0.631 0 O-C-N 126.637 2.461 . . . . 10.0 109.054 -179.766 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 23.4 tptp -148.27 98.39 2.91 Favored 'General case' 0 N--CA 1.44 -0.935 0 N-CA-C 106.852 -1.536 . . . . 10.0 106.852 179.754 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 7.7 ttpt -63.5 122.9 17.41 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 125.636 1.835 . . . . 10.0 108.795 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 24.6 t -102.45 -57.3 4.57 Favored 'Isoleucine or valine' 0 C--O 1.244 0.809 0 N-CA-C 113.911 1.078 . . . . 10.0 113.911 179.665 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 3.3 t-80 . . . . . 0 C--O 1.244 0.8 0 C-N-CA 118.086 -1.446 . . . . 10.0 113.828 179.824 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 . . . . . 0 N--CA 1.472 0.672 0 N-CA-C 108.654 -0.869 . . . . 10.0 108.654 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 2.8 m-30 -72.41 -28.18 62.82 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 115.999 1.851 . . . . 10.0 115.999 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.4 p30 -68.13 139.32 56.16 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-N 120.921 1.691 . . . . 10.0 114.389 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -156.5 -93.12 0.09 OUTLIER Glycine 0 C--O 1.216 -1.006 0 N-CA-C 119.114 2.406 . . . . 10.0 119.114 -179.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.499 ' HA ' ' CE3' ' A' ' 8' ' ' TRP . 0.8 OUTLIER 172.7 170.91 0.12 Allowed 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 103.501 -2.778 . . . . 10.0 103.501 179.362 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.733 ' HA ' ' HB3' ' A' ' 132' ' ' LYS 0.331 32.0 p90 -152.05 159.25 43.75 Favored 'General case' 0 N--CA 1.441 -0.899 0 N-CA-C 115.459 1.651 . . . . 10.0 115.459 -178.116 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.519 ' HD3' ' CG ' ' A' ' 132' ' ' LYS . 2.3 pttp -167.28 88.38 0.3 Allowed 'General case' 0 C--O 1.216 -0.709 0 O-C-N 127.879 3.237 . . . . 10.0 108.313 175.844 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.538 ' HE1' ' HD2' ' A' ' 38' ' ' PRO . 2.1 ttp -54.49 140.12 35.44 Favored 'General case' 0 CA--C 1.509 -0.616 0 N-CA-C 116.521 2.045 . . . . 10.0 116.521 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.8 tp -101.73 -42.95 6.0 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 114.448 -1.251 . . . . 10.0 108.07 179.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -162.0 161.71 28.62 Favored 'General case' 0 C--O 1.244 0.792 0 O-C-N 125.377 1.673 . . . . 10.0 115.446 179.663 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -135.43 173.25 11.93 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 105.247 -2.131 . . . . 10.0 105.247 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -162.19 151.84 16.17 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 119.889 -1.757 . . . . 10.0 115.497 179.616 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 57.51 27.46 14.07 Favored 'General case' 0 C--N 1.324 -0.541 0 O-C-N 127.084 2.74 . . . . 10.0 115.582 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.4 ' CD1' ' N ' ' A' ' 16' ' ' PHE . 0.0 OUTLIER -56.55 -29.56 62.09 Favored 'General case' 0 C--O 1.244 0.784 0 C-N-CA 126.045 1.738 . . . . 10.0 114.932 179.931 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -78.66 -43.43 26.15 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 120.414 1.461 . . . . 10.0 109.169 179.186 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.08 -21.95 63.1 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-O 117.834 -1.079 . . . . 10.0 110.884 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -72.76 -36.04 67.59 Favored 'General case' 0 CA--C 1.552 1.052 0 O-C-N 124.79 1.306 . . . . 10.0 109.783 -179.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.625 HD22 HG11 ' A' ' 25' ' ' VAL . 75.0 mt -74.17 -27.96 61.07 Favored 'General case' 0 C--O 1.22 -0.454 0 CA-C-N 114.022 -1.444 . . . . 10.0 111.207 -179.83 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.5 ttt180 -73.47 -23.48 60.08 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 114.099 -1.409 . . . . 10.0 110.057 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.24 -24.62 62.22 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 122.258 1.028 . . . . 10.0 112.205 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.5 mt -109.71 -1.28 18.1 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 114.222 -1.354 . . . . 10.0 114.444 -179.784 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 55.68 72.06 0.51 Allowed 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 118.884 0.766 . . . . 10.0 111.415 179.717 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.625 HG11 HD22 ' A' ' 20' ' ' LEU . 2.2 p -94.58 -109.94 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.24 0.563 0 CA-C-O 117.084 -1.436 . . . . 10.0 107.416 179.965 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.58 ' N ' HG22 ' A' ' 25' ' ' VAL . 0.9 OUTLIER -148.37 161.99 40.46 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-N 120.437 1.471 . . . . 10.0 113.582 179.761 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -77.25 -20.0 14.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 O-C-N 125.876 1.985 . . . . 10.0 114.017 -179.6 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -77.32 -34.18 55.39 Favored 'General case' 0 C--O 1.242 0.677 0 O-C-N 125.274 1.609 . . . . 10.0 109.326 179.784 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.492 HD23 HG21 ' A' ' 25' ' ' VAL . 44.8 tp -77.91 -40.01 41.14 Favored 'General case' 0 C--O 1.222 -0.392 0 C-N-CA 118.393 -1.323 . . . . 10.0 113.487 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 8.8 mtm-85 -59.09 -23.26 61.92 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 125.65 1.58 . . . . 10.0 114.163 179.714 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.7 ttpp -76.53 -43.25 40.07 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 117.844 -1.074 . . . . 10.0 109.971 179.784 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.404 HD12 ' CE1' ' A' ' 57' ' ' PHE . 0.8 OUTLIER -79.52 -40.94 21.91 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 O-C-N 125.709 1.881 . . . . 10.0 109.807 -179.835 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -55.4 -58.6 7.06 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-O 121.83 0.824 . . . . 10.0 112.094 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -64.89 82.28 0.04 OUTLIER 'General case' 0 C--N 1.342 0.265 0 CA-C-N 113.775 -1.557 . . . . 10.0 110.247 179.746 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 162.77 -32.59 0.0 OUTLIER 'General case' 0 N--CA 1.444 -0.77 0 O-C-N 126.112 2.132 . . . . 10.0 111.144 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.5 mt -88.98 155.38 19.53 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 124.372 1.045 . . . . 10.0 111.096 179.562 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.1 pttt -138.35 105.64 7.82 Favored Pre-proline 0 C--N 1.319 -0.723 0 N-CA-C 103.911 -2.625 . . . . 10.0 103.911 179.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.538 ' HD2' ' HE1' ' A' ' 10' ' ' MET . 95.8 Cg_exo -51.15 -166.68 0.0 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.327 0 C-N-CA 125.04 3.827 . . . . 10.0 119.123 179.785 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.601 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 4.7 p30 -153.22 167.79 28.13 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 112.724 -2.035 . . . . 10.0 106.522 -179.555 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.45 ' HB2' ' CZ ' ' A' ' 130' ' ' PHE . 0.3 OUTLIER -149.97 121.07 7.74 Favored 'General case' 0 CA--C 1.497 -1.085 0 C-N-CA 116.994 -1.882 . . . . 10.0 112.819 -179.433 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.626 ' HA ' ' CE3' ' A' ' 8' ' ' TRP . 2.4 tt0 -110.36 103.12 11.73 Favored 'General case' 0 CA--C 1.509 -0.611 0 O-C-N 119.95 -1.719 . . . . 10.0 106.91 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 67.6 mt -93.44 130.13 42.89 Favored 'Isoleucine or valine' 0 C--O 1.243 0.737 0 CA-C-N 115.115 -0.948 . . . . 10.0 108.906 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -119.13 122.65 69.76 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.934 0 N-CA-C 107.04 -1.467 . . . . 10.0 107.04 -179.885 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -143.78 107.05 4.54 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 105.921 -1.881 . . . . 10.0 105.921 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -81.03 -51.44 8.5 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 123.281 1.515 . . . . 10.0 107.822 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -155.15 -83.93 0.04 OUTLIER Glycine 0 C--N 1.345 1.06 0 N-CA-C 108.916 -1.674 . . . . 10.0 108.916 -179.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -111.27 -1.61 16.01 Favored 'General case' 0 N--CA 1.443 -0.817 0 O-C-N 121.124 -1.221 . . . . 10.0 109.658 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 65.9 m170 -107.5 102.87 12.1 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 109.085 -0.709 . . . . 10.0 109.085 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 2.5 ttt -95.15 151.13 19.47 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 116.495 2.035 . . . . 10.0 116.495 -179.843 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 19.4 mt -145.64 127.42 8.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 105.939 -1.874 . . . . 10.0 105.939 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.4 mp -112.2 123.66 68.15 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 CA-C-N 114.664 -1.153 . . . . 10.0 108.328 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 4.9 tpt180 -114.34 86.6 2.46 Favored 'General case' 0 C--N 1.319 -0.744 0 C-N-CA 124.714 1.206 . . . . 10.0 111.581 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 93.7 m -87.63 131.47 34.42 Favored 'General case' 0 N--CA 1.444 -0.728 0 N-CA-C 103.033 -2.951 . . . . 10.0 103.033 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 3.9 mt -105.51 66.56 0.74 Allowed 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 120.497 3.517 . . . . 10.0 120.497 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 43.8 m -76.84 116.57 17.62 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 102.706 -3.072 . . . . 10.0 102.706 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -57.58 -17.87 16.6 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 108.043 -1.095 . . . . 10.0 108.043 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.404 ' CE1' HD12 ' A' ' 32' ' ' ILE . 0.3 OUTLIER -117.93 105.7 12.18 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 106.86 -1.533 . . . . 10.0 106.86 179.914 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 6.0 mmt-85 61.52 92.14 0.05 Allowed 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 114.385 -1.279 . . . . 10.0 112.816 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -40.85 150.21 0.07 Allowed 'General case' 0 CA--C 1.532 0.277 0 O-C-N 126.707 2.504 . . . . 10.0 113.067 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -132.33 98.0 4.27 Favored 'General case' 0 C--N 1.311 -1.072 0 N-CA-C 103.012 -2.958 . . . . 10.0 103.012 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.4 ' CG2' ' N ' ' A' ' 62' ' ' MET . 1.7 mp -135.18 146.84 29.61 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.055 0 N-CA-C 115.164 1.542 . . . . 10.0 115.164 179.785 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . 0.4 ' N ' ' CG2' ' A' ' 61' ' ' ILE . 0.0 OUTLIER -147.09 -171.49 3.79 Favored 'General case' 0 C--O 1.216 -0.689 0 N-CA-C 106.318 -1.734 . . . . 10.0 106.318 179.905 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -167.64 123.79 1.09 Allowed 'General case' 0 C--O 1.223 -0.312 0 N-CA-C 100.923 -3.732 . . . . 10.0 100.923 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.449 ' CE1' ' CE1' ' A' ' 70' ' ' PHE . 12.7 m-85 -123.42 -175.0 3.09 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 115.144 1.535 . . . . 10.0 115.144 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -133.71 95.3 3.44 Favored 'General case' 0 N--CA 1.443 -0.782 0 N-CA-C 103.729 -2.693 . . . . 10.0 103.729 179.798 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 9.4 t -53.27 137.68 13.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 O-C-N 124.971 1.419 . . . . 10.0 109.046 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 76.64 15.44 81.56 Favored Glycine 0 N--CA 1.443 -0.877 0 CA-C-O 117.462 -1.744 . . . . 10.0 113.113 -179.78 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 3.8 tppt? -139.41 132.32 29.33 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 125.308 1.443 . . . . 10.0 112.116 -179.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -69.83 148.95 48.42 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 118.153 -0.927 . . . . 10.0 109.474 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.449 ' CE1' ' CE1' ' A' ' 64' ' ' PHE . 3.6 p90 -155.17 161.59 41.18 Favored 'General case' 0 C--O 1.245 0.841 0 O-C-N 124.894 1.372 . . . . 10.0 107.813 -179.787 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -100.6 123.32 44.65 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.518 -0.919 . . . . 10.0 108.518 179.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -75.01 78.03 2.2 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 114.696 -1.138 . . . . 10.0 113.639 -179.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -60.92 133.56 56.22 Favored 'General case' 0 C--N 1.316 -0.891 0 C-N-CA 119.126 -1.03 . . . . 10.0 108.247 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.0 tp -147.58 99.57 3.13 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 117.67 -1.157 . . . . 10.0 113.071 179.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.499 HG23 ' O ' ' A' ' 75' ' ' THR . 3.4 t -127.5 78.78 1.84 Allowed 'General case' 0 N--CA 1.443 -0.797 0 O-C-N 124.723 1.265 . . . . 10.0 108.837 -179.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 153.25 110.94 0.43 Allowed Glycine 0 C--O 1.244 0.775 0 C-N-CA 120.006 -1.092 . . . . 10.0 110.671 179.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.6 mt 69.71 106.22 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 N-CA-C 107.527 -1.286 . . . . 10.0 107.527 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 87.64 -33.95 0.03 OUTLIER 'General case' 0 C--O 1.242 0.662 0 O-C-N 127.492 2.995 . . . . 10.0 114.319 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.2 p30 35.04 97.62 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.808 0 C-N-CA 126.956 2.103 . . . . 10.0 116.286 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.479 ' HD2' ' CZ ' ' A' ' 104' ' ' ARG . 13.6 ttp180 -124.8 -65.62 1.02 Allowed 'General case' 0 CA--C 1.512 -0.493 0 O-C-N 119.629 -1.919 . . . . 10.0 115.196 -179.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 76.02 120.95 0.05 OUTLIER 'General case' 0 N--CA 1.439 -1.017 0 N-CA-C 103.882 -2.636 . . . . 10.0 103.882 179.658 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -155.63 -174.46 4.98 Favored 'General case' 0 CA--C 1.512 -0.486 0 N-CA-C 108.953 -0.758 . . . . 10.0 108.953 179.898 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 4.0 ptm -121.76 148.33 44.79 Favored 'General case' 0 N--CA 1.438 -1.028 0 N-CA-C 100.237 -3.986 . . . . 10.0 100.237 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.437 HG21 ' NE2' ' A' ' 97' ' ' GLN . 1.2 m -155.68 150.29 26.12 Favored 'General case' 0 CA--C 1.501 -0.914 0 N-CA-C 114.611 1.337 . . . . 10.0 114.611 179.95 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 16.4 m -133.69 106.71 7.51 Favored 'General case' 0 N--CA 1.438 -1.052 0 O-C-N 120.965 -1.085 . . . . 10.0 109.059 -179.779 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.8 m -90.01 147.06 5.46 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.61 0 N-CA-C 103.205 -2.887 . . . . 10.0 103.205 179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -163.83 169.51 18.16 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 126.479 2.362 . . . . 10.0 114.207 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 2.6 m-90 -97.83 122.86 41.44 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 124.096 0.958 . . . . 10.0 110.467 179.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -99.49 -63.21 1.15 Allowed 'General case' 0 C--O 1.247 0.944 0 N-CA-C 101.93 -3.359 . . . . 10.0 101.93 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -160.53 92.92 0.12 Allowed Glycine 0 CA--C 1.498 -1.011 0 N-CA-C 108.34 -1.904 . . . . 10.0 108.34 179.769 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 57.53 30.69 19.12 Favored 'General case' 0 C--N 1.318 -0.773 0 O-C-N 124.951 1.03 . . . . 10.0 113.054 -179.683 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.4 mtpt -148.42 166.15 28.99 Favored 'General case' 0 C--O 1.238 0.49 0 N-CA-C 109.282 -0.636 . . . . 10.0 109.282 -179.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.2 tt -117.57 116.65 27.52 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 105.032 -2.211 . . . . 10.0 105.032 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 25.0 mm100 -106.9 156.86 18.24 Favored 'General case' 0 N--CA 1.445 -0.724 0 O-C-N 118.411 -2.681 . . . . 10.0 111.429 179.759 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -148.02 142.48 26.39 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 118.946 -1.101 . . . . 10.0 112.126 -179.676 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 57.6 t -131.68 106.92 12.42 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 CA-C-N 114.128 -1.397 . . . . 10.0 109.133 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.437 ' NE2' HG21 ' A' ' 84' ' ' THR . 3.2 mp0 -91.72 114.92 27.59 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 106.144 -1.799 . . . . 10.0 106.144 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.01 -85.37 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 116.651 -1.642 . . . . 10.0 113.734 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 40.66 -142.92 0.69 Allowed Glycine 0 CA--C 1.528 0.887 0 O-C-N 125.284 1.615 . . . . 10.0 112.475 -179.683 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.47 ' H ' ' NH1' ' A' ' 104' ' ' ARG . 3.1 mm-40 -105.19 -159.27 0.7 Allowed 'General case' 0 C--N 1.315 -0.929 0 O-C-N 126.785 2.109 . . . . 10.0 110.461 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 68.22 -166.22 0.19 Allowed 'General case' 0 C--N 1.316 -0.855 0 O-C-N 126.333 2.271 . . . . 10.0 113.636 179.875 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -135.18 12.33 3.56 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 125.249 1.419 . . . . 10.0 114.445 -179.854 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -149.76 41.7 0.81 Allowed Glycine 0 N--CA 1.467 0.701 0 N-CA-C 116.151 1.22 . . . . 10.0 116.151 179.749 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.479 ' CZ ' ' HD2' ' A' ' 80' ' ' ARG . 70.2 mtt180 -91.73 129.4 37.71 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 113.829 1.048 . . . . 10.0 113.829 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 148.41 159.72 8.64 Favored Glycine 0 N--CA 1.462 0.379 0 C-N-CA 117.369 -2.348 . . . . 10.0 110.668 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 16.2 m0 -123.41 171.19 9.63 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 124.818 1.247 . . . . 10.0 109.75 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 3.4 m -153.35 112.98 3.85 Favored 'General case' 0 C--O 1.212 -0.91 0 N-CA-C 106.466 -1.679 . . . . 10.0 106.466 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -93.81 170.64 9.41 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 122.252 1.025 . . . . 10.0 112.567 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 2.0 t90 -176.37 108.56 0.08 Allowed 'General case' 0 C--O 1.219 -0.525 0 N-CA-C 106.935 -1.506 . . . . 10.0 106.935 179.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 54.1 mt -92.6 129.63 42.9 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 CA-C-O 124.275 1.988 . . . . 10.0 111.294 -179.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -110.48 -164.26 0.91 Allowed 'General case' 0 C--O 1.242 0.659 0 N-CA-C 106.803 -1.554 . . . . 10.0 106.803 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -96.78 108.06 3.61 Favored Glycine 0 CA--C 1.522 0.506 0 N-CA-C 107.541 -2.224 . . . . 10.0 107.541 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 78.25 12.29 1.7 Allowed 'General case' 0 C--O 1.214 -0.774 0 N-CA-C 108.461 -0.94 . . . . 10.0 108.461 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -149.79 149.88 31.18 Favored 'General case' 0 CA--C 1.509 -0.632 0 CA-C-O 123.195 1.474 . . . . 10.0 110.849 179.747 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.529 ' HB3' ' HB2' ' A' ' 130' ' ' PHE . 11.9 tp -116.83 121.27 41.03 Favored 'General case' 0 C--O 1.241 0.611 0 N-CA-C 104.3 -2.481 . . . . 10.0 104.3 -179.744 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 59.7 t-80 -114.13 117.14 30.38 Favored 'General case' 0 C--O 1.213 -0.849 0 N-CA-C 106.881 -1.526 . . . . 10.0 106.881 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.526 HD21 ' HG3' ' A' ' 119' ' ' MET . 0.6 OUTLIER -128.62 154.26 46.41 Favored 'General case' 0 CA--C 1.51 -0.567 0 O-C-N 126.0 2.063 . . . . 10.0 110.704 -179.987 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -143.36 126.48 16.46 Favored 'General case' 0 CA--C 1.495 -1.161 0 N-CA-C 106.747 -1.575 . . . . 10.0 106.747 179.647 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.526 ' HG3' HD21 ' A' ' 117' ' ' LEU . 28.7 mtp -107.97 126.75 53.08 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 113.68 -1.6 . . . . 10.0 113.006 179.929 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.611 ' HG3' HG23 ' A' ' 125' ' ' THR . 0.0 OUTLIER -125.82 142.38 51.54 Favored 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 118.725 -1.19 . . . . 10.0 110.17 -179.931 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -158.49 127.55 5.58 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.42 -0.956 . . . . 10.0 108.42 179.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 34.86 56.84 0.75 Allowed 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 117.881 2.548 . . . . 10.0 117.881 179.903 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 77.09 11.32 85.67 Favored Glycine 0 C--N 1.317 -0.482 0 N-CA-C 116.763 1.465 . . . . 10.0 116.763 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 22.5 t -124.26 130.81 73.55 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.335 0 N-CA-C 108.124 -1.065 . . . . 10.0 108.124 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' THR . . . . . 0.611 HG23 ' HG3' ' A' ' 120' ' ' ARG . 1.6 m -119.23 108.53 14.76 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 126.553 2.408 . . . . 10.0 114.152 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.51 144.59 25.45 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 106.331 -1.729 . . . . 10.0 106.331 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -144.55 179.49 7.25 Favored 'General case' 0 C--O 1.22 -0.454 0 O-C-N 125.414 1.696 . . . . 10.0 112.477 -179.947 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -169.76 145.25 3.0 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-N 114.45 -1.25 . . . . 10.0 108.402 -179.718 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -111.96 98.59 7.24 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 O-C-N 124.687 1.242 . . . . 10.0 108.007 179.769 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . 0.529 ' HB2' ' HB3' ' A' ' 115' ' ' LEU . 5.6 m-85 -74.0 169.67 17.01 Favored 'General case' 0 C--O 1.214 -0.767 0 O-C-N 125.734 1.896 . . . . 10.0 107.435 179.894 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.491 ' HD2' ' C ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -145.15 57.72 1.27 Allowed 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 122.999 1.38 . . . . 10.0 111.068 -179.76 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . 0.733 ' HB3' ' HA ' ' A' ' 8' ' ' TRP . 0.9 OUTLIER -162.14 -144.86 0.1 Allowed 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 104.728 -2.323 . . . . 10.0 104.728 179.588 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' VAL . . . . . 0.553 ' O ' HG13 ' A' ' 133' ' ' VAL . 0.4 OUTLIER 97.01 30.12 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.308 -1.201 0 O-C-N 127.708 3.13 . . . . 10.0 109.284 -179.911 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 51.1 t-80 . . . . . 0 N--CA 1.441 -0.879 0 CA-C-N 112.446 -2.161 . . . . 10.0 109.831 179.666 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 CA--C 1.538 0.518 0 N-CA-C 108.885 -0.784 . . . . 10.0 108.885 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.517 ' CZ ' HD12 ' A' ' 110' ' ' ILE . 3.4 m-30 -89.99 -16.9 28.89 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 117.211 2.3 . . . . 10.0 117.211 -179.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -39.28 146.27 0.09 Allowed 'General case' 0 C--O 1.244 0.787 0 O-C-N 126.358 2.287 . . . . 10.0 113.433 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -179.53 -138.02 3.17 Favored Glycine 0 C--O 1.227 -0.323 0 N-CA-C 118.573 2.189 . . . . 10.0 118.573 -179.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.433 ' CB ' HG12 ' A' ' 133' ' ' VAL . 50.0 m-85 -144.9 -175.88 4.85 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 119.604 -2.116 . . . . 10.0 106.616 -179.655 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.64 ' CE3' ' HB3' ' A' ' 39' ' ' ASP 0.287 11.5 p-90 -158.97 -177.32 6.42 Favored 'General case' 0 C--O 1.214 -0.766 0 N-CA-C 113.883 1.068 . . . . 10.0 113.883 -179.262 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.484 ' HD3' ' HB ' ' A' ' 133' ' ' VAL . 11.5 ptmt 157.3 97.67 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.557 0 O-C-N 127.663 3.102 . . . . 10.0 107.167 178.454 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.448 ' CE ' ' HB2' ' A' ' 13' ' ' ASN . 3.8 ppp? -61.01 139.32 58.08 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-O 117.711 -1.138 . . . . 10.0 112.29 -179.536 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.405 ' O ' HD23 ' A' ' 11' ' ' LEU . 1.1 tt -96.97 -38.27 9.86 Favored 'General case' 0 C--N 1.32 -0.68 0 O-C-N 125.876 1.985 . . . . 10.0 108.289 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -163.27 136.05 5.45 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 116.724 2.12 . . . . 10.0 116.724 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . 0.448 ' HB2' ' CE ' ' A' ' 10' ' ' MET . 29.6 t30 -134.03 152.42 51.84 Favored 'General case' 0 C--O 1.239 0.538 0 O-C-N 125.888 1.992 . . . . 10.0 107.712 -179.795 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -173.76 170.66 3.93 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 118.612 -0.709 . . . . 10.0 112.372 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.463 ' HB2' ' HA ' ' A' ' 126' ' ' CYS . 6.0 m-20 66.95 20.6 10.48 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 127.644 2.377 . . . . 10.0 113.725 179.347 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -67.04 -30.72 70.88 Favored 'General case' 0 CA--C 1.548 0.876 0 CA-C-N 114.62 -1.173 . . . . 10.0 112.418 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -71.24 -42.46 68.82 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-O 122.395 1.093 . . . . 10.0 111.891 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -75.17 -25.14 58.08 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 114.108 -1.406 . . . . 10.0 107.262 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 10.2 t80 -75.5 -43.39 49.36 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 118.335 -0.84 . . . . 10.0 111.016 -179.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.475 HD22 HG21 ' A' ' 25' ' ' VAL . 50.6 mt -72.2 -21.84 61.36 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 113.02 0.748 . . . . 10.0 113.02 -179.621 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.4 ttm-85 -74.4 -24.68 59.15 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 114.49 -1.232 . . . . 10.0 108.833 179.809 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.16 -32.53 69.04 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 122.587 1.184 . . . . 10.0 110.607 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 51.5 mt -100.5 -7.92 23.67 Favored 'General case' 0 C--O 1.236 0.379 0 O-C-N 119.669 -1.894 . . . . 10.0 110.668 179.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.403 ' OD1' ' N ' ' A' ' 24' ' ' ASP . 0.3 OUTLIER 51.35 62.85 2.5 Favored 'General case' 0 C--O 1.245 0.864 0 O-C-N 124.085 0.865 . . . . 10.0 111.935 179.854 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.527 HG12 ' HB2' ' A' ' 78' ' ' ASP . 20.8 m -94.29 39.71 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 N-CA-C 104.054 -2.572 . . . . 10.0 104.054 179.959 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 65.55 154.63 0.08 Allowed 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 115.719 1.748 . . . . 10.0 115.719 -179.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 15.5 m -72.11 -22.07 20.91 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.656 0 N-CA-C 114.886 1.439 . . . . 10.0 114.886 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -73.65 -27.08 61.06 Favored 'General case' 0 C--O 1.234 0.28 0 O-C-N 124.838 1.336 . . . . 10.0 111.468 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.458 HD22 ' CG2' ' A' ' 25' ' ' VAL . 0.2 OUTLIER -76.27 -30.56 57.87 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 119.556 -0.858 . . . . 10.0 112.96 179.833 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.72 -22.89 61.56 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-O 124.189 1.947 . . . . 10.0 110.214 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.33 -41.51 33.42 Favored 'General case' 0 N--CA 1.444 -0.728 0 N-CA-C 107.384 -1.339 . . . . 10.0 107.384 -179.733 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.2 mp -72.58 -35.5 51.0 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.512 0 O-C-N 127.315 2.884 . . . . 10.0 110.499 -179.742 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.32 -31.05 43.09 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 113.18 -1.827 . . . . 10.0 113.22 179.804 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -56.97 -30.57 64.2 Favored 'General case' 0 C--N 1.318 -0.765 0 O-C-N 119.753 -1.842 . . . . 10.0 115.213 179.672 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -110.81 40.59 1.98 Allowed 'General case' 0 C--N 1.322 -0.596 0 O-C-N 124.563 1.164 . . . . 10.0 109.511 179.877 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -117.08 131.56 56.89 Favored 'General case' 0 CA--C 1.515 -0.396 0 C-N-CA 124.386 1.074 . . . . 10.0 109.686 179.952 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -143.97 100.79 4.96 Favored Pre-proline 0 N--CA 1.47 0.546 0 N-CA-C 106.776 -1.564 . . . . 10.0 106.776 179.821 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -98.94 168.47 0.56 Allowed 'Trans proline' 0 N--CA 1.447 -1.247 0 C-N-CA 124.606 3.537 . . . . 10.0 116.458 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.64 ' HB3' ' CE3' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -121.87 -174.29 2.84 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 105.723 -1.955 . . . . 10.0 105.723 -179.725 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.449 ' HB2' ' CE2' ' A' ' 130' ' ' PHE . 2.5 mttt -156.48 105.56 2.27 Favored 'General case' 0 CA--C 1.501 -0.923 0 C-N-CA 118.475 -1.29 . . . . 10.0 112.833 -179.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -97.64 107.86 20.45 Favored 'General case' 0 C--N 1.341 0.234 0 N-CA-C 102.682 -3.081 . . . . 10.0 102.682 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.522 HG23 HD12 ' A' ' 51' ' ' ILE . 86.0 mt -89.27 141.68 13.95 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.022 0 CA-C-O 118.845 -0.598 . . . . 10.0 110.511 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -134.8 158.97 41.79 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 O-C-N 124.727 1.267 . . . . 10.0 107.677 -179.883 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.445 ' HG3' ' CB ' ' A' ' 48' ' ' HIS . 0.0 OUTLIER -129.41 136.93 50.57 Favored 'General case' 0 C--N 1.323 -0.584 0 O-C-N 125.961 2.038 . . . . 10.0 111.566 -179.653 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -133.8 -143.94 0.22 Allowed 'General case' 0 C--O 1.243 0.739 0 CA-C-O 114.776 -2.535 . . . . 10.0 107.791 -179.723 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . 0.423 ' O ' ' NE2' ' A' ' 65' ' ' GLN . . . -42.1 138.28 2.59 Favored Glycine 0 CA--C 1.534 1.237 0 N-CA-C 104.587 -3.405 . . . . 10.0 104.587 179.959 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.54 ' CB ' ' HB3' ' A' ' 65' ' ' GLN . 11.3 m-20 59.19 -115.2 0.76 Allowed 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 102.595 -3.113 . . . . 10.0 102.595 -176.82 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . 0.589 ' CD2' ' HB ' ' A' ' 66' ' ' VAL . 0.1 OUTLIER 164.27 85.04 0.0 OUTLIER 'General case' 0 CA--C 1.5 -0.97 0 O-C-N 126.487 2.367 . . . . 10.0 112.611 175.31 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.7 ' HE2' HD21 ' A' ' 93' ' ' LEU . 36.4 ttm -169.38 83.07 0.13 Allowed 'General case' 0 N--CA 1.435 -1.22 0 N-CA-C 115.771 1.767 . . . . 10.0 115.771 175.416 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.566 HD12 ' C ' ' A' ' 49' ' ' MET . 1.3 mp -117.46 107.22 21.64 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.172 0 N-CA-C 102.208 -3.256 . . . . 10.0 102.208 179.533 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.522 HD12 HG23 ' A' ' 42' ' ' ILE . 0.2 OUTLIER -106.3 108.12 24.35 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.952 0 N-CA-C 109.243 -0.651 . . . . 10.0 109.243 -179.999 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.461 ' HG3' HD13 ' A' ' 61' ' ' ILE . 19.9 ttp180 -101.55 110.24 22.2 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.694 -1.139 . . . . 10.0 113.519 -179.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 20.7 m -97.77 122.93 41.45 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 102.24 -3.244 . . . . 10.0 102.24 -179.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -125.83 61.62 1.25 Allowed 'General case' 0 C--N 1.324 -0.51 1 N-CA-C 121.917 4.043 . . . . 10.0 121.917 -179.795 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.0 m -65.5 -175.94 0.3 Allowed 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 125.908 1.683 . . . . 10.0 107.976 -179.755 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 58.7 p -105.15 -20.93 13.36 Favored 'General case' 0 C--O 1.242 0.69 0 CA-C-O 117.388 -1.291 . . . . 10.0 109.927 179.698 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -73.48 -56.64 4.78 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 122.892 1.329 . . . . 10.0 108.609 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.42 -165.06 1.9 Allowed 'General case' 0 C--O 1.244 0.814 0 CA-C-N 114.183 -1.371 . . . . 10.0 110.089 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -156.84 133.28 9.94 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-O 123.965 1.841 . . . . 10.0 111.849 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -109.9 125.48 52.85 Favored 'General case' 0 CA--C 1.501 -0.929 0 N-CA-C 102.398 -3.186 . . . . 10.0 102.398 179.751 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.461 HD13 ' HG3' ' A' ' 52' ' ' ARG . 1.1 mt -132.73 158.46 43.28 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.706 0 O-C-N 118.237 -2.789 . . . . 10.0 116.102 -179.663 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -141.23 155.23 46.05 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 104.406 -2.442 . . . . 10.0 104.406 -179.911 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -131.67 69.61 1.47 Allowed 'General case' 0 C--N 1.311 -1.066 1 N-CA-C 99.436 -4.283 . . . . 10.0 99.436 179.884 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.467 ' HB3' ' HB3' ' A' ' 49' ' ' MET . 2.2 m-85 -69.78 -172.91 0.55 Allowed 'General case' 0 C--O 1.241 0.657 0 CA-C-N 113.383 -1.735 . . . . 10.0 113.546 179.772 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.54 ' HB3' ' CB ' ' A' ' 47' ' ' ASP . 22.6 mt-30 -171.58 121.32 0.5 Allowed 'General case' 0 C--N 1.317 -0.838 0 C-N-CA 128.001 2.52 . . . . 10.0 107.092 -179.404 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.589 ' HB ' ' CD2' ' A' ' 48' ' ' HIS . 24.8 t -58.89 156.32 2.29 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 C-N-CA 125.961 1.704 . . . . 10.0 113.231 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.453 ' N ' ' CG1' ' A' ' 66' ' ' VAL . . . 63.58 11.26 41.02 Favored Glycine 0 C--O 1.218 -0.889 0 N-CA-C 118.38 2.112 . . . . 10.0 118.38 179.791 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 9.0 tttp -124.26 148.63 47.23 Favored 'General case' 0 C--O 1.22 -0.459 0 CA-C-N 118.105 0.953 . . . . 10.0 112.241 179.901 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 53.4 tt0 -91.12 136.58 32.99 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 125.402 1.688 . . . . 10.0 109.076 -179.807 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -122.53 179.02 4.74 Favored 'General case' 0 C--N 1.318 -0.797 0 C-N-CA 124.566 1.146 . . . . 10.0 108.358 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -154.03 67.98 0.75 Allowed 'General case' 0 C--N 1.317 -0.811 0 O-C-N 127.205 2.815 . . . . 10.0 111.198 -179.754 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -51.71 126.7 18.52 Favored 'General case' 0 N--CA 1.442 -0.847 0 N-CA-C 112.355 0.502 . . . . 10.0 112.355 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.41 ' OD2' HD12 ' A' ' 74' ' ' LEU . 5.3 p-10 -70.68 -20.02 62.73 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.785 0.802 . . . . 10.0 110.227 179.959 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.74 HD13 ' O ' ' A' ' 74' ' ' LEU . 0.0 OUTLIER -156.75 127.46 6.69 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 116.395 1.998 . . . . 10.0 116.395 -179.959 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.592 ' N ' ' HA ' ' A' ' 79' ' ' ASP . 18.3 m -96.43 123.59 40.14 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-O 124.116 1.913 . . . . 10.0 111.194 -179.591 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 52.48 -133.22 39.05 Favored Glycine 0 N--CA 1.441 -0.994 0 N-CA-C 107.172 -2.371 . . . . 10.0 107.172 179.797 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.803 ' O ' HD12 ' A' ' 77' ' ' ILE . 0.9 OUTLIER -107.38 -11.85 10.48 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 N-CA-C 106.843 -1.54 . . . . 10.0 106.843 179.374 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.527 ' HB2' HG12 ' A' ' 25' ' ' VAL . 0.2 OUTLIER -82.17 -4.97 58.09 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-N 113.67 -1.604 . . . . 10.0 109.262 179.848 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.592 ' HA ' ' N ' ' A' ' 75' ' ' THR . 4.0 m-20 39.68 -128.15 0.35 Allowed 'General case' 0 C--N 1.316 -0.88 0 C-N-CA 128.314 2.646 . . . . 10.0 115.953 -179.596 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 16.9 ttt85 84.8 114.37 0.05 Allowed 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 120.481 1.491 . . . . 10.0 107.231 -179.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 5.4 mmtp -57.19 141.84 44.96 Favored 'General case' 0 C--N 1.316 -0.873 0 O-C-N 127.156 2.785 . . . . 10.0 105.583 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 72.8 m -152.12 149.66 29.04 Favored 'General case' 0 C--O 1.213 -0.86 0 O-C-N 125.412 1.695 . . . . 10.0 109.601 -179.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.6 mtm -100.69 114.54 28.36 Favored 'General case' 0 C--O 1.241 0.617 1 N-CA-C 100.163 -4.014 . . . . 10.0 100.163 179.869 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 98.8 m -112.12 135.53 52.66 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 115.844 1.794 . . . . 10.0 115.844 179.734 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -131.3 145.22 51.79 Favored 'General case' 0 C--N 1.343 0.287 0 N-CA-C 108.134 -1.061 . . . . 10.0 108.134 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.489 HG11 ' HE3' ' A' ' 49' ' ' MET . 1.2 t -113.23 172.88 3.1 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.986 0 N-CA-C 104.02 -2.585 . . . . 10.0 104.02 179.887 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -169.49 169.11 9.05 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 120.526 1.512 . . . . 10.0 113.96 179.783 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -106.81 122.62 46.76 Favored 'General case' 0 C--O 1.224 -0.24 0 O-C-N 125.844 1.965 . . . . 10.0 106.905 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.424 ' HB3' ' HB2' ' A' ' 92' ' ' LYS . 24.5 t0 -107.69 3.89 25.15 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 101.381 -3.563 . . . . 10.0 101.381 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 111.47 -96.46 0.88 Allowed Glycine 0 C--O 1.24 0.51 0 N-CA-C 104.066 -3.614 . . . . 10.0 104.066 -179.719 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 8.9 p30 -84.83 -35.78 22.06 Favored 'General case' 0 C--O 1.222 -0.373 0 C-N-CA 119.641 -0.824 . . . . 10.0 109.657 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.424 ' HB2' ' HB3' ' A' ' 89' ' ' ASP . 1.6 mtmm -82.17 142.6 32.07 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 124.009 0.924 . . . . 10.0 111.843 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.7 HD21 ' HE2' ' A' ' 49' ' ' MET . 9.8 tp -119.22 100.72 7.5 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 104.254 -2.499 . . . . 10.0 104.254 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . 0.444 ' HB3' HG23 ' A' ' 107' ' ' THR . 10.6 pt20 -123.92 168.07 13.28 Favored 'General case' 0 CA--C 1.497 -1.073 0 N-CA-C 114.985 1.476 . . . . 10.0 114.985 179.836 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 19.9 p -131.67 -173.03 3.01 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-N 113.547 -1.66 . . . . 10.0 110.026 179.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.4 HG12 ' N ' ' A' ' 97' ' ' GLN . 7.0 t -134.76 -74.08 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.744 0 C-N-CA 125.062 1.345 . . . . 10.0 109.475 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.4 ' N ' HG12 ' A' ' 96' ' ' VAL . 21.7 mt-30 87.78 118.45 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.569 0 O-C-N 127.273 2.858 . . . . 10.0 110.423 179.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.8 mmtt -88.96 114.2 25.32 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 125.386 1.474 . . . . 10.0 114.247 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . 0.505 ' N ' HH22 ' A' ' 104' ' ' ARG . . . -153.32 -160.05 9.47 Favored Glycine 0 CA--C 1.523 0.573 0 N-CA-C 108.753 -1.739 . . . . 10.0 108.753 -179.911 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 14.4 tm-20 -86.63 -14.51 42.5 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 116.645 2.091 . . . . 10.0 116.645 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 15.3 mmtt -81.78 178.44 8.32 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 113.273 0.842 . . . . 10.0 113.273 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 3.7 pm0 -121.71 28.89 7.42 Favored 'General case' 0 CA--C 1.509 -0.6 0 C-N-CA 125.933 1.693 . . . . 10.0 110.517 179.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -159.19 -18.4 0.03 OUTLIER Glycine 0 N--CA 1.462 0.383 0 CA-C-O 116.554 -2.248 . . . . 10.0 118.481 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.505 HH22 ' N ' ' A' ' 99' ' ' GLY . 24.0 mtm-85 -47.4 144.82 2.75 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 120.209 2.004 . . . . 10.0 109.017 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 129.65 152.11 7.47 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 107.592 -2.203 . . . . 10.0 107.592 -179.786 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -124.95 -170.97 2.26 Favored 'General case' 0 C--O 1.239 0.531 0 C-N-CA 125.223 1.409 . . . . 10.0 109.916 179.713 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . 0.444 HG23 ' HB3' ' A' ' 94' ' ' GLN . 3.1 m -161.39 117.75 2.18 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-O 117.307 -1.33 . . . . 10.0 109.55 179.724 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 -93.45 128.17 39.42 Favored 'General case' 0 C--N 1.318 -0.772 0 O-C-N 126.796 2.56 . . . . 10.0 107.287 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 4.5 t90 -139.55 101.47 4.23 Favored 'General case' 0 CA--C 1.511 -0.521 0 O-C-N 120.505 -1.372 . . . . 10.0 112.271 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.517 HD12 ' CZ ' ' A' ' 4' ' ' PHE . 72.2 mt -85.64 119.4 34.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 O-C-N 126.405 2.316 . . . . 10.0 114.069 179.689 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -132.25 148.09 52.44 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 104.301 -2.481 . . . . 10.0 104.301 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 26.73 -103.16 0.01 OUTLIER Glycine 0 N--CA 1.445 -0.737 0 O-C-N 128.161 3.413 . . . . 10.0 111.926 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -116.05 24.77 11.19 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 125.766 1.509 . . . . 10.0 112.251 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.485 ' C ' HD23 ' A' ' 115' ' ' LEU . 0.1 OUTLIER -139.99 163.19 33.33 Favored 'General case' 0 CA--C 1.501 -0.912 0 CA-C-O 123.502 1.62 . . . . 10.0 114.13 -179.995 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.485 HD23 ' C ' ' A' ' 114' ' ' GLU . 4.5 mt -124.6 108.78 12.42 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 104.781 -2.303 . . . . 10.0 104.781 -179.959 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -94.85 73.95 3.57 Favored 'General case' 0 C--N 1.313 -1.006 0 C-N-CA 119.332 -0.947 . . . . 10.0 109.33 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.525 HD22 ' HB2' ' A' ' 128' ' ' GLN . 8.9 tt -66.89 153.68 42.88 Favored 'General case' 0 N--CA 1.45 -0.456 0 O-C-N 126.355 2.285 . . . . 10.0 112.71 179.79 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -141.51 138.49 32.81 Favored 'General case' 0 C--O 1.214 -0.807 0 O-C-N 125.037 1.461 . . . . 10.0 109.986 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -136.21 121.44 19.12 Favored 'General case' 0 C--N 1.322 -0.596 0 O-C-N 124.738 1.274 . . . . 10.0 111.013 179.781 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -123.19 152.99 40.69 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 114.842 -1.072 . . . . 10.0 111.161 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -165.07 130.38 2.62 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 104.829 -2.286 . . . . 10.0 104.829 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 47.22 30.27 1.4 Allowed 'General case' 0 C--N 1.321 -0.672 0 O-C-N 125.345 1.653 . . . . 10.0 111.977 -179.884 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 86.58 -8.41 75.21 Favored Glycine 0 CA--C 1.535 1.335 0 C-N-CA 119.604 -1.284 . . . . 10.0 114.497 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 22.1 t -86.08 124.24 40.12 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 CA-C-N 118.723 1.262 . . . . 10.0 108.517 -179.787 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 5.4 m -103.42 120.6 41.14 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-O 123.943 1.83 . . . . 10.0 114.39 -179.813 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . 0.463 ' HA ' ' HB2' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -124.92 129.4 50.29 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 112.443 -2.162 . . . . 10.0 105.272 179.996 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -115.46 173.77 6.35 Favored 'General case' 0 C--O 1.24 0.597 0 N-CA-C 115.319 1.6 . . . . 10.0 115.319 179.784 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . 0.525 ' HB2' HD22 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -151.87 88.71 1.41 Allowed 'General case' 0 CA--C 1.512 -0.519 0 CA-C-N 113.012 -1.904 . . . . 10.0 110.3 179.832 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 38.5 t -70.17 119.13 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 N-CA-C 104.874 -2.269 . . . . 10.0 104.874 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . 0.449 ' CE2' ' HB2' ' A' ' 40' ' ' LYS . 0.3 OUTLIER -101.03 174.86 5.81 Favored 'General case' 0 C--O 1.218 -0.562 0 CA-C-O 123.687 1.708 . . . . 10.0 108.94 179.758 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 2.3 tptm -143.22 88.88 2.05 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 113.578 -1.646 . . . . 10.0 106.616 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 22.9 ttpt -65.08 98.0 0.28 Allowed 'General case' 0 CA--C 1.504 -0.796 0 C-N-CA 118.008 -1.477 . . . . 10.0 107.709 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' VAL . . . . . 0.495 HG13 ' N ' ' A' ' 134' ' ' HIS . 7.1 p -53.66 -37.25 31.0 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.353 0 CA-C-N 114.417 -1.265 . . . . 10.0 110.209 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' HIS . . . . . 0.495 ' N ' HG13 ' A' ' 133' ' ' VAL . 1.9 t-160 . . . . . 0 N--CA 1.438 -1.064 0 O-C-N 126.049 2.093 . . . . 10.0 111.511 -179.981 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.217 -0.611 0 CA-C-O 118.0 -1.0 . . . . 10.0 111.751 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.412 ' CE2' ' CD1' ' A' ' 93' ' ' LEU . 19.8 m-30 -90.11 -9.67 47.49 Favored 'General case' 0 C--N 1.319 -0.74 0 O-C-N 127.881 3.238 . . . . 10.0 116.326 -179.906 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 71.8 m-20 -43.57 143.8 0.9 Allowed 'General case' 0 N--CA 1.471 0.619 0 O-C-N 127.253 2.845 . . . . 10.0 111.905 179.97 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . 0.429 ' HA2' ' HA ' ' A' ' 134' ' ' HIS . . . -146.58 -177.49 21.23 Favored Glycine 0 C--N 1.346 1.12 0 N-CA-C 119.669 2.628 . . . . 10.0 119.669 -179.569 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -151.48 46.44 0.8 Allowed 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 103.839 -2.652 . . . . 10.0 103.839 -179.582 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.618 ' CZ3' ' CB ' ' A' ' 39' ' ' ASP 0.397 30.2 p-90 -37.61 169.61 0.0 OUTLIER 'General case' 0 C--O 1.211 -0.931 0 C-N-CA 127.19 2.196 . . . . 10.0 115.272 179.331 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.509 ' HE3' ' HB2' ' A' ' 132' ' ' LYS . 0.0 OUTLIER -157.55 150.49 23.26 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 111.633 -2.531 . . . . 10.0 104.473 174.976 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.3 ppp? -106.4 168.37 9.2 Favored 'General case' 0 C--O 1.24 0.561 0 O-C-N 119.834 -1.791 . . . . 10.0 112.67 -179.777 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -137.3 -59.9 0.68 Allowed 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 105.719 -1.956 . . . . 10.0 105.719 -179.902 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 61.8 p -161.85 173.68 14.21 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 124.689 2.185 . . . . 10.0 112.623 179.771 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . 0.42 ' OD1' ' N ' ' A' ' 13' ' ' ASN . 3.1 p-10 -126.16 161.35 27.87 Favored 'General case' 0 CA--C 1.513 -0.481 0 CA-C-N 112.67 -2.059 . . . . 10.0 108.088 -179.597 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 35.9 tp10 -149.0 134.8 18.86 Favored 'General case' 0 C--O 1.215 -0.722 0 O-C-N 119.539 -1.975 . . . . 10.0 113.519 179.676 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 61.25 27.84 17.49 Favored 'General case' 0 C--O 1.244 0.78 0 C-N-CA 125.015 1.326 . . . . 10.0 111.846 -179.958 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.497 ' CD2' HD11 ' A' ' 20' ' ' LEU . 40.2 t80 -69.16 -27.62 65.69 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 114.797 1.406 . . . . 10.0 114.797 -179.399 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -76.61 -29.07 56.37 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 120.205 -1.559 . . . . 10.0 112.778 179.916 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -79.37 -28.18 41.94 Favored 'General case' 0 C--O 1.219 -0.505 0 CA-C-N 114.512 -1.222 . . . . 10.0 109.445 -179.948 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.6 ' CE1' HD11 ' A' ' 23' ' ' LEU . 0.2 OUTLIER -65.9 -43.67 87.55 Favored 'General case' 0 CA--C 1.555 1.172 0 O-C-N 125.489 1.743 . . . . 10.0 108.978 -179.998 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.503 ' CD1' ' HG3' ' A' ' 30' ' ' ARG . 0.7 OUTLIER -76.82 -23.22 52.8 Favored 'General case' 0 C--O 1.22 -0.462 0 O-C-N 126.146 2.154 . . . . 10.0 112.609 179.707 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.89 -26.01 40.39 Favored 'General case' 0 C--N 1.321 -0.662 0 O-C-N 126.224 2.202 . . . . 10.0 108.816 179.531 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.403 ' HB1' ' HB3' ' A' ' 122' ' ' GLU . . . -69.89 -27.64 64.97 Favored 'General case' 0 C--O 1.218 -0.57 0 C-N-CA 125.976 1.711 . . . . 10.0 112.984 179.781 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.6 HD11 ' CE1' ' A' ' 19' ' ' TYR . 0.0 OUTLIER -113.27 9.64 18.37 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 114.197 -1.365 . . . . 10.0 109.886 179.567 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 38.41 72.19 0.14 Allowed 'General case' 0 C--N 1.322 -0.6 0 O-C-N 126.697 2.498 . . . . 10.0 114.957 179.466 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 3.8 m -88.78 170.05 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-O 117.027 -1.463 . . . . 10.0 108.841 -179.661 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 9.0 m120 -53.98 152.63 5.58 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 117.913 -1.042 . . . . 10.0 111.502 179.48 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 2.5 p -71.6 -23.1 22.29 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.855 0 N-CA-C 117.284 2.327 . . . . 10.0 117.284 -179.632 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -79.82 -32.04 40.67 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 114.43 -1.259 . . . . 10.0 109.919 -179.806 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 54.3 tp -70.75 -44.72 66.18 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 114.64 1.348 . . . . 10.0 114.64 -179.732 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.503 ' HG3' ' CD1' ' A' ' 20' ' ' LEU . 18.4 ttp180 -56.86 -36.72 70.37 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 126.254 1.822 . . . . 10.0 114.377 179.813 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.87 -32.66 61.93 Favored 'General case' 0 C--O 1.218 -0.585 0 O-C-N 126.274 2.234 . . . . 10.0 110.588 179.806 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 20.7 mm -77.41 -41.04 29.52 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.453 0 O-C-N 125.489 1.743 . . . . 10.0 109.261 -179.739 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -80.35 -6.25 57.69 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.785 -0.643 . . . . 10.0 112.399 179.828 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -93.46 -30.42 15.06 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 115.294 1.59 . . . . 10.0 115.294 -179.785 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -92.33 -14.06 29.32 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 120.017 1.281 . . . . 10.0 110.456 179.893 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.4 HD11 ' HB3' ' A' ' 57' ' ' PHE . 0.0 OUTLIER -80.42 118.26 21.89 Favored 'General case' 0 CA--C 1.514 -0.423 0 C-N-CA 125.677 1.591 . . . . 10.0 109.468 -179.735 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.7 135.75 19.7 Favored Pre-proline 0 C--N 1.318 -0.783 0 N-CA-C 106.495 -1.668 . . . . 10.0 106.495 -179.975 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_exo -90.7 179.18 1.83 Allowed 'Trans proline' 0 N--CA 1.447 -1.258 0 C-N-CA 124.268 3.312 . . . . 10.0 119.545 -179.443 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.618 ' CB ' ' CZ3' ' A' ' 8' ' ' TRP . 0.3 OUTLIER -149.39 143.84 26.0 Favored 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 127.636 2.375 . . . . 10.0 104.724 179.72 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.573 ' C ' ' CD1' ' A' ' 8' ' ' TRP . 1.2 tptt -97.56 -143.22 0.3 Allowed 'General case' 0 C--N 1.305 -1.335 0 CA-C-O 114.672 -2.585 . . . . 10.0 106.905 -179.42 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.544 ' HA ' ' CD1' ' A' ' 8' ' ' TRP . 0.2 OUTLIER 152.92 117.32 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.938 0 O-C-N 127.728 3.143 . . . . 10.0 102.77 178.586 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 6.3 mm -121.86 145.76 28.01 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.981 0 O-C-N 124.701 1.251 . . . . 10.0 113.602 179.451 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 67.0 t -147.48 100.36 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 O-C-N 125.911 2.007 . . . . 10.0 106.35 179.898 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -112.01 116.91 31.33 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 124.668 1.187 . . . . 10.0 108.665 179.862 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -118.86 125.73 50.18 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 104.799 -2.297 . . . . 10.0 104.799 -179.942 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 61.32 -115.29 7.68 Favored Glycine 0 C--O 1.223 -0.532 0 N-CA-C 108.951 -1.66 . . . . 10.0 108.951 -179.723 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -112.58 -20.84 11.57 Favored 'General case' 0 C--N 1.321 -0.652 0 O-C-N 121.693 -0.887 . . . . 10.0 110.609 -179.854 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 46.1 m170 -82.45 119.08 23.74 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 107.802 -1.184 . . . . 10.0 107.802 -179.954 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 17.5 ttp -104.21 155.18 18.95 Favored 'General case' 0 C--N 1.32 -0.684 0 O-C-N 126.664 2.478 . . . . 10.0 114.454 179.961 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 4.8 mt -145.7 122.8 4.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 106.419 -1.697 . . . . 10.0 106.419 -179.937 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.5 mp -119.23 131.41 72.0 Favored 'Isoleucine or valine' 0 C--O 1.242 0.699 0 N-CA-C 104.683 -2.34 . . . . 10.0 104.683 179.823 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.84 98.66 6.01 Favored 'General case' 0 N--CA 1.442 -0.872 0 CA-C-N 114.971 -1.013 . . . . 10.0 111.571 -179.76 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 89.2 m -72.33 139.88 48.2 Favored 'General case' 0 C--O 1.219 -0.538 0 N-CA-C 101.784 -3.413 . . . . 10.0 101.784 179.983 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.2 mt -113.11 54.74 0.72 Allowed 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 119.902 3.297 . . . . 10.0 119.902 -179.886 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 64.8 m -93.38 131.01 38.95 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 104.04 -2.578 . . . . 10.0 104.04 -179.757 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -69.51 -13.34 62.29 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 123.236 1.493 . . . . 10.0 107.727 -179.848 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.4 ' HB3' HD11 ' A' ' 36' ' ' LEU . 28.5 t80 -95.22 84.17 4.02 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 106.799 -1.556 . . . . 10.0 106.799 179.954 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.42 ' CZ ' ' HB3' ' A' ' 58' ' ' ARG . 0.0 OUTLIER 50.95 80.11 0.08 Allowed 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 114.471 1.286 . . . . 10.0 114.471 -179.822 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . 0.401 ' OD1' ' N ' ' A' ' 59' ' ' ASN . 4.8 p-10 -71.94 90.62 1.15 Allowed 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 113.747 -1.57 . . . . 10.0 112.206 179.787 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 25.6 p90 -75.32 130.1 38.5 Favored 'General case' 0 C--N 1.321 -0.648 0 O-C-N 126.638 2.461 . . . . 10.0 105.483 -179.854 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.471 HG22 ' N ' ' A' ' 62' ' ' MET . 6.2 mm -104.34 164.28 3.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 O-C-N 121.409 -0.807 . . . . 10.0 111.277 -179.716 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . 0.471 ' N ' HG22 ' A' ' 61' ' ' ILE . 27.7 mmm -144.78 150.98 38.13 Favored 'General case' 0 N--CA 1.442 -0.827 0 N-CA-C 107.291 -1.374 . . . . 10.0 107.291 179.992 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -133.52 88.5 2.49 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 103.684 -2.71 . . . . 10.0 103.684 179.953 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -76.34 178.47 6.49 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 119.619 -1.926 . . . . 10.0 114.474 179.961 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 10.5 mt-30 -147.35 113.98 6.03 Favored 'General case' 0 C--N 1.315 -0.893 0 O-C-N 128.764 3.79 . . . . 10.0 103.187 -179.86 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -62.05 137.52 23.88 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 O-C-N 124.38 1.05 . . . . 10.0 113.721 -179.846 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.99 -25.16 0.67 Allowed Glycine 0 C--O 1.218 -0.869 0 CA-C-O 117.025 -1.986 . . . . 10.0 116.281 179.804 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 15.2 mttp -91.78 160.33 15.38 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 120.492 2.146 . . . . 10.0 116.7 -179.777 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -69.05 158.74 34.2 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 107.947 -1.131 . . . . 10.0 107.947 -179.955 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 45.9 t80 -165.95 113.11 0.91 Allowed 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 113.994 -1.457 . . . . 10.0 113.24 -179.583 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -79.73 145.84 32.7 Favored 'General case' 0 C--N 1.314 -0.955 0 O-C-N 125.181 1.551 . . . . 10.0 107.525 -179.79 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.646 ' OE2' HD23 ' A' ' 74' ' ' LEU . 13.8 tt0 -107.1 -42.24 4.93 Favored 'General case' 0 C--O 1.24 0.591 0 N-CA-C 117.193 2.294 . . . . 10.0 117.193 -179.922 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.434 ' HA ' ' HA ' ' A' ' 81' ' ' LYS . 6.3 t70 53.08 35.95 20.97 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.467 0.651 . . . . 10.0 110.695 179.777 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.646 HD23 ' OE2' ' A' ' 72' ' ' GLU . 0.3 OUTLIER -46.28 117.54 1.61 Allowed 'General case' 0 C--N 1.32 -0.708 0 O-C-N 120.555 -1.341 . . . . 10.0 114.167 179.894 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -129.32 8.24 5.48 Favored 'General case' 0 CA--C 1.514 -0.418 0 O-C-N 121.61 -0.681 . . . . 10.0 109.909 179.956 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . 0.439 ' H ' HD13 ' A' ' 74' ' ' LEU . . . -78.94 -43.54 10.95 Favored Glycine 0 CA--C 1.5 -0.902 0 CA-C-O 117.505 -1.719 . . . . 10.0 110.453 -179.749 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.7 pp -142.44 142.2 27.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 CA-C-N 118.775 1.287 . . . . 10.0 107.917 179.848 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 75.34 -59.02 0.55 Allowed 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.639 0.733 . . . . 10.0 111.632 179.709 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 87.06 82.77 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 115.44 1.645 . . . . 10.0 115.44 179.926 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 3.4 ptt85 -155.32 143.29 19.99 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 113.985 -1.462 . . . . 10.0 111.026 179.767 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.434 ' HA ' ' HA ' ' A' ' 73' ' ' ASP . 4.3 ptpp? -95.21 175.81 6.46 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 103.731 -2.692 . . . . 10.0 103.731 179.894 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 6.0 p -177.84 158.72 1.32 Allowed 'General case' 0 C--O 1.213 -0.82 0 N-CA-C 106.344 -1.725 . . . . 10.0 106.344 179.824 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.6 ttm -105.57 117.83 35.01 Favored 'General case' 0 C--N 1.329 -0.323 1 N-CA-C 98.683 -4.562 . . . . 10.0 98.683 179.998 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 43.0 m -121.24 124.09 43.81 Favored 'General case' 0 C--O 1.215 -0.745 0 CA-C-N 112.068 -2.333 . . . . 10.0 117.113 -179.743 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.53 121.52 36.73 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 114.397 -1.274 . . . . 10.0 108.065 179.919 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 13.8 t -98.01 104.89 16.49 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.875 0 N-CA-C 105.488 -2.041 . . . . 10.0 105.488 -179.819 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -110.59 -178.65 3.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 122.238 1.018 . . . . 10.0 113.358 179.956 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 19.0 m0 -111.91 134.24 53.6 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 112.883 -1.962 . . . . 10.0 107.446 179.75 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -102.95 -58.94 1.79 Allowed 'General case' 0 C--O 1.246 0.892 0 N-CA-C 102.879 -3.008 . . . . 10.0 102.879 179.954 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 157.73 90.01 0.07 OUTLIER Glycine 0 CA--C 1.504 -0.614 0 N-CA-C 105.96 -2.856 . . . . 10.0 105.96 179.819 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 65.9 47.0 2.12 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 108.084 -1.08 . . . . 10.0 108.084 -179.904 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 25.6 mtmt -169.37 124.63 0.85 Allowed 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 125.51 1.524 . . . . 10.0 108.724 -179.991 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.412 ' CD1' ' CE2' ' A' ' 4' ' ' PHE . 0.3 OUTLIER -82.71 77.56 9.45 Favored 'General case' 0 CA--C 1.515 -0.394 0 O-C-N 126.451 2.344 . . . . 10.0 107.576 179.934 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.59 105.88 7.91 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 114.561 -1.199 . . . . 10.0 112.487 -179.982 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -108.45 138.48 44.68 Favored 'General case' 0 C--N 1.341 0.23 0 O-C-N 125.129 1.518 . . . . 10.0 112.598 -179.912 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 40.9 t -125.57 131.93 71.52 Favored 'Isoleucine or valine' 0 C--O 1.242 0.67 0 CA-C-O 124.457 2.075 . . . . 10.0 109.367 179.711 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.438 ' CG ' ' HA2' ' A' ' 105' ' ' GLY . 0.0 OUTLIER -134.95 141.2 46.21 Favored 'General case' 0 C--O 1.242 0.678 0 O-C-N 120.231 -1.543 . . . . 10.0 107.159 179.876 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 9.9 pttp -149.33 110.89 4.49 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 122.586 1.184 . . . . 10.0 111.08 179.988 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -163.37 74.49 0.18 Allowed Glycine 0 C--O 1.221 -0.691 0 O-C-N 119.653 -1.904 . . . . 10.0 112.135 -179.958 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 94.6 23.33 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.579 0 O-C-N 127.458 2.505 . . . . 10.0 115.024 179.791 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.427 ' CE ' ' HA ' ' A' ' 101' ' ' LYS . 0.0 OUTLIER -139.33 -155.49 0.6 Allowed 'General case' 0 N--CA 1.471 0.585 0 O-C-N 126.379 2.3 . . . . 10.0 110.982 -179.948 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -136.77 -57.24 0.73 Allowed 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 125.309 1.443 . . . . 10.0 113.564 -179.979 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -109.31 42.5 1.94 Allowed Glycine 0 N--CA 1.449 -0.436 0 N-CA-C 119.333 2.493 . . . . 10.0 119.333 -179.808 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 3.1 mtm180 -88.18 168.02 13.11 Favored 'General case' 0 C--O 1.244 0.805 0 O-C-N 120.71 -1.465 . . . . 10.0 110.805 -179.961 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . 0.438 ' HA2' ' CG ' ' A' ' 97' ' ' GLN . . . 120.96 139.02 5.63 Favored Glycine 0 N--CA 1.45 -0.426 0 N-CA-C 108.638 -1.785 . . . . 10.0 108.638 -179.819 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 106' ' ' TRP . . . . . 0.48 ' CD1' ' CG ' ' A' ' 119' ' ' MET . 3.1 m0 -104.93 176.5 5.14 Favored 'General case' 0 C--N 1.316 -0.87 0 O-C-N 119.959 -1.906 . . . . 10.0 109.096 -179.754 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 4.5 m -140.62 120.31 13.38 Favored 'General case' 0 C--O 1.222 -0.347 0 O-C-N 126.69 2.493 . . . . 10.0 107.074 179.915 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -108.65 133.31 52.93 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 114.342 -1.299 . . . . 10.0 109.676 -179.979 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 2.0 t90 -138.8 113.27 8.9 Favored 'General case' 0 CA--C 1.502 -0.882 0 O-C-N 125.783 1.927 . . . . 10.0 109.19 179.645 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -82.97 128.51 38.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 121.994 0.902 . . . . 10.0 111.651 -179.981 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -127.05 88.16 2.77 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 122.883 1.325 . . . . 10.0 108.044 179.991 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 53.27 -103.6 0.15 Allowed Glycine 0 C--N 1.346 1.134 0 O-C-N 119.21 -2.181 . . . . 10.0 111.16 -179.79 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . 0.407 ' N ' ' OD1' ' A' ' 113' ' ' ASP . 0.5 OUTLIER -102.17 28.88 5.47 Favored 'General case' 0 N--CA 1.463 0.199 0 C-N-CA 124.378 1.071 . . . . 10.0 113.692 -179.967 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -146.12 145.21 30.43 Favored 'General case' 0 C--N 1.321 -0.669 0 O-C-N 119.73 -1.856 . . . . 10.0 109.68 179.989 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 1.068 ' HG ' HG11 ' A' ' 133' ' ' VAL . 0.1 OUTLIER -107.75 133.96 51.39 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 104.593 -2.373 . . . . 10.0 104.593 -179.559 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -120.72 95.78 4.85 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 106.022 -1.844 . . . . 10.0 106.022 -179.969 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 5.0 tp -101.29 134.0 45.01 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 113.811 -1.54 . . . . 10.0 108.907 179.929 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -133.61 100.83 4.91 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 105.059 -2.2 . . . . 10.0 105.059 179.685 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.48 ' CG ' ' CD1' ' A' ' 106' ' ' TRP . 2.2 ttm -96.39 139.4 32.57 Favored 'General case' 0 CA--C 1.504 -0.821 0 O-C-N 126.449 2.343 . . . . 10.0 113.435 -179.907 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.409 ' O ' ' HB2' ' A' ' 121' ' ' ALA . 3.2 ptt180 -131.27 177.92 7.1 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 114.004 1.113 . . . . 10.0 114.004 -179.998 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . 0.409 ' HB2' ' O ' ' A' ' 120' ' ' ARG . . . 174.19 132.07 0.03 OUTLIER 'General case' 0 C--N 1.319 -0.755 0 O-C-N 124.526 1.142 . . . . 10.0 108.908 179.647 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . 0.403 ' HB3' ' HB1' ' A' ' 22' ' ' ALA . 2.6 tm-20 44.97 51.82 8.52 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 116.272 1.953 . . . . 10.0 116.272 -179.918 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 66.19 24.12 71.79 Favored Glycine 0 CA--C 1.534 1.243 0 CA-C-N 114.316 -1.311 . . . . 10.0 114.854 -179.77 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 1.6 t -136.86 118.85 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 CA-C-O 123.796 1.76 . . . . 10.0 107.326 179.962 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 125' ' ' THR . . . . . 0.441 HG22 ' N ' ' A' ' 126' ' ' CYS . 18.7 m -94.55 159.05 15.26 Favored 'General case' 0 C--N 1.314 -0.937 0 C-N-CA 125.507 1.523 . . . . 10.0 110.575 -179.977 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . 0.441 ' N ' HG22 ' A' ' 125' ' ' THR . 0.0 OUTLIER -149.52 153.64 37.52 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 127.829 3.206 . . . . 10.0 105.218 -179.816 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 25.3 mttp -151.5 123.44 8.1 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 113.719 1.007 . . . . 10.0 113.719 179.728 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -109.89 118.72 37.23 Favored 'General case' 0 C--N 1.319 -0.747 0 O-C-N 126.658 2.474 . . . . 10.0 109.432 -179.866 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 90.7 t -83.3 118.75 31.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 119.218 -0.993 . . . . 10.0 110.635 -179.741 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . 0.448 ' HB3' ' HB2' ' A' ' 115' ' ' LEU . 0.4 OUTLIER -103.3 133.3 48.59 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 114.147 -1.388 . . . . 10.0 109.095 -179.915 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.463 ' HB3' ' HG2' ' A' ' 9' ' ' LYS . 0.0 OUTLIER -110.15 130.68 55.5 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 105.076 -2.194 . . . . 10.0 105.076 179.577 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . 0.509 ' HB2' ' HE3' ' A' ' 9' ' ' LYS . 25.7 tptt 74.84 161.18 0.24 Allowed 'General case' 0 C--O 1.211 -0.923 0 CA-C-O 116.743 -1.599 . . . . 10.0 107.03 -178.766 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 133' ' ' VAL . . . . . 1.068 HG11 ' HG ' ' A' ' 115' ' ' LEU . 7.6 p 146.25 57.77 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.31 -1.113 1 O-C-N 130.125 4.641 . . . . 10.0 109.298 -179.529 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 134' ' ' HIS . . . . . 0.429 ' HA ' ' HA2' ' A' ' 6' ' ' GLY . 8.2 t60 . . . . . 0 C--N 1.314 -0.966 1 O-C-N 129.245 4.091 . . . . 10.0 108.989 179.825 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.2 t0 . . . . . 0 C--O 1.218 -0.556 0 CA-C-O 123.432 1.586 . . . . 10.0 111.765 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.404 ' CE2' HD12 ' A' ' 110' ' ' ILE . 55.7 m-85 -78.22 -43.57 28.04 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 116.428 2.01 . . . . 10.0 116.428 -179.952 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 10.1 m-20 -43.23 125.18 3.63 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-O 116.954 -1.498 . . . . 10.0 114.796 179.798 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 160.58 -99.25 0.18 Allowed Glycine 0 CA--C 1.531 1.083 0 O-C-N 125.5 1.75 . . . . 10.0 116.899 179.96 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -175.04 128.69 0.29 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 101.579 -3.489 . . . . 10.0 101.579 -179.823 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.615 ' CD2' HD12 ' A' ' 115' ' ' LEU . 82.0 m95 -127.16 114.1 17.25 Favored 'General case' 0 C--N 1.322 -0.608 0 O-C-N 126.78 2.55 . . . . 10.0 111.824 179.727 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.1 175.33 7.78 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 107.306 -1.368 . . . . 10.0 107.306 179.81 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -114.9 149.34 37.35 Favored 'General case' 0 C--O 1.241 0.606 0 N-CA-C 116.306 1.965 . . . . 10.0 116.306 -179.893 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.1 tt -114.84 -0.74 13.39 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 114.212 -1.358 . . . . 10.0 109.582 -179.88 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.1 t 173.83 156.32 0.12 Allowed 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 117.287 2.329 . . . . 10.0 117.287 -179.389 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -146.78 122.31 10.41 Favored 'General case' 0 C--N 1.322 -0.624 0 O-C-N 126.158 2.161 . . . . 10.0 105.289 -179.883 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.2 tt0 -135.81 144.01 45.48 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 115.991 1.849 . . . . 10.0 115.991 179.489 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 62.0 29.36 17.69 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 125.036 1.46 . . . . 10.0 111.799 179.832 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.451 ' CE1' ' HG3' ' A' ' 17' ' ' GLU . 1.7 p90 -76.18 -26.26 56.01 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-O 118.527 -0.749 . . . . 10.0 112.281 179.892 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.451 ' HG3' ' CE1' ' A' ' 16' ' ' PHE . 5.0 mt-10 -71.25 -32.14 68.39 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 122.848 1.308 . . . . 10.0 111.968 179.932 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -78.91 -29.18 44.09 Favored 'General case' 0 C--O 1.215 -0.74 0 CA-C-N 113.37 -1.741 . . . . 10.0 108.103 -179.832 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.43 ' CE1' HD23 ' A' ' 20' ' ' LEU . 0.1 OUTLIER -65.92 -35.81 81.65 Favored 'General case' 0 C--O 1.247 0.956 0 O-C-N 124.213 0.946 . . . . 10.0 110.12 -179.934 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.43 HD23 ' CE1' ' A' ' 19' ' ' TYR . 4.2 mt -77.02 -33.47 57.44 Favored 'General case' 0 C--O 1.22 -0.48 0 CA-C-O 121.692 0.758 . . . . 10.0 109.598 -179.858 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.31 -23.93 60.33 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 107.672 -1.233 . . . . 10.0 107.672 -179.877 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.14 -34.69 66.23 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 126.016 2.073 . . . . 10.0 111.968 -179.699 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -119.28 7.81 11.33 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 119.23 0.923 . . . . 10.0 113.439 179.883 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 t0 55.53 78.16 0.2 Allowed 'General case' 0 N--CA 1.475 0.808 0 O-C-N 124.92 1.387 . . . . 10.0 112.34 -179.831 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.556 HG22 ' O ' ' A' ' 25' ' ' VAL . 2.9 p -118.74 54.29 0.25 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.506 0 CA-C-O 124.057 1.884 . . . . 10.0 107.464 179.737 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.432 ' ND2' ' N ' ' A' ' 26' ' ' ASN . 0.0 OUTLIER 60.14 146.08 0.01 OUTLIER 'General case' 0 C--O 1.225 -0.185 0 N-CA-C 118.655 2.835 . . . . 10.0 118.655 179.328 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 33.7 m -76.04 -30.77 20.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 113.417 -1.719 . . . . 10.0 113.237 179.892 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.27 -28.64 67.38 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 119.885 -1.759 . . . . 10.0 111.576 179.861 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.552 HD22 HG22 ' A' ' 25' ' ' VAL . 7.8 tp -77.87 -32.74 52.13 Favored 'General case' 0 N--CA 1.447 -0.595 0 O-C-N 123.847 0.717 . . . . 10.0 112.486 179.83 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 15.8 ttp85 -64.54 -32.87 74.7 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 124.446 2.07 . . . . 10.0 113.065 179.825 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -74.16 -41.16 61.96 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 113.794 -1.548 . . . . 10.0 111.058 -179.829 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.669 HG21 ' CE2' ' A' ' 57' ' ' PHE . 4.8 mm -74.89 -49.27 29.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 C-N-CA 125.136 1.375 . . . . 10.0 111.488 179.709 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -58.18 -40.51 81.68 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 117.643 -1.17 . . . . 10.0 112.746 -179.906 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.433 ' HA ' ' CZ ' ' A' ' 16' ' ' PHE . 0.1 OUTLIER -52.37 -29.88 26.1 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 120.41 1.459 . . . . 10.0 111.993 -179.486 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -109.0 23.99 13.76 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 119.481 1.037 . . . . 10.0 109.703 -179.777 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 2.3 tt -123.76 132.66 53.85 Favored 'General case' 0 CA--C 1.522 -0.122 0 O-C-N 125.21 1.568 . . . . 10.0 108.925 179.93 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 4.4 mmtp -119.66 106.02 42.62 Favored Pre-proline 0 N--CA 1.477 0.895 0 N-CA-C 104.644 -2.354 . . . . 10.0 104.644 179.66 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -66.6 -145.84 0.02 OUTLIER 'Trans proline' 0 C--N 1.356 0.95 0 C-N-CA 123.962 3.108 . . . . 10.0 117.522 -179.84 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 179.68 113.27 0.04 OUTLIER 'General case' 0 C--O 1.238 0.455 0 N-CA-C 106.236 -1.765 . . . . 10.0 106.236 -179.797 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.6 mmtp -80.08 168.56 18.99 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 117.401 -1.285 . . . . 10.0 111.825 -179.879 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -164.63 149.94 9.98 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 104.796 -2.298 . . . . 10.0 104.796 179.912 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 3.6 mm -133.69 154.58 38.79 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.632 0 N-CA-C 113.343 0.868 . . . . 10.0 113.343 -179.684 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.447 ' CG2' ' HD3' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -148.02 129.66 6.15 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 N-CA-C 105.7 -1.963 . . . . 10.0 105.7 179.576 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.472 ' HG2' ' HA ' ' A' ' 48' ' ' HIS . 0.8 OUTLIER -109.71 122.85 48.42 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-O 122.863 1.316 . . . . 10.0 111.029 -179.93 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -166.04 146.68 6.56 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 116.055 -1.926 . . . . 10.0 108.493 -179.941 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 74.19 -109.54 2.82 Favored Glycine 0 CA--C 1.537 1.417 0 O-C-N 126.119 2.137 . . . . 10.0 109.7 179.946 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.542 ' CB ' ' HB3' ' A' ' 65' ' ' GLN 0.256 2.8 m-20 -96.79 26.03 4.84 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 113.853 -1.174 . . . . 10.0 108.843 179.228 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . 0.472 ' HA ' ' HG2' ' A' ' 44' ' ' GLN . 8.3 m-70 77.01 -163.46 0.04 OUTLIER 'General case' 0 N--CA 1.434 -1.24 0 C-N-CA 126.695 1.998 . . . . 10.0 111.409 176.465 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.498 ' HG2' ' CD1' ' A' ' 51' ' ' ILE . 4.9 ttm 10.01 123.06 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.057 0 O-C-N 129.046 3.966 . . . . 10.0 119.261 -177.879 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 11.8 mt -144.53 106.46 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.865 0 N-CA-C 102.408 -3.182 . . . . 10.0 102.408 179.104 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.498 ' CD1' ' HG2' ' A' ' 49' ' ' MET . 1.2 mp -96.08 131.85 41.82 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.054 0 CA-C-O 124.846 2.26 . . . . 10.0 112.123 -178.795 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.606 HH21 HD11 ' A' ' 54' ' ' LEU . 0.0 OUTLIER -120.14 139.86 51.98 Favored 'General case' 0 N--CA 1.43 -1.466 0 CA-C-N 112.392 -2.186 . . . . 10.0 110.139 179.264 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 92.2 m -120.35 145.7 46.88 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 102.501 -3.148 . . . . 10.0 102.501 -179.86 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.606 HD11 HH21 ' A' ' 52' ' ' ARG . 97.0 mt -139.22 150.45 45.55 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 121.256 3.799 . . . . 10.0 121.256 179.909 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 78.4 p -179.27 174.84 0.99 Allowed 'General case' 0 C--O 1.24 0.577 0 CA-C-N 112.714 -2.039 . . . . 10.0 106.128 179.996 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 16.5 p -71.8 -22.02 61.63 Favored 'General case' 0 C--O 1.241 0.615 0 O-C-N 124.414 1.071 . . . . 10.0 109.892 179.308 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.669 ' CE2' HG21 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -86.11 173.96 9.49 Favored 'General case' 0 C--O 1.245 0.865 0 C-N-CA 125.795 1.638 . . . . 10.0 109.908 -179.919 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -47.35 127.14 10.54 Favored 'General case' 0 C--O 1.241 0.653 0 O-C-N 125.9 2.0 . . . . 10.0 114.159 -179.948 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 10.9 p-10 -100.04 177.31 5.13 Favored 'General case' 0 C--O 1.237 0.421 0 O-C-N 125.683 1.864 . . . . 10.0 108.857 179.794 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.466 ' C ' HD13 ' A' ' 61' ' ' ILE . 9.8 p90 -159.24 143.08 14.99 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 103.269 -2.863 . . . . 10.0 103.269 179.732 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.466 HD13 ' C ' ' A' ' 60' ' ' TYR . 0.1 OUTLIER -115.83 153.43 17.42 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.797 0 CA-C-O 123.679 1.704 . . . . 10.0 110.307 -179.87 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -136.09 -178.63 5.23 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 104.195 -2.521 . . . . 10.0 104.195 179.964 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 34.1 t0 -150.33 122.24 8.17 Favored 'General case' 0 N--CA 1.437 -1.125 0 CA-C-N 113.003 -1.908 . . . . 10.0 106.508 179.888 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.873 ' CD2' HG11 ' A' ' 86' ' ' VAL . 4.8 m-85 -93.67 -96.09 0.15 Allowed 'General case' 0 N--CA 1.44 -0.947 0 C-N-CA 125.629 1.572 . . . . 10.0 114.607 179.429 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.542 ' HB3' ' CB ' ' A' ' 47' ' ' ASP . 86.6 mt-30 84.33 114.01 0.05 Allowed 'General case' 0 C--N 1.298 -1.634 1 O-C-N 131.622 5.576 . . . . 10.0 108.393 -179.679 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 3.2 t -53.56 135.13 15.86 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.726 0 CA-C-N 113.023 -1.899 . . . . 10.0 107.369 179.573 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 63.04 70.5 1.03 Allowed Glycine 0 CA--C 1.53 1.014 0 CA-C-O 117.724 -1.598 . . . . 10.0 116.677 -179.756 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 5.6 tttp -179.43 148.45 0.35 Allowed 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 123.724 1.726 . . . . 10.0 113.715 179.617 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -97.18 133.37 41.91 Favored 'General case' 0 C--O 1.24 0.555 0 CA-C-N 113.129 -1.85 . . . . 10.0 109.662 -179.882 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.476 ' CD1' ' N ' ' A' ' 70' ' ' PHE . 1.0 OUTLIER -146.27 103.29 3.69 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 119.205 0.911 . . . . 10.0 111.345 -179.5 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.12 126.09 26.17 Favored 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 106.325 -1.731 . . . . 10.0 106.325 -179.77 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.426 ' OE1' HD12 ' A' ' 74' ' ' LEU . 2.2 mm-40 -109.72 96.07 6.02 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 112.407 0.521 . . . . 10.0 112.407 179.93 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -76.65 81.07 3.3 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 105.48 -2.044 . . . . 10.0 105.48 179.992 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.426 HD12 ' OE1' ' A' ' 72' ' ' GLU . 1.5 mp -67.43 120.94 14.74 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-N 112.479 -2.146 . . . . 10.0 113.248 179.946 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.452 HG23 ' O ' ' A' ' 75' ' ' THR . 1.2 t -159.83 100.18 1.42 Allowed 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 105.619 -1.993 . . . . 10.0 105.619 -179.924 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -167.69 -46.26 0.03 OUTLIER Glycine 0 N--CA 1.443 -0.884 0 O-C-N 127.277 2.86 . . . . 10.0 111.384 179.932 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 16.0 mt -137.97 -71.53 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 N-CA-C 107.517 -1.29 . . . . 10.0 107.517 -179.994 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -76.41 -22.14 55.09 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 125.585 1.803 . . . . 10.0 113.063 -179.981 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 60.16 -162.63 0.26 Allowed 'General case' 0 N--CA 1.478 0.937 0 CA-C-O 116.903 -1.522 . . . . 10.0 112.136 179.984 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 12.4 ttm105 74.89 137.07 0.06 Allowed 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 121.023 1.738 . . . . 10.0 109.394 -179.678 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.51 164.22 12.35 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 107.874 -1.158 . . . . 10.0 107.874 -179.874 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -162.33 159.47 25.48 Favored 'General case' 0 C--O 1.218 -0.581 0 N-CA-C 105.561 -2.014 . . . . 10.0 105.561 -179.984 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 2.6 ttp -122.24 124.92 44.92 Favored 'General case' 0 N--CA 1.448 -0.554 1 N-CA-C 99.066 -4.42 . . . . 10.0 99.066 -179.838 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.459 HG22 ' CZ ' ' A' ' 70' ' ' PHE . 1.1 m -124.77 137.66 54.31 Favored 'General case' 0 C--O 1.214 -0.77 0 N-CA-C 118.828 2.899 . . . . 10.0 118.828 -179.411 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -124.47 143.63 50.54 Favored 'General case' 0 CA--C 1.502 -0.9 0 N-CA-C 104.793 -2.299 . . . . 10.0 104.793 -179.754 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.873 HG11 ' CD2' ' A' ' 64' ' ' PHE . 3.0 m -123.55 146.62 28.66 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 N-CA-C 102.279 -3.23 . . . . 10.0 102.279 179.932 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 6.0 p -143.91 104.24 4.13 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 113.942 -1.481 . . . . 10.0 111.01 179.965 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 13.8 p-90 -61.74 137.75 58.27 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 104.987 -2.227 . . . . 10.0 104.987 -179.876 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -102.63 -54.91 2.55 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 102.624 -3.102 . . . . 10.0 102.624 179.794 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -168.94 -86.2 0.06 OUTLIER Glycine 0 CA--C 1.501 -0.836 0 N-CA-C 107.023 -2.431 . . . . 10.0 107.023 -179.912 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -102.49 14.0 33.08 Favored 'General case' 0 N--CA 1.446 -0.634 0 O-C-N 124.748 0.911 . . . . 10.0 112.566 -179.884 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -136.65 174.29 10.78 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 123.627 1.679 . . . . 10.0 108.633 -179.86 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -144.85 136.75 25.77 Favored 'General case' 0 C--O 1.216 -0.658 0 CA-C-N 114.549 -1.205 . . . . 10.0 107.949 179.847 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -126.18 149.23 49.15 Favored 'General case' 0 C--O 1.212 -0.906 0 CA-C-N 115.446 -0.797 . . . . 10.0 113.101 179.993 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -139.2 122.83 17.43 Favored 'General case' 0 C--N 1.321 -0.658 0 O-C-N 125.594 1.809 . . . . 10.0 113.219 179.85 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 14.1 t -111.68 113.93 45.6 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 N-CA-C 106.212 -1.773 . . . . 10.0 106.212 179.727 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -90.81 79.96 5.91 Favored 'General case' 0 C--O 1.245 0.826 0 O-C-N 125.118 1.511 . . . . 10.0 108.002 -179.949 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 24.5 ttpp -75.94 89.12 2.93 Favored 'General case' 0 CA--C 1.521 -0.159 0 C-N-CA 124.98 1.312 . . . . 10.0 113.352 -179.919 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -119.91 -65.28 0.27 Allowed Glycine 0 N--CA 1.436 -1.304 0 C-N-CA 125.498 1.523 . . . . 10.0 110.881 179.968 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -148.41 -32.18 0.25 Allowed 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 115.693 1.738 . . . . 10.0 115.693 -179.892 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 61.3 mmtt -80.1 -175.82 5.22 Favored 'General case' 0 C--O 1.215 -0.722 0 N-CA-C 115.115 1.524 . . . . 10.0 115.115 -179.856 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -105.88 -29.48 9.97 Favored 'General case' 0 N--CA 1.452 -0.358 0 O-C-N 125.833 1.958 . . . . 10.0 114.628 179.961 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -113.2 -18.62 7.12 Favored Glycine 0 N--CA 1.465 0.63 0 CA-C-O 118.411 -1.216 . . . . 10.0 115.825 -179.911 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -48.16 109.14 0.2 Allowed 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 120.329 2.065 . . . . 10.0 113.216 -179.918 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 177.55 149.13 7.69 Favored Glycine 0 N--CA 1.448 -0.554 0 N-CA-C 109.539 -1.424 . . . . 10.0 109.539 -179.688 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 9.3 m0 -111.21 121.18 44.62 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 118.708 1.254 . . . . 10.0 109.949 -179.987 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 60.2 m -104.59 108.9 20.58 Favored 'General case' 0 CA--C 1.499 -1.005 0 O-C-N 123.924 0.765 . . . . 10.0 109.259 179.586 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 -88.37 156.52 19.1 Favored 'General case' 0 C--O 1.245 0.835 0 C-N-CA 124.909 1.284 . . . . 10.0 108.237 179.719 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 109' ' ' TRP . . . . . 0.428 ' CD1' ' C ' ' A' ' 109' ' ' TRP . 2.4 t90 -175.46 104.65 0.08 Allowed 'General case' 0 C--O 1.215 -0.741 0 O-C-N 121.306 -0.872 . . . . 10.0 109.141 179.771 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.404 HD12 ' CE2' ' A' ' 4' ' ' PHE . 5.1 mt -78.49 146.47 8.08 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 125.799 2.714 . . . . 10.0 114.519 179.79 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -133.68 78.77 1.79 Allowed 'General case' 0 C--O 1.222 -0.366 0 CA-C-N 113.579 -1.646 . . . . 10.0 108.226 -179.779 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 73.62 -101.89 1.23 Allowed Glycine 0 N--CA 1.449 -0.443 0 N-CA-C 108.22 -1.952 . . . . 10.0 108.22 179.889 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -112.88 21.98 14.92 Favored 'General case' 0 C--O 1.214 -0.797 0 O-C-N 124.928 1.016 . . . . 10.0 109.596 179.889 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -127.71 139.92 52.39 Favored 'General case' 0 C--O 1.216 -0.683 0 CA-C-O 122.64 1.209 . . . . 10.0 110.131 -179.829 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.615 HD12 ' CD2' ' A' ' 8' ' ' TRP . 0.2 OUTLIER -105.58 125.18 50.69 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 114.402 -1.272 . . . . 10.0 109.135 -179.988 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 40.1 t-80 -111.44 101.69 10.12 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 106.491 -1.67 . . . . 10.0 106.491 179.684 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.601 ' O ' HD23 ' A' ' 117' ' ' LEU . 2.0 tt -112.7 126.3 55.24 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 122.415 1.102 . . . . 10.0 113.075 179.989 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -112.59 103.75 11.82 Favored 'General case' 0 CA--C 1.505 -0.781 0 O-C-N 119.891 -1.755 . . . . 10.0 108.272 179.951 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 1.4 ttm -94.23 161.29 14.32 Favored 'General case' 0 CA--C 1.509 -0.601 0 N-CA-C 108.184 -1.043 . . . . 10.0 108.184 -179.923 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 49.9 mtm180 -150.13 -177.37 5.89 Favored 'General case' 0 C--N 1.316 -0.874 0 C-N-CA 125.135 1.374 . . . . 10.0 114.348 179.915 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 165.67 129.92 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.493 0 O-C-N 128.141 3.401 . . . . 10.0 107.985 -179.989 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 53.51 36.21 22.7 Favored 'General case' 0 C--O 1.244 0.787 0 N-CA-C 114.813 1.412 . . . . 10.0 114.813 179.853 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 81.3 -6.69 63.01 Favored Glycine 0 CA--C 1.529 0.914 0 CA-C-O 116.052 -2.527 . . . . 10.0 114.671 -179.818 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -82.02 157.08 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 CA-C-N 119.041 1.421 . . . . 10.0 109.573 -179.854 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 3.5 m -127.5 114.17 17.1 Favored 'General case' 0 C--O 1.239 0.522 0 O-C-N 126.367 2.292 . . . . 10.0 113.074 179.781 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -120.57 151.86 38.86 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 105.908 -1.886 . . . . 10.0 105.908 -179.779 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.61 154.87 51.29 Favored 'General case' 0 C--O 1.224 -0.26 0 O-C-N 125.271 1.607 . . . . 10.0 113.114 -179.905 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . 0.457 ' HB2' HD22 ' A' ' 117' ' ' LEU . 0.4 OUTLIER -145.63 109.63 4.86 Favored 'General case' 0 C--N 1.323 -0.546 0 O-C-N 126.267 2.229 . . . . 10.0 108.378 179.662 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 16.9 t -91.22 140.37 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 N-CA-C 107.935 -1.135 . . . . 10.0 107.935 -179.613 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -123.84 169.44 11.57 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 119.221 -0.418 . . . . 10.0 111.008 179.721 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -141.48 124.74 16.48 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 105.789 -1.93 . . . . 10.0 105.789 -179.988 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . 0.515 ' HB2' ' CZ3' ' A' ' 8' ' ' TRP . 13.7 tttt -78.4 132.0 37.18 Favored 'General case' 0 C--N 1.324 -0.533 0 O-C-N 121.365 -0.834 . . . . 10.0 110.495 -179.893 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 2.2 t -107.31 -54.7 5.78 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 N-CA-C 115.009 1.485 . . . . 10.0 115.009 179.94 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 6.1 t-160 . . . . . 0 C--O 1.252 1.216 0 CA-C-O 117.143 -1.408 . . . . 10.0 113.37 -179.907 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo . . . . . 0 C--O 1.231 0.129 0 CA-C-O 118.308 -0.788 . . . . 10.0 110.952 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 2.1 t -102.37 -14.24 8.26 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.898 0 O-C-N 126.98 2.675 . . . . 10.0 112.406 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 25.62 89.46 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.967 0 O-C-N 128.616 3.698 . . . . 10.0 113.569 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 26.5 m-85 -40.14 -22.56 0.01 OUTLIER 'General case' 0 C--O 1.245 0.819 0 N-CA-C 117.844 2.535 . . . . 10.0 117.844 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -49.05 104.77 0.07 Allowed 'General case' 0 N--CA 1.475 0.775 0 O-C-N 125.738 1.899 . . . . 10.0 111.248 179.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -152.21 -163.44 11.57 Favored Glycine 0 N--CA 1.449 -0.458 0 N-CA-C 118.194 2.038 . . . . 10.0 118.194 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -135.31 110.85 9.17 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 100.843 -3.762 . . . . 10.0 100.843 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.604 ' CE2' HD21 ' A' ' 115' ' ' LEU . 46.5 m0 -112.63 116.43 30.17 Favored 'General case' 0 CA--C 1.506 -0.747 0 O-C-N 124.095 0.872 . . . . 10.0 112.373 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.78 148.63 22.42 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 117.658 -1.163 . . . . 10.0 107.946 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 2.6 mtt -86.03 128.66 34.9 Favored 'General case' 0 C--N 1.314 -0.942 0 O-C-N 126.671 2.482 . . . . 10.0 111.411 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.436 HD23 ' HA ' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -104.5 -53.12 2.77 Favored 'General case' 0 C--N 1.317 -0.813 0 O-C-N 124.914 1.384 . . . . 10.0 108.053 179.809 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -118.09 -172.36 2.24 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 113.53 0.937 . . . . 10.0 113.53 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 177.43 104.97 0.02 OUTLIER 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 106.655 -1.609 . . . . 10.0 106.655 179.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -107.2 151.13 25.83 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 116.551 2.056 . . . . 10.0 116.551 -179.793 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 34.03 34.33 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 116.647 2.091 . . . . 10.0 116.647 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -71.04 -29.99 66.05 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 115.554 1.687 . . . . 10.0 115.554 -179.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -75.38 -36.38 60.91 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 121.197 -0.939 . . . . 10.0 111.641 179.721 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -74.49 -23.45 58.86 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 107.785 -1.191 . . . . 10.0 107.785 -179.693 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.443 ' CZ ' HD11 ' A' ' 23' ' ' LEU . 2.4 t80 -69.36 -34.81 75.13 Favored 'General case' 0 CA--C 1.552 1.054 0 N-CA-C 108.492 -0.929 . . . . 10.0 108.492 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 34.6 mt -79.0 -28.84 43.44 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 108.821 -0.807 . . . . 10.0 108.821 179.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.6 ttt180 -73.83 -35.96 64.87 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 114.312 -1.313 . . . . 10.0 108.65 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.29 -33.65 71.81 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 126.695 2.497 . . . . 10.0 110.879 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.443 HD11 ' CZ ' ' A' ' 19' ' ' TYR . 6.7 mt -91.32 5.38 49.46 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 115.179 -0.919 . . . . 10.0 109.124 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 52.72 38.09 25.4 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 116.707 2.114 . . . . 10.0 116.707 -179.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 1.4 m -79.79 179.11 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 N-CA-C 106.036 -1.839 . . . . 10.0 106.036 179.561 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -72.35 159.49 33.94 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 117.462 2.393 . . . . 10.0 117.462 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.0 m -72.64 -35.46 50.61 Favored 'Isoleucine or valine' 0 C--O 1.242 0.668 0 C-N-CA 125.735 1.614 . . . . 10.0 112.836 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.72 -28.19 64.55 Favored 'General case' 0 N--CA 1.445 -0.724 0 O-C-N 120.286 -1.509 . . . . 10.0 111.558 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 22.9 tp -69.32 -45.23 70.02 Favored 'General case' 0 C--O 1.216 -0.705 0 CA-C-N 114.477 -1.238 . . . . 10.0 110.392 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.17 -20.44 61.59 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-N 113.107 -1.86 . . . . 10.0 112.333 179.854 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.75 -47.4 47.14 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 118.894 -2.379 . . . . 10.0 109.534 -179.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.1 mm -78.95 -44.7 24.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 O-C-N 126.803 2.564 . . . . 10.0 111.21 -179.54 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -55.88 -35.16 66.21 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 116.486 2.032 . . . . 10.0 116.486 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -67.51 -55.4 13.68 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 121.845 2.111 . . . . 10.0 115.668 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -54.57 -21.11 9.35 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-O 117.329 -1.319 . . . . 10.0 112.872 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 25.2 mt -90.55 161.32 15.52 Favored 'General case' 0 CA--C 1.503 -0.861 0 CA-C-O 123.204 1.478 . . . . 10.0 114.841 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.1 mttp -154.29 109.79 2.43 Favored Pre-proline 0 N--CA 1.472 0.646 0 N-CA-C 104.408 -2.441 . . . . 10.0 104.408 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.482 ' HB2' HG22 ' A' ' 53' ' ' THR . 72.5 Cg_endo -81.29 136.92 10.29 Favored 'Trans proline' 0 CA--C 1.535 0.568 0 C-N-CA 123.044 2.496 . . . . 10.0 116.802 179.791 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -91.01 121.79 33.12 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 118.019 -1.472 . . . . 10.0 107.701 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.1 ttpt -84.44 158.78 20.95 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-O 118.654 -0.689 . . . . 10.0 110.399 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -153.87 125.2 7.47 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 105.586 -2.005 . . . . 10.0 105.586 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.496 HD11 ' CZ3' ' A' ' 8' ' ' TRP . 7.9 mt -103.88 143.52 15.6 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.013 0 CA-C-N 120.076 1.307 . . . . 10.0 114.099 -179.761 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 35.7 t -136.97 138.16 46.17 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 N-CA-C 104.672 -2.344 . . . . 10.0 104.672 179.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -152.85 117.3 4.97 Favored 'General case' 0 C--N 1.312 -1.052 0 C-N-CA 124.784 1.234 . . . . 10.0 110.13 -179.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.58 -41.56 26.89 Favored 'General case' 0 C--N 1.321 -0.661 0 O-C-N 119.691 -1.881 . . . . 10.0 108.199 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -174.66 -92.11 0.08 OUTLIER Glycine 0 C--O 1.24 0.522 0 N-CA-C 106.76 -2.536 . . . . 10.0 106.76 -179.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -98.33 17.95 17.56 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 119.299 1.549 . . . . 10.0 109.935 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . 0.679 ' HE1' HD11 ' A' ' 50' ' ' ILE . 0.7 OUTLIER -129.15 121.73 28.34 Favored 'General case' 0 C--O 1.214 -0.766 0 N-CA-C 105.439 -2.06 . . . . 10.0 105.439 179.721 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 7.2 ttp -121.03 133.44 55.25 Favored 'General case' 0 N--CA 1.443 -0.8 0 O-C-N 126.033 2.083 . . . . 10.0 112.759 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.679 HD11 ' HE1' ' A' ' 48' ' ' HIS . 19.3 mt -116.3 120.41 64.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 107.661 -1.237 . . . . 10.0 107.661 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -98.28 109.49 23.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 104.75 -2.315 . . . . 10.0 104.75 179.726 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 4.2 mtt180 -106.54 128.95 54.52 Favored 'General case' 0 N--CA 1.434 -1.265 0 C-N-CA 123.397 0.679 . . . . 10.0 112.112 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.482 HG22 ' HB2' ' A' ' 38' ' ' PRO . 0.2 OUTLIER -125.39 137.91 54.02 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 100.563 -3.865 . . . . 10.0 100.563 179.859 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.3 mp -125.92 92.64 3.63 Favored 'General case' 0 N--CA 1.449 -0.482 1 N-CA-C 123.409 4.596 . . . . 10.0 123.409 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 3.4 p -123.19 144.02 49.64 Favored 'General case' 0 C--N 1.315 -0.931 0 O-C-N 125.958 2.036 . . . . 10.0 105.531 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -69.35 -16.48 63.54 Favored 'General case' 0 C--O 1.22 -0.48 0 CA-C-O 123.209 1.48 . . . . 10.0 107.571 179.742 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -93.36 108.79 20.38 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 107.255 -1.387 . . . . 10.0 107.255 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 15.4 tpp180 36.64 91.87 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 O-C-N 126.074 2.109 . . . . 10.0 114.742 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.432 ' HB2' HD11 ' A' ' 61' ' ' ILE . 0.6 OUTLIER -48.79 122.12 5.35 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-O 123.64 1.686 . . . . 10.0 110.631 179.986 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -102.01 78.13 1.76 Allowed 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 112.87 -1.968 . . . . 10.0 107.959 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.432 HD11 ' HB2' ' A' ' 59' ' ' ASN . 1.4 mm -106.77 133.5 51.15 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 C-N-CA 120.424 -0.51 . . . . 10.0 109.993 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -129.99 151.46 50.52 Favored 'General case' 0 C--N 1.317 -0.834 0 C-N-CA 125.742 1.617 . . . . 10.0 108.378 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -127.33 152.81 46.97 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 101.363 -3.569 . . . . 10.0 101.363 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 4.9 m-30 -146.39 167.89 22.49 Favored 'General case' 0 C--O 1.246 0.911 0 N-CA-C 116.062 1.875 . . . . 10.0 116.062 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 40.2 mm-40 -137.01 117.14 13.39 Favored 'General case' 0 N--CA 1.437 -1.118 0 N-CA-C 104.412 -2.44 . . . . 10.0 104.412 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 47.1 t -73.73 132.25 33.68 Favored 'Isoleucine or valine' 0 C--O 1.241 0.639 0 CA-C-N 115.133 -0.939 . . . . 10.0 112.021 -179.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 77.86 -10.42 25.74 Favored Glycine 0 N--CA 1.437 -1.263 0 C-N-CA 125.299 1.428 . . . . 10.0 116.032 -179.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.6 tmtt? -113.25 126.48 55.45 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 114.514 -0.843 . . . . 10.0 112.218 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -41.82 141.15 0.87 Allowed 'General case' 0 C--N 1.32 -0.681 0 O-C-N 127.604 3.065 . . . . 10.0 112.789 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -124.15 151.34 44.1 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 113.912 -1.494 . . . . 10.0 113.248 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -126.49 151.81 47.31 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 105.994 -1.854 . . . . 10.0 105.994 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -143.32 145.5 32.75 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 117.201 2.297 . . . . 10.0 117.201 -179.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -129.81 124.05 32.4 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 121.487 0.661 . . . . 10.0 109.372 -179.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.492 HD13 HG12 ' A' ' 77' ' ' ILE . 80.5 mt -121.52 139.86 52.95 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 123.906 0.882 . . . . 10.0 111.751 -179.707 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.91 4.46 4.16 Favored 'General case' 0 N--CA 1.443 -0.8 0 O-C-N 120.649 -1.282 . . . . 10.0 109.631 -179.762 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -121.48 -21.23 3.07 Favored Glycine 0 CA--C 1.53 0.986 0 CA-C-O 117.892 -1.504 . . . . 10.0 110.858 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.656 HD13 ' N ' ' A' ' 77' ' ' ILE . 0.0 OUTLIER -124.43 120.17 58.37 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.687 0 CA-C-O 116.4 -1.762 . . . . 10.0 108.011 -179.868 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 3.4 p30 28.5 34.34 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.86 0 O-C-N 126.646 2.466 . . . . 10.0 114.027 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -4.56 81.13 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 127.68 2.392 . . . . 10.0 116.367 -179.592 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.9 158.23 44.91 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 113.095 -1.866 . . . . 10.0 110.265 -179.688 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -120.18 137.59 54.09 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 103.815 -2.661 . . . . 10.0 103.815 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 7.2 p -140.57 166.71 24.0 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.408 -1.269 . . . . 10.0 109.656 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -110.38 116.42 31.4 Favored 'General case' 0 N--CA 1.439 -0.995 1 N-CA-C 99.047 -4.427 . . . . 10.0 99.047 179.878 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 31.9 m -117.49 138.28 51.98 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 123.266 1.508 . . . . 10.0 114.329 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 20.7 m -127.51 123.49 36.01 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 106.238 -1.764 . . . . 10.0 106.238 -179.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 2.6 m -104.63 123.36 58.55 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.661 0 N-CA-C 102.647 -3.094 . . . . 10.0 102.647 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -137.97 178.37 7.17 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 122.724 1.25 . . . . 10.0 110.603 -179.834 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 4.0 p-90 -123.45 109.33 13.71 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 104.288 -2.486 . . . . 10.0 104.288 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -72.55 -55.09 7.47 Favored 'General case' 0 C--N 1.314 -0.974 1 N-CA-C 99.014 -4.439 . . . . 10.0 99.014 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -149.13 -117.57 0.89 Allowed Glycine 0 C--O 1.246 0.849 0 N-CA-C 105.505 -3.038 . . . . 10.0 105.505 -179.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -97.99 49.77 1.02 Allowed 'General case' 0 N--CA 1.461 0.115 0 C-N-CA 118.447 -1.301 . . . . 10.0 111.374 179.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.3 mtmm -147.14 -168.95 3.18 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 124.436 1.094 . . . . 10.0 109.181 -179.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -142.58 151.3 41.4 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 105.819 -1.919 . . . . 10.0 105.819 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 17.5 mt-30 -147.23 150.2 34.39 Favored 'General case' 0 C--O 1.215 -0.743 0 C-N-CA 124.595 1.158 . . . . 10.0 112.256 179.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -138.85 127.95 23.97 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-N 114.517 -1.22 . . . . 10.0 112.882 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 9.1 p -110.11 97.66 6.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 C-N-CA 123.992 0.917 . . . . 10.0 108.955 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -73.89 81.99 1.67 Allowed 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 105.675 -1.972 . . . . 10.0 105.675 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -71.64 97.45 1.73 Allowed 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 114.3 1.222 . . . . 10.0 114.3 -179.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -162.16 -155.26 7.89 Favored Glycine 0 C--N 1.315 -0.604 0 O-C-N 126.104 2.128 . . . . 10.0 110.621 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -64.96 -171.68 0.07 Allowed 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 120.639 0.256 . . . . 10.0 111.657 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 15.2 mmtm 74.97 162.49 0.25 Allowed 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 114.774 1.398 . . . . 10.0 114.774 -179.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -93.41 -32.84 14.08 Favored 'General case' 0 C--O 1.213 -0.824 0 CA-C-O 122.95 1.357 . . . . 10.0 112.446 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -130.78 80.86 0.34 Allowed Glycine 0 C--O 1.221 -0.719 0 C-N-CA 125.391 1.472 . . . . 10.0 115.392 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.49 126.11 46.13 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-O 123.571 1.653 . . . . 10.0 108.681 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 145.0 154.97 6.29 Favored Glycine 0 C--N 1.336 0.528 0 CA-C-O 117.834 -1.537 . . . . 10.0 109.709 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' TRP . . . . . 0.492 ' CD1' ' HG2' ' A' ' 119' ' ' MET . 2.9 m0 -115.81 161.19 19.11 Favored 'General case' 0 C--N 1.314 -0.968 0 O-C-N 127.118 2.305 . . . . 10.0 108.952 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 51.1 m -133.54 130.5 38.54 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 104.974 -2.232 . . . . 10.0 104.974 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -118.09 162.48 18.13 Favored 'General case' 0 C--N 1.318 -0.784 0 O-C-N 127.257 2.848 . . . . 10.0 111.6 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' TRP . . . . . 0.46 ' CD1' ' C ' ' A' ' 109' ' ' TRP . 0.0 OUTLIER 176.99 157.53 0.31 Allowed 'General case' 0 CA--C 1.5 -0.947 0 CA-C-N 114.354 -1.294 . . . . 10.0 107.613 -179.995 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 66.8 mt -121.62 130.88 74.21 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 CA-C-N 115.857 -0.61 . . . . 10.0 111.429 -179.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -111.12 58.99 0.61 Allowed 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 124.136 1.922 . . . . 10.0 107.93 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 77.22 -94.45 1.13 Allowed Glycine 0 CA--C 1.504 -0.634 0 O-C-N 120.478 -1.389 . . . . 10.0 110.739 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -102.93 4.75 37.89 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 114.271 1.211 . . . . 10.0 114.271 -179.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -142.45 139.83 31.73 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 124.013 1.863 . . . . 10.0 115.041 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.604 HD21 ' CE2' ' A' ' 8' ' ' TRP . 4.3 mm? -83.32 144.51 29.64 Favored 'General case' 0 N--CA 1.441 -0.905 0 CA-C-N 112.718 -2.037 . . . . 10.0 109.684 -179.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 8.4 m-70 -131.67 67.66 1.51 Allowed 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 113.319 -1.764 . . . . 10.0 107.375 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.93 154.07 20.8 Favored 'General case' 0 C--N 1.317 -0.82 0 O-C-N 125.06 1.475 . . . . 10.0 113.441 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -135.99 135.63 39.67 Favored 'General case' 0 CA--C 1.502 -0.896 0 N-CA-C 107.352 -1.351 . . . . 10.0 107.352 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.492 ' HG2' ' CD1' ' A' ' 106' ' ' TRP . 3.6 mtt -125.61 123.11 38.3 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-O 123.391 1.567 . . . . 10.0 111.784 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.09 158.29 23.4 Favored 'General case' 0 N--CA 1.443 -0.791 0 O-C-N 119.958 -1.714 . . . . 10.0 112.834 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . 0.567 ' O ' HG22 ' A' ' 124' ' ' VAL . . . -169.34 103.69 0.36 Allowed 'General case' 0 CA--C 1.515 -0.368 0 O-C-N 120.935 -1.103 . . . . 10.0 108.382 -179.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 73.47 13.21 4.57 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.397 1.879 . . . . 10.0 116.029 -179.855 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 107.81 13.75 19.27 Favored Glycine 0 CA--C 1.535 1.301 0 CA-C-O 116.144 -2.476 . . . . 10.0 116.326 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.567 HG22 ' O ' ' A' ' 121' ' ' ALA . 2.7 m -112.91 93.97 2.85 Favored 'Isoleucine or valine' 0 C--O 1.242 0.679 0 CA-C-N 119.869 1.834 . . . . 10.0 113.554 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -78.91 109.94 13.66 Favored 'General case' 0 C--N 1.317 -0.811 0 O-C-N 125.852 1.97 . . . . 10.0 113.809 -179.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -106.57 151.52 24.91 Favored 'General case' 0 N--CA 1.463 0.202 0 N-CA-C 105.02 -2.215 . . . . 10.0 105.02 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 9.0 mtpp -132.84 150.44 52.16 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 119.111 -1.035 . . . . 10.0 111.949 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -138.61 106.66 5.71 Favored 'General case' 0 C--N 1.316 -0.876 0 O-C-N 121.759 -0.588 . . . . 10.0 110.9 -179.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.543 HG22 ' O ' ' A' ' 115' ' ' LEU . 1.1 t -89.64 127.54 42.21 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 C-N-CA 118.611 -1.236 . . . . 10.0 109.126 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -108.38 167.06 10.3 Favored 'General case' 0 N--CA 1.445 -0.716 0 C-N-CA 125.309 1.443 . . . . 10.0 110.199 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -127.23 107.56 10.11 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 106.785 -1.561 . . . . 10.0 106.785 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . 0.46 ' HG3' ' CD1' ' A' ' 8' ' ' TRP . 21.3 tttt -56.26 109.88 0.67 Allowed 'General case' 0 C--O 1.221 -0.396 0 CA-C-N 119.726 1.148 . . . . 10.0 108.155 179.811 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 16.1 m -103.42 50.58 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.506 -0.724 0 C-N-CA 124.964 1.306 . . . . 10.0 110.94 179.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 2.1 t60 . . . . . 0 C--N 1.315 -0.922 0 O-C-N 121.569 -0.707 . . . . 10.0 109.767 179.96 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo . . . . . 0 C--O 1.233 0.232 0 N-CA-C 109.851 -0.865 . . . . 10.0 109.851 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.742 HG12 ' OE1' ' A' ' 44' ' ' GLN . 0.8 OUTLIER -111.08 -156.42 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.281 0 C-N-CA 123.995 0.918 . . . . 10.0 109.634 -179.578 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.696 ' N ' HG13 ' A' ' 2' ' ' VAL . 14.5 m-20 -101.33 -33.73 9.91 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 116.54 -1.695 . . . . 10.0 112.972 -179.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.595 ' CE1' HD12 ' A' ' 93' ' ' LEU . 0.7 OUTLIER -20.52 -52.49 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.779 0 O-C-N 126.313 2.258 . . . . 10.0 116.606 179.681 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.419 ' HA ' HG22 ' A' ' 42' ' ' ILE . 3.9 p-10 -53.12 110.56 0.55 Allowed 'General case' 0 N--CA 1.484 1.25 0 O-C-N 125.2 1.562 . . . . 10.0 112.404 179.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -152.75 171.08 31.87 Favored Glycine 0 N--CA 1.464 0.503 0 C-N-CA 118.507 -1.806 . . . . 10.0 115.748 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -92.65 87.45 5.91 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 101.355 -3.572 . . . . 10.0 101.355 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.53 ' CH2' HD11 ' A' ' 115' ' ' LEU . 38.7 m0 -89.55 112.63 23.88 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 123.282 1.515 . . . . 10.0 114.24 179.816 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 18.8 pttp -98.05 138.62 35.08 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 103.908 -2.627 . . . . 10.0 103.908 179.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.27 150.23 22.71 Favored 'General case' 0 C--N 1.313 -0.981 0 N-CA-C 114.115 1.154 . . . . 10.0 114.115 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.2 tt -113.34 -55.15 2.55 Favored 'General case' 0 C--O 1.242 0.696 0 CA-C-O 118.293 -0.86 . . . . 10.0 109.666 -179.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.4 p -167.99 133.09 1.83 Allowed 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 116.33 1.974 . . . . 10.0 116.33 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -90.4 165.89 13.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 111.173 -2.74 . . . . 10.0 105.715 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -124.13 -57.26 1.61 Allowed 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 120.549 1.522 . . . . 10.0 111.293 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -112.4 51.07 0.83 Allowed 'General case' 0 C--N 1.328 -0.342 0 O-C-N 126.592 2.432 . . . . 10.0 113.148 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 6.4 t80 -76.3 -28.57 57.04 Favored 'General case' 0 CA--C 1.546 0.799 0 O-C-N 118.889 -2.382 . . . . 10.0 110.133 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -79.26 -42.4 25.96 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 125.799 1.937 . . . . 10.0 112.0 179.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -74.79 -20.56 59.74 Favored 'General case' 0 C--O 1.22 -0.478 0 O-C-N 121.418 -0.801 . . . . 10.0 108.85 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 14.2 t80 -67.1 -39.86 86.81 Favored 'General case' 0 CA--C 1.548 0.88 0 CA-C-O 122.583 1.183 . . . . 10.0 110.074 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 34.9 mt -75.33 -40.33 58.49 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 122.385 1.088 . . . . 10.0 109.643 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.4 ttm180 -68.41 -27.2 65.99 Favored 'General case' 0 C--O 1.241 0.657 0 C-N-CA 125.415 1.486 . . . . 10.0 109.231 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.56 -26.36 59.9 Favored 'General case' 0 C--O 1.221 -0.432 0 O-C-N 124.664 1.228 . . . . 10.0 109.239 -179.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 79.0 mt -99.12 -15.26 19.05 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 124.756 1.223 . . . . 10.0 109.514 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 61.67 61.74 1.4 Allowed 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 116.424 2.009 . . . . 10.0 116.424 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.606 HG13 ' HA ' ' A' ' 78' ' ' ASP . 0.2 OUTLIER -88.33 -150.11 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.245 0.838 0 N-CA-C 104.892 -2.262 . . . . 10.0 104.892 -179.7 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.551 ' N ' ' ND2' ' A' ' 26' ' ' ASN . 0.0 OUTLIER -96.27 162.37 13.54 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 120.639 1.563 . . . . 10.0 113.786 -179.908 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.9 t -70.36 -39.33 76.41 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 O-C-N 125.735 1.897 . . . . 10.0 114.261 -179.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -71.56 -29.99 65.36 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 113.473 0.916 . . . . 10.0 113.473 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.74 -29.25 58.8 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 124.903 1.281 . . . . 10.0 111.455 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.05 -33.42 67.95 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 113.252 0.834 . . . . 10.0 113.252 179.726 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -72.21 -41.42 66.95 Favored 'General case' 0 N--CA 1.451 -0.423 0 O-C-N 125.813 1.946 . . . . 10.0 109.387 -179.402 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.555 HG21 ' CZ ' ' A' ' 57' ' ' PHE . 46.5 mm -73.58 -60.03 2.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 O-C-N 120.879 -1.138 . . . . 10.0 108.175 -179.556 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -46.32 -26.77 0.88 Allowed 'General case' 0 C--N 1.318 -0.771 0 O-C-N 125.026 1.454 . . . . 10.0 114.79 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -81.96 -16.98 48.6 Favored 'General case' 0 C--N 1.327 -0.37 0 O-C-N 124.448 1.092 . . . . 10.0 111.061 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -87.6 -15.83 36.24 Favored 'General case' 0 N--CA 1.441 -0.877 0 O-C-N 121.064 -1.023 . . . . 10.0 110.744 -179.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.67 172.97 8.41 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.518 -0.919 . . . . 10.0 108.518 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.5 ptpt -152.37 135.52 9.43 Favored Pre-proline 0 N--CA 1.474 0.77 0 N-CA-C 106.292 -1.744 . . . . 10.0 106.292 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -74.29 107.28 2.41 Favored 'Trans proline' 0 N--CA 1.448 -1.151 1 C-N-CA 126.532 4.822 . . . . 10.0 119.064 -179.758 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -82.38 149.02 27.92 Favored 'General case' 0 C--O 1.239 0.526 0 N-CA-C 105.778 -1.934 . . . . 10.0 105.778 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 28.6 mttp -121.36 155.91 33.76 Favored 'General case' 0 C--O 1.214 -0.811 0 O-C-N 120.48 -1.388 . . . . 10.0 109.671 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -143.37 105.01 4.32 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 102.907 -2.997 . . . . 10.0 102.907 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.419 HG22 ' HA ' ' A' ' 5' ' ' ASN . 1.3 mt -100.41 149.29 6.13 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.921 0 C-N-CA 117.679 -1.608 . . . . 10.0 111.525 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 45.4 t -138.34 145.42 28.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 113.594 -1.639 . . . . 10.0 107.694 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.742 ' OE1' HG12 ' A' ' 2' ' ' VAL . 1.9 tt0 -139.01 128.08 23.83 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 113.538 -1.664 . . . . 10.0 112.005 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -103.55 -49.8 3.6 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 104.202 -2.518 . . . . 10.0 104.202 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -164.18 -113.15 0.28 Allowed Glycine 0 C--O 1.246 0.893 0 N-CA-C 106.466 -2.653 . . . . 10.0 106.466 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -75.17 -20.22 59.45 Favored 'General case' 0 C--O 1.215 -0.722 0 O-C-N 120.317 -1.696 . . . . 10.0 110.816 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.4 m170 -91.7 130.78 37.43 Favored 'General case' 0 N--CA 1.439 -0.982 0 CA-C-N 114.99 -1.005 . . . . 10.0 110.017 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.477 ' HG2' ' CD1' ' A' ' 51' ' ' ILE . 2.5 ttp -121.42 149.54 42.86 Favored 'General case' 0 N--CA 1.435 -1.181 0 O-C-N 125.761 1.913 . . . . 10.0 111.568 -179.659 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 19.9 mt -130.16 123.64 56.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 105.835 -1.913 . . . . 10.0 105.835 -179.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.477 ' CD1' ' HG2' ' A' ' 49' ' ' MET . 1.6 mp -110.05 128.18 66.4 Favored 'Isoleucine or valine' 0 C--O 1.24 0.578 0 N-CA-C 106.07 -1.826 . . . . 10.0 106.07 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.6 mmm180 -116.32 106.56 13.79 Favored 'General case' 0 N--CA 1.435 -1.221 0 CA-C-O 118.533 -0.746 . . . . 10.0 110.59 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.476 ' C ' HD12 ' A' ' 54' ' ' LEU . 65.3 m -91.52 129.87 37.43 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 102.126 -3.287 . . . . 10.0 102.126 -179.707 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.476 HD12 ' C ' ' A' ' 53' ' ' THR . 6.0 mp -127.37 86.5 2.5 Favored 'General case' 0 N--CA 1.441 -0.881 0 N-CA-C 119.353 3.094 . . . . 10.0 119.353 -179.811 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 7.1 m -108.42 132.67 53.53 Favored 'General case' 0 N--CA 1.443 -0.782 0 C-N-CA 125.491 1.517 . . . . 10.0 107.504 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.7 p -56.83 -24.73 53.2 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-O 123.021 1.391 . . . . 10.0 107.753 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.555 ' CZ ' HG21 ' A' ' 32' ' ' ILE . 1.2 t80 -87.0 -135.07 0.08 Allowed 'General case' 0 C--O 1.239 0.545 0 N-CA-C 106.782 -1.562 . . . . 10.0 106.782 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.69 140.21 44.02 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 118.868 -1.133 . . . . 10.0 113.723 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -138.14 144.06 40.62 Favored 'General case' 0 N--CA 1.466 0.367 0 O-C-N 125.851 1.97 . . . . 10.0 111.714 179.719 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 1.5 p90 -129.34 134.57 47.97 Favored 'General case' 0 C--O 1.217 -0.643 0 N-CA-C 105.449 -2.056 . . . . 10.0 105.449 -179.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 1.4 mp -97.28 119.5 45.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 124.327 2.013 . . . . 10.0 109.286 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -118.39 144.4 45.95 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-N 112.497 -2.138 . . . . 10.0 106.654 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -132.11 114.3 14.35 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 100.467 -3.901 . . . . 10.0 100.467 -179.834 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -102.55 177.38 4.88 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 117.429 2.381 . . . . 10.0 117.429 -179.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 15.9 mm-40 -144.1 105.58 4.27 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 103.095 -2.928 . . . . 10.0 103.095 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 47.8 t -62.81 119.43 6.78 Favored 'Isoleucine or valine' 0 C--O 1.243 0.744 0 CA-C-O 122.738 1.256 . . . . 10.0 113.106 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.12 37.28 63.89 Favored Glycine 0 CA--C 1.533 1.188 0 N-CA-C 117.117 1.607 . . . . 10.0 117.117 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.21 13.84 3.54 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 119.426 -0.91 . . . . 10.0 112.473 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 65.85 150.61 0.05 OUTLIER 'General case' 0 C--N 1.32 -0.706 0 O-C-N 125.656 1.847 . . . . 10.0 112.338 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -149.63 114.92 5.48 Favored 'General case' 0 C--O 1.243 0.714 0 CA-C-O 121.18 0.514 . . . . 10.0 111.665 179.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -87.07 89.93 8.18 Favored 'General case' 0 C--O 1.217 -0.612 0 N-CA-C 107.688 -1.227 . . . . 10.0 107.688 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -68.52 170.65 8.71 Favored 'General case' 0 C--N 1.319 -0.723 0 O-C-N 126.328 2.267 . . . . 10.0 115.625 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -150.02 62.66 0.98 Allowed 'General case' 0 N--CA 1.441 -0.91 0 N-CA-C 106.475 -1.676 . . . . 10.0 106.475 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.827 HD12 HG22 ' A' ' 77' ' ' ILE . 3.5 mm? -50.0 145.91 5.24 Favored 'General case' 0 N--CA 1.438 -1.034 0 N-CA-C 113.267 0.84 . . . . 10.0 113.267 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 62.2 m -156.1 92.67 1.36 Allowed 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.368 -0.833 . . . . 10.0 109.08 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 144.54 -43.85 0.94 Allowed Glycine 0 N--CA 1.434 -1.47 0 CA-C-O 117.072 -1.96 . . . . 10.0 112.097 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.827 HG22 HD12 ' A' ' 74' ' ' LEU . 0.3 OUTLIER -99.59 66.74 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.467 0 CA-C-N 118.961 1.38 . . . . 10.0 108.66 179.976 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.606 ' HA ' HG13 ' A' ' 25' ' ' VAL . 9.0 t70 83.24 -11.0 0.96 Allowed 'General case' 0 N--CA 1.443 -0.798 0 O-C-N 125.523 1.764 . . . . 10.0 109.744 -179.731 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 50.45 100.26 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 116.593 2.072 . . . . 10.0 116.593 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.42 124.11 4.01 Favored 'General case' 0 C--N 1.317 -0.818 0 O-C-N 120.688 -1.258 . . . . 10.0 112.178 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 10.3 mttt -63.05 149.21 45.62 Favored 'General case' 0 C--O 1.221 -0.447 0 N-CA-C 105.87 -1.9 . . . . 10.0 105.87 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 1.6 p -158.28 171.06 20.88 Favored 'General case' 0 C--O 1.215 -0.741 0 N-CA-C 105.652 -1.981 . . . . 10.0 105.652 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 30.1 mtp -120.56 96.38 5.11 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 102.664 -3.087 . . . . 10.0 102.664 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 27.7 m -107.24 117.52 34.28 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 116.977 2.214 . . . . 10.0 116.977 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 51.6 m -109.09 118.44 36.78 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 106.004 -1.85 . . . . 10.0 106.004 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.414 HG22 ' HB3' ' A' ' 95' ' ' CYS . 53.4 t -99.77 139.09 22.16 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 N-CA-C 105.714 -1.958 . . . . 10.0 105.714 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -154.41 -174.0 4.8 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 113.867 -1.515 . . . . 10.0 113.188 179.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 64.4 p-90 -133.93 130.48 37.79 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 121.787 0.804 . . . . 10.0 108.835 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 14.8 t0 -149.31 119.35 7.18 Favored 'General case' 0 C--O 1.242 0.666 0 N-CA-C 103.444 -2.798 . . . . 10.0 103.444 179.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 88.08 13.27 64.44 Favored Glycine 0 CA--C 1.503 -0.702 0 N-CA-C 106.979 -2.449 . . . . 10.0 106.979 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 20.9 t0 72.11 5.39 5.3 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 119.269 1.535 . . . . 10.0 111.859 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.44 168.85 9.48 Favored 'General case' 0 CA--C 1.504 -0.79 0 N-CA-C 106.499 -1.667 . . . . 10.0 106.499 179.782 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.595 HD12 ' CE1' ' A' ' 4' ' ' PHE . 0.5 OUTLIER -112.96 92.22 3.93 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 123.808 1.766 . . . . 10.0 106.425 179.586 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -104.45 155.87 18.42 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 114.72 -1.127 . . . . 10.0 110.446 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' CYS . . . . . 0.414 ' HB3' HG22 ' A' ' 86' ' ' VAL . 0.1 OUTLIER -145.3 170.59 16.01 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 117.601 -1.64 . . . . 10.0 108.461 -179.835 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 81.3 t -145.94 128.07 8.63 Favored 'Isoleucine or valine' 0 C--O 1.241 0.639 0 O-C-N 125.291 1.619 . . . . 10.0 107.574 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -110.89 118.94 37.47 Favored 'General case' 0 C--N 1.32 -0.695 0 O-C-N 125.041 1.463 . . . . 10.0 109.136 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 2.7 mmmt -96.17 80.58 3.26 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 122.655 1.217 . . . . 10.0 110.373 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -143.27 74.96 0.32 Allowed Glycine 0 C--N 1.338 0.652 0 CA-C-N 114.101 -1.409 . . . . 10.0 110.481 179.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 58.72 -176.12 0.08 Allowed 'General case' 0 C--O 1.234 0.241 0 N-CA-C 116.125 1.898 . . . . 10.0 116.125 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 24.9 mmtt 60.81 175.58 0.1 Allowed 'General case' 0 CA--C 1.544 0.747 0 O-C-N 125.244 1.59 . . . . 10.0 114.822 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 75.2 mt-10 -123.68 88.3 2.89 Favored 'General case' 0 C--O 1.232 0.134 0 O-C-N 125.568 1.792 . . . . 10.0 113.512 179.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 142.46 -23.39 2.36 Favored Glycine 0 C--O 1.217 -0.953 0 CA-C-O 118.258 -1.301 . . . . 10.0 116.263 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 7.0 mtp180 -47.94 130.89 15.45 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.869 0.982 . . . . 10.0 112.347 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 142.99 148.96 5.03 Favored Glycine 0 N--CA 1.439 -1.111 0 O-C-N 125.874 1.984 . . . . 10.0 109.952 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' TRP . . . . . 0.511 ' CE3' HD11 ' A' ' 117' ' ' LEU . 2.6 m0 -112.26 171.54 7.45 Favored 'General case' 0 N--CA 1.455 -0.22 0 O-C-N 121.789 -0.83 . . . . 10.0 109.727 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 4.0 m -153.54 88.98 1.3 Allowed 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 104.106 -2.553 . . . . 10.0 104.106 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 -79.76 98.23 6.94 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 125.156 1.535 . . . . 10.0 112.9 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -105.15 130.71 53.26 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 107.218 -1.401 . . . . 10.0 107.218 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 15.6 mt -93.18 119.64 41.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 116.679 2.103 . . . . 10.0 116.679 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -101.5 71.85 1.37 Allowed 'General case' 0 C--O 1.223 -0.303 0 CA-C-O 123.337 1.541 . . . . 10.0 108.243 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 59.52 -103.6 0.44 Allowed Glycine 0 C--N 1.341 0.826 0 N-CA-C 109.419 -1.473 . . . . 10.0 109.419 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 17.9 p-10 -87.12 16.79 4.74 Favored 'General case' 0 N--CA 1.476 0.842 0 O-C-N 121.392 -1.063 . . . . 10.0 112.54 179.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 13.4 mt-10 -138.92 158.33 44.4 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 125.166 2.412 . . . . 10.0 110.304 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.53 HD11 ' CH2' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -118.75 121.1 39.3 Favored 'General case' 0 C--O 1.24 0.582 0 N-CA-C 105.629 -1.989 . . . . 10.0 105.629 -179.931 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 48.0 t-80 -115.18 68.03 0.7 Allowed 'General case' 0 N--CA 1.444 -0.739 0 CA-C-O 123.327 1.537 . . . . 10.0 110.828 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.511 HD11 ' CE3' ' A' ' 106' ' ' TRP . 9.0 tt -69.48 126.28 29.27 Favored 'General case' 0 N--CA 1.441 -0.889 0 CA-C-N 113.206 -1.815 . . . . 10.0 108.796 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -128.38 98.19 4.98 Favored 'General case' 0 CA--C 1.498 -1.047 0 CA-C-O 124.31 2.005 . . . . 10.0 107.494 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 3.1 ptp -95.09 133.64 38.68 Favored 'General case' 0 CA--C 1.515 -0.396 0 O-C-N 120.663 -1.273 . . . . 10.0 112.346 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.97 169.1 9.25 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 117.613 -1.184 . . . . 10.0 112.388 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -177.58 116.6 0.09 Allowed 'General case' 0 C--O 1.237 0.433 0 O-C-N 125.43 1.706 . . . . 10.0 106.604 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 67.91 31.56 5.61 Favored 'General case' 0 C--O 1.245 0.865 0 CA-C-O 123.354 1.55 . . . . 10.0 114.344 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 78.83 -3.81 63.3 Favored Glycine 0 CA--C 1.526 0.747 0 O-C-N 120.049 -1.657 . . . . 10.0 113.178 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 49.1 t -95.85 121.68 46.63 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 N-CA-C 105.924 -1.88 . . . . 10.0 105.924 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 4.9 m -104.4 117.47 34.26 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-O 122.407 1.099 . . . . 10.0 112.164 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 4.2 t -103.4 128.03 50.62 Favored 'General case' 0 C--O 1.214 -0.777 0 C-N-CA 126.039 1.736 . . . . 10.0 107.538 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.42 155.08 47.94 Favored 'General case' 0 C--O 1.218 -0.572 0 C-N-CA 119.098 -1.041 . . . . 10.0 111.457 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -136.22 135.54 39.16 Favored 'General case' 0 N--CA 1.439 -1.02 0 N-CA-C 113.146 0.795 . . . . 10.0 113.146 179.869 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -86.23 103.19 12.58 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 CA-C-N 114.2 -1.364 . . . . 10.0 107.676 179.601 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . 0.494 ' CD1' ' HB3' ' A' ' 8' ' ' TRP . 0.7 OUTLIER -93.52 165.58 12.68 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 118.109 -0.948 . . . . 10.0 109.096 -179.86 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 13.5 tptp -133.02 134.87 45.0 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 125.94 2.025 . . . . 10.0 108.543 179.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 15.4 tptm -88.49 131.46 34.89 Favored 'General case' 0 CA--C 1.512 -0.493 0 CA-C-N 114.603 -1.181 . . . . 10.0 109.487 -179.677 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 28.3 t -109.8 -48.42 6.94 Favored 'Isoleucine or valine' 0 C--O 1.243 0.75 0 O-C-N 125.876 1.985 . . . . 10.0 109.075 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 6.2 t-80 . . . . . 0 N--CA 1.438 -1.05 0 CA-C-N 112.84 -1.982 . . . . 10.0 114.17 -179.806 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.484 0.938 0 CA-C-O 124.09 1.621 . . . . 10.0 113.289 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 14.4 m -106.21 67.21 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 114.383 -1.28 . . . . 10.0 111.722 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -128.95 51.46 2.04 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 123.512 1.625 . . . . 10.0 109.983 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.414 ' CE1' HD11 ' A' ' 110' ' ' ILE . 10.0 m-85 63.21 -43.32 0.21 Allowed 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 117.11 2.263 . . . . 10.0 117.11 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 42.7 t-20 -40.25 106.39 0.05 Allowed 'General case' 0 C--N 1.319 -0.744 0 C-N-CA 125.455 1.502 . . . . 10.0 114.916 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -165.45 -127.17 0.87 Allowed Glycine 0 N--CA 1.468 0.796 0 N-CA-C 116.61 1.404 . . . . 10.0 116.61 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -167.15 122.98 1.11 Allowed 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 102.664 -3.087 . . . . 10.0 102.664 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 40.9 m0 -106.77 107.69 18.83 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 117.75 -1.119 . . . . 10.0 109.345 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.413 ' HE3' ' HB3' ' A' ' 131' ' ' LYS . 20.0 pttt -97.4 108.34 21.05 Favored 'General case' 0 C--O 1.216 -0.683 0 N-CA-C 105.589 -2.004 . . . . 10.0 105.589 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.17 166.84 0.09 Allowed 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 115.602 1.704 . . . . 10.0 115.602 -179.868 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.3 tt -126.12 -63.88 1.08 Allowed 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 105.18 -2.156 . . . . 10.0 105.18 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 77.4 p -144.64 155.89 43.84 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 124.654 1.182 . . . . 10.0 113.891 179.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -129.35 155.7 45.21 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 125.392 1.682 . . . . 10.0 106.647 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.8 pm0 -144.81 146.88 32.31 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 116.821 2.156 . . . . 10.0 116.821 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.1 m120 54.85 16.47 1.45 Allowed 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 114.571 1.323 . . . . 10.0 114.571 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -59.17 -36.79 75.92 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 116.015 1.858 . . . . 10.0 116.015 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.38 -34.77 61.14 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-N 119.419 1.009 . . . . 10.0 111.62 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -73.55 -27.39 61.31 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 107.846 -1.168 . . . . 10.0 107.846 179.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.412 ' CD2' HD23 ' A' ' 20' ' ' LEU . 10.1 t80 -65.15 -42.52 93.72 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 124.994 1.317 . . . . 10.0 111.024 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.633 HD12 ' HA ' ' A' ' 30' ' ' ARG . 24.4 mt -75.11 -25.52 58.56 Favored 'General case' 0 N--CA 1.478 0.946 0 O-C-N 121.797 -0.564 . . . . 10.0 109.576 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 57.1 ttt180 -67.79 -27.66 66.93 Favored 'General case' 0 C--O 1.242 0.708 0 C-N-CA 124.582 1.153 . . . . 10.0 110.735 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.51 -42.33 71.43 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.08 1.352 . . . . 10.0 110.096 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 32.6 mt -76.99 -13.47 59.96 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 122.312 1.053 . . . . 10.0 109.741 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 29.7 m-20 45.46 39.67 4.86 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.575 1.15 . . . . 10.0 111.483 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.569 HG12 ' N ' ' A' ' 26' ' ' ASN . 1.2 t -57.15 -63.54 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 O-C-N 127.428 2.955 . . . . 10.0 104.692 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.569 ' N ' HG12 ' A' ' 25' ' ' VAL . 5.4 t-20 -167.75 161.35 13.25 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.303 0.853 . . . . 10.0 113.303 -179.761 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.4 HG13 ' NH2' ' A' ' 30' ' ' ARG . 2.9 t -78.51 -33.14 16.85 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 N-CA-C 114.633 1.345 . . . . 10.0 114.633 -179.822 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -74.67 -32.34 62.19 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.003 -0.999 . . . . 10.0 112.634 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.5 tp -78.84 -21.47 47.57 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 122.021 0.915 . . . . 10.0 113.306 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.633 ' HA ' HD12 ' A' ' 20' ' ' LEU . 15.7 ttm180 -74.46 -31.31 62.19 Favored 'General case' 0 C--O 1.22 -0.491 0 O-C-N 119.605 -1.935 . . . . 10.0 111.311 -179.751 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.2 tttp -77.95 -39.03 43.95 Favored 'General case' 0 C--O 1.225 -0.19 0 CA-C-N 114.137 -1.392 . . . . 10.0 110.209 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 10.7 mm -75.29 -46.41 38.54 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 CA-C-N 114.278 -1.328 . . . . 10.0 109.913 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.54 ' CB ' HD11 ' A' ' 20' ' ' LEU . . . -67.21 -21.07 65.78 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 115.623 1.712 . . . . 10.0 115.623 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -71.1 -45.69 63.19 Favored 'General case' 0 N--CA 1.443 -0.819 0 N-CA-C 114.886 1.439 . . . . 10.0 114.886 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.3 pp -59.04 -21.84 59.74 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 113.627 0.973 . . . . 10.0 113.627 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -69.23 159.03 33.8 Favored 'General case' 0 C--O 1.217 -0.63 0 O-C-N 124.116 0.885 . . . . 10.0 112.348 -179.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 7.6 mttp -146.28 107.29 4.16 Favored Pre-proline 0 C--N 1.322 -0.593 0 N-CA-C 103.662 -2.718 . . . . 10.0 103.662 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -89.13 104.35 0.39 Allowed 'Trans proline' 0 C--N 1.354 0.868 0 N-CA-C 118.8 2.577 . . . . 10.0 118.8 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -81.28 136.01 35.76 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 103.536 -2.764 . . . . 10.0 103.536 178.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 12.0 mtpp -118.66 142.51 47.59 Favored 'General case' 0 C--N 1.31 -1.141 0 C-N-CA 118.846 -1.142 . . . . 10.0 112.153 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.424 ' OE1' HG23 ' A' ' 43' ' ' VAL . 0.2 OUTLIER -120.98 116.77 25.72 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 102.706 -3.072 . . . . 10.0 102.706 179.76 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 29.9 mt -110.66 136.26 47.22 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.058 0 CA-C-O 124.653 2.168 . . . . 10.0 111.062 -179.536 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.424 HG23 ' OE1' ' A' ' 41' ' ' GLU . 83.7 t -131.53 124.35 54.29 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.875 0 N-CA-C 105.095 -2.187 . . . . 10.0 105.095 -179.8 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 -108.86 165.13 11.79 Favored 'General case' 0 C--O 1.215 -0.733 0 CA-C-N 114.733 -1.121 . . . . 10.0 109.596 179.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -145.4 -146.81 0.2 Allowed 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 104.525 -2.398 . . . . 10.0 104.525 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -84.81 91.85 1.71 Allowed Glycine 0 CA--C 1.527 0.8 0 N-CA-C 105.993 -2.843 . . . . 10.0 105.993 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 62.02 20.34 11.51 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 124.481 0.754 . . . . 10.0 112.311 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 4.9 t-160 -125.75 103.52 7.85 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 105.413 -2.069 . . . . 10.0 105.413 -179.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.53 ' HG2' HD11 ' A' ' 51' ' ' ILE . 2.8 ttp -109.87 107.21 17.07 Favored 'General case' 0 C--O 1.216 -0.686 0 CA-C-N 112.723 -2.035 . . . . 10.0 116.028 -179.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.531 ' H ' HD12 ' A' ' 50' ' ' ILE . 3.3 mp -88.97 146.8 5.73 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 C-N-CA 125.824 1.65 . . . . 10.0 107.858 -179.583 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.53 HD11 ' HG2' ' A' ' 49' ' ' MET . 1.8 mp -133.87 133.12 56.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 O-C-N 124.582 1.176 . . . . 10.0 108.065 179.657 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 21.1 mtt-85 -124.14 127.58 48.0 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-O 117.798 -1.096 . . . . 10.0 113.199 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 12.7 m -114.63 94.85 4.96 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 102.814 -3.032 . . . . 10.0 102.814 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 58.0 mt -82.87 100.06 10.12 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 120.554 3.539 . . . . 10.0 120.554 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 48.9 p -122.82 -139.88 0.31 Allowed 'General case' 0 C--N 1.319 -0.759 0 O-C-N 126.168 2.167 . . . . 10.0 108.028 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -139.1 -38.36 0.5 Allowed 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 119.212 0.915 . . . . 10.0 111.86 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -54.76 -81.16 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 123.048 1.404 . . . . 10.0 110.507 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 3.2 mmp_? -110.47 -25.67 9.92 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 116.767 -1.587 . . . . 10.0 113.847 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.639 ' O ' HD12 ' A' ' 61' ' ' ILE . 5.2 m120 56.83 85.31 0.08 Allowed 'General case' 0 CA--C 1.537 0.477 0 O-C-N 126.41 2.319 . . . . 10.0 108.352 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -56.16 117.83 4.12 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 107.007 -1.479 . . . . 10.0 107.007 -179.548 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.639 HD12 ' O ' ' A' ' 59' ' ' ASN . 3.6 mt -128.1 114.29 34.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 CA-C-N 113.798 -1.546 . . . . 10.0 111.454 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 3.2 mtm -121.27 172.39 8.04 Favored 'General case' 0 C--O 1.214 -0.795 0 N-CA-C 104.716 -2.327 . . . . 10.0 104.716 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.407 ' HA ' ' HA ' ' A' ' 50' ' ' ILE . 0.8 OUTLIER -163.23 128.6 3.11 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 104.904 -2.258 . . . . 10.0 104.904 179.553 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 -135.02 178.63 6.88 Favored 'General case' 0 CA--C 1.515 -0.366 0 N-CA-C 114.142 1.164 . . . . 10.0 114.142 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -129.44 100.51 5.58 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 126.868 2.605 . . . . 10.0 105.457 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.1 t -43.95 146.59 0.32 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.594 0 O-C-N 125.879 1.987 . . . . 10.0 110.419 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 56.42 63.74 5.04 Favored Glycine 0 CA--C 1.526 0.78 0 CA-C-N 114.077 -1.42 . . . . 10.0 113.03 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.12 166.57 2.4 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 125.011 2.338 . . . . 10.0 116.22 -179.758 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -87.5 133.96 33.68 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 113.444 -1.707 . . . . 10.0 110.783 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -145.69 112.51 5.99 Favored 'General case' 0 C--N 1.318 -0.777 0 O-C-N 125.301 1.625 . . . . 10.0 114.1 -179.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 17.9 pt-20 -76.6 135.66 39.21 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 105.13 -2.174 . . . . 10.0 105.13 -179.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -99.9 -34.92 9.92 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 122.44 1.114 . . . . 10.0 112.511 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 75.83 -60.48 0.49 Allowed 'General case' 0 C--O 1.221 -0.418 0 CA-C-N 114.235 -1.348 . . . . 10.0 108.614 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 61.77 33.57 17.77 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 116.689 2.107 . . . . 10.0 116.689 179.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -59.44 125.2 22.67 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-O 123.144 1.45 . . . . 10.0 109.158 -179.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 75.33 133.41 0.36 Allowed Glycine 0 C--O 1.223 -0.554 0 CA-C-O 118.336 -1.258 . . . . 10.0 110.413 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.485 HG22 ' O ' ' A' ' 77' ' ' ILE . 2.8 mt 92.02 20.49 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 O-C-N 126.448 1.911 . . . . 10.0 108.711 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.554 ' HA ' HG22 ' A' ' 25' ' ' VAL . 18.4 t70 143.32 -33.84 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.74 0 O-C-N 128.659 3.724 . . . . 10.0 114.098 179.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 50.48 52.85 14.0 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 124.121 0.968 . . . . 10.0 112.967 -179.648 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.5 -67.65 0.57 Allowed 'General case' 0 N--CA 1.467 0.407 0 O-C-N 119.49 -2.006 . . . . 10.0 114.094 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 88.56 118.74 0.03 OUTLIER 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 102.876 -3.009 . . . . 10.0 102.876 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 4.6 p -147.4 171.25 15.77 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 123.433 1.587 . . . . 10.0 110.246 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.09 71.75 0.87 Allowed 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 100.287 -3.968 . . . . 10.0 100.287 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 6.3 m -76.77 139.53 40.43 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 118.315 2.709 . . . . 10.0 118.315 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 1.9 m -124.97 129.27 50.01 Favored 'General case' 0 C--O 1.244 0.77 0 O-C-N 125.475 1.734 . . . . 10.0 107.421 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -101.86 159.19 4.24 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.989 0 N-CA-C 104.773 -2.306 . . . . 10.0 104.773 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.4 t -145.99 167.76 22.54 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 122.75 1.262 . . . . 10.0 110.837 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . 0.468 ' HA ' HD12 ' A' ' 93' ' ' LEU . 11.1 p90 -124.32 122.61 38.18 Favored 'General case' 0 C--O 1.239 0.534 0 CA-C-N 112.815 -1.993 . . . . 10.0 107.177 179.853 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -88.97 172.52 9.07 Favored 'General case' 0 C--N 1.312 -1.053 1 N-CA-C 98.593 -4.595 . . . . 10.0 98.593 179.985 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -65.87 -27.78 73.07 Favored Glycine 0 CA--C 1.496 -1.156 0 N-CA-C 108.448 -1.861 . . . . 10.0 108.448 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 44.0 p-10 -145.66 25.88 1.3 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 118.89 1.345 . . . . 10.0 111.897 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 2.1 mtmt -153.03 -157.11 0.76 Allowed 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 108.3 -1.0 . . . . 10.0 108.3 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.468 HD12 ' HA ' ' A' ' 88' ' ' TRP . 4.4 tp -165.27 136.48 3.99 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 106.257 -1.757 . . . . 10.0 106.257 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -132.38 156.72 46.15 Favored 'General case' 0 CA--C 1.508 -0.655 0 N-CA-C 114.623 1.342 . . . . 10.0 114.623 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -133.72 145.25 49.7 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 123.129 1.442 . . . . 10.0 111.439 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 3.8 t -138.52 153.57 26.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 114.132 -1.395 . . . . 10.0 108.908 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -148.5 152.76 37.44 Favored 'General case' 0 C--O 1.246 0.878 0 CA-C-O 122.355 1.074 . . . . 10.0 108.365 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 2.8 mttp -117.62 83.54 2.01 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 114.61 -1.177 . . . . 10.0 110.122 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -152.96 87.07 0.13 Allowed Glycine 0 C--N 1.315 -0.604 0 C-N-CA 119.174 -1.489 . . . . 10.0 110.133 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 42.61 -154.81 0.02 OUTLIER 'General case' 0 C--O 1.246 0.888 0 N-CA-C 116.968 2.21 . . . . 10.0 116.968 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.401 ' N ' ' CD ' ' A' ' 101' ' ' LYS . 0.0 OUTLIER 62.66 166.65 0.12 Allowed 'General case' 0 C--O 1.217 -0.642 0 CA-C-O 124.089 1.899 . . . . 10.0 112.552 179.759 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -100.13 4.9 44.8 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-N 112.646 -2.07 . . . . 10.0 114.451 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 170.48 58.13 0.04 OUTLIER Glycine 0 C--N 1.319 -0.373 0 N-CA-C 120.02 2.768 . . . . 10.0 120.02 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.504 ' H ' ' NE ' ' A' ' 104' ' ' ARG . 0.0 OUTLIER -86.59 161.88 18.28 Favored 'General case' 0 N--CA 1.441 -0.88 0 O-C-N 125.034 1.079 . . . . 10.0 109.44 -179.943 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 127.55 154.94 8.62 Favored Glycine 0 N--CA 1.435 -1.402 0 C-N-CA 120.624 -0.798 . . . . 10.0 111.457 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -118.77 154.64 32.48 Favored 'General case' 0 CA--C 1.506 -0.734 0 C-N-CA 124.442 1.097 . . . . 10.0 110.502 -179.776 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.1 m -131.88 139.79 48.89 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-O 123.697 1.713 . . . . 10.0 107.864 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -120.94 125.31 47.1 Favored 'General case' 0 C--O 1.246 0.917 0 CA-C-N 113.249 -1.796 . . . . 10.0 108.608 -179.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 5.5 t-105 -132.27 137.03 47.34 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 106.839 -1.541 . . . . 10.0 106.839 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.414 HD11 ' CE1' ' A' ' 4' ' ' PHE . 2.1 mt -111.26 140.85 28.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 O-C-N 126.352 2.283 . . . . 10.0 117.022 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -123.82 170.56 10.42 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 104.103 -2.554 . . . . 10.0 104.103 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -33.95 -80.0 0.02 OUTLIER Glycine 0 C--O 1.241 0.59 0 O-C-N 128.152 3.407 . . . . 10.0 111.159 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -115.42 15.53 16.77 Favored 'General case' 0 CA--C 1.555 1.143 0 CA-C-N 120.157 1.978 . . . . 10.0 108.776 179.737 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -126.9 154.51 44.35 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 124.547 2.117 . . . . 10.0 112.516 -179.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.485 ' HB3' ' HB2' ' A' ' 130' ' ' PHE . 0.2 OUTLIER -113.42 127.55 56.15 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 111.715 -2.493 . . . . 10.0 106.525 179.863 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -110.87 79.64 1.22 Allowed 'General case' 0 C--O 1.217 -0.656 0 CA-C-O 122.305 1.05 . . . . 10.0 111.785 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 1.7 tp -80.27 148.24 30.85 Favored 'General case' 0 C--O 1.218 -0.582 0 CA-C-O 124.417 2.056 . . . . 10.0 113.493 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.412 ' HA ' ' HB3' ' A' ' 127' ' ' LYS . 0.0 OUTLIER -142.89 136.33 28.53 Favored 'General case' 0 C--O 1.219 -0.54 0 O-C-N 119.594 -1.941 . . . . 10.0 107.264 -179.835 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 7.5 mtp -138.48 151.08 47.07 Favored 'General case' 0 CA--C 1.51 -0.589 0 CA-C-O 122.941 1.353 . . . . 10.0 108.111 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.421 ' O ' ' HB2' ' A' ' 121' ' ' ALA . 2.8 mtt-85 -143.58 166.48 24.71 Favored 'General case' 0 CA--C 1.512 -0.512 0 O-C-N 119.852 -1.78 . . . . 10.0 112.338 -179.777 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . 0.421 ' HB2' ' O ' ' A' ' 120' ' ' ARG . . . 178.57 122.66 0.05 OUTLIER 'General case' 0 CA--C 1.503 -0.848 0 CA-C-N 114.418 -1.264 . . . . 10.0 109.212 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 50.92 41.19 26.68 Favored 'General case' 0 C--O 1.244 0.791 0 O-C-N 125.96 2.037 . . . . 10.0 115.947 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 84.12 -7.37 71.55 Favored Glycine 0 C--N 1.341 0.811 0 O-C-N 124.646 1.216 . . . . 10.0 115.165 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 12.7 t -91.31 126.85 43.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 CA-C-O 117.642 -1.17 . . . . 10.0 111.409 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 85.6 m -111.86 111.35 22.24 Favored 'General case' 0 N--CA 1.441 -0.904 0 O-C-N 126.725 2.516 . . . . 10.0 115.83 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 1.4 t -110.07 156.39 20.61 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 104.996 -2.224 . . . . 10.0 104.996 -179.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . 0.412 ' HB3' ' HA ' ' A' ' 118' ' ' GLU . 0.0 OUTLIER -168.07 177.92 5.32 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 123.306 1.527 . . . . 10.0 110.163 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -149.83 150.42 31.95 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 112.789 -2.005 . . . . 10.0 114.092 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 28.1 t -111.32 115.66 50.45 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.788 0 N-CA-C 105.199 -2.149 . . . . 10.0 105.199 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . 0.485 ' HB2' ' HB3' ' A' ' 115' ' ' LEU . 55.1 m-85 -110.39 162.55 14.55 Favored 'General case' 0 CA--C 1.51 -0.573 0 O-C-N 125.584 1.802 . . . . 10.0 111.809 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.413 ' HB3' ' HE3' ' A' ' 9' ' ' LYS . 0.0 OUTLIER -129.45 115.22 17.18 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 105.879 -1.897 . . . . 10.0 105.879 179.866 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 9.9 tttp -76.45 116.78 17.46 Favored 'General case' 0 C--O 1.216 -0.675 0 O-C-N 125.524 1.765 . . . . 10.0 108.506 -179.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.63 -37.39 77.55 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.678 0 CA-C-N 114.127 -1.397 . . . . 10.0 112.117 -179.741 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 . . . . . 0 N--CA 1.446 -0.641 0 CA-C-O 117.195 -1.384 . . . . 10.0 107.86 179.849 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo . . . . . 0 CA--C 1.538 0.675 0 CA-C-O 123.116 1.215 . . . . 10.0 112.714 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -109.3 17.14 7.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 C-N-CA 124.297 1.039 . . . . 10.0 110.017 -179.901 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -72.04 145.45 48.26 Favored 'General case' 0 C--O 1.238 0.497 0 CA-C-O 123.167 1.46 . . . . 10.0 111.419 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.447 ' CD1' HD11 ' A' ' 110' ' ' ILE . 57.0 m-85 -96.5 -28.23 14.5 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 116.899 2.185 . . . . 10.0 116.899 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 47.0 p-10 -64.48 139.79 58.8 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 117.985 2.587 . . . . 10.0 117.985 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -174.23 -130.57 1.3 Allowed Glycine 0 N--CA 1.452 -0.267 0 N-CA-C 117.179 1.632 . . . . 10.0 117.179 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -160.84 98.15 1.19 Allowed 'General case' 0 C--O 1.239 0.533 0 N-CA-C 105.709 -1.96 . . . . 10.0 105.709 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.562 ' CZ3' ' HG2' ' A' ' 132' ' ' LYS . 0.8 OUTLIER -90.15 139.64 30.43 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 116.253 -1.832 . . . . 10.0 107.697 179.9 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -123.04 8.88 9.28 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 125.09 1.494 . . . . 10.0 111.481 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 61.77 135.09 0.01 OUTLIER 'General case' 0 C--N 1.309 -1.163 0 O-C-N 126.718 2.511 . . . . 10.0 117.527 179.101 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.5 tp -113.05 -56.08 2.45 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 107.854 -1.165 . . . . 10.0 107.854 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.1 p -154.01 -178.25 6.96 Favored 'General case' 0 C--O 1.242 0.679 0 N-CA-C 115.522 1.675 . . . . 10.0 115.522 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -154.17 164.02 39.18 Favored 'General case' 0 C--O 1.238 0.457 0 N-CA-C 105.002 -2.222 . . . . 10.0 105.002 -179.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -156.02 18.6 0.37 Allowed 'General case' 0 C--O 1.234 0.237 0 O-C-N 118.545 -2.597 . . . . 10.0 114.658 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.415 ' CB ' ' HA ' ' A' ' 126' ' ' CYS . 0.3 OUTLIER -163.01 26.52 0.09 Allowed 'General case' 0 C--O 1.241 0.651 0 O-C-N 125.34 1.65 . . . . 10.0 114.332 -179.873 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.634 ' CE2' ' HB1' ' A' ' 33' ' ' ALA . 2.6 t80 -62.75 -52.59 62.61 Favored 'General case' 0 C--O 1.243 0.718 0 C-N-CA 124.627 1.171 . . . . 10.0 113.71 -179.591 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.0 tm-20 -69.01 -34.13 74.77 Favored 'General case' 0 CA--C 1.511 -0.557 0 N-CA-C 115.151 1.537 . . . . 10.0 115.151 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -77.0 -23.3 52.25 Favored 'General case' 0 C--N 1.32 -0.715 0 O-C-N 124.91 1.381 . . . . 10.0 108.034 -179.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -78.1 -32.59 50.63 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 107.994 -1.113 . . . . 10.0 107.994 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 81.8 mt -75.9 -30.4 58.77 Favored 'General case' 0 C--O 1.217 -0.656 0 O-C-N 119.926 -1.733 . . . . 10.0 111.876 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.2 ttm180 -68.96 -27.09 65.42 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 124.11 0.964 . . . . 10.0 110.245 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.26 -49.01 54.24 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.189 1.795 . . . . 10.0 109.308 -179.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.566 HD13 ' HB3' ' A' ' 78' ' ' ASP . 2.6 mt -74.9 -15.47 60.7 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 125.915 2.009 . . . . 10.0 111.793 179.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 69.15 28.94 4.84 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 115.396 1.628 . . . . 10.0 115.396 -179.7 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 6.1 m -62.0 178.12 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 N-CA-C 107.675 -1.231 . . . . 10.0 107.675 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -62.32 152.07 34.83 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 116.327 1.973 . . . . 10.0 116.327 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 14.8 p -70.74 -32.29 48.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 N-CA-C 115.072 1.508 . . . . 10.0 115.072 179.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -73.72 -25.04 60.01 Favored 'General case' 0 C--O 1.243 0.725 0 O-C-N 124.989 1.431 . . . . 10.0 109.171 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -73.99 -50.48 19.69 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-N 114.024 -1.444 . . . . 10.0 108.826 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.49 -25.37 68.23 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 125.145 1.378 . . . . 10.0 113.491 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -73.92 -44.84 53.78 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 113.166 -1.833 . . . . 10.0 112.12 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.418 HG22 ' CD2' ' A' ' 36' ' ' LEU . 1.7 mm -69.31 -54.85 17.67 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 O-C-N 120.093 -1.629 . . . . 10.0 110.755 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.634 ' HB1' ' CE2' ' A' ' 16' ' ' PHE . . . -45.57 -28.13 0.89 Allowed 'General case' 0 C--O 1.216 -0.696 0 N-CA-C 115.874 1.805 . . . . 10.0 115.874 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 13.9 t-20 -86.15 -2.47 58.38 Favored 'General case' 0 N--CA 1.44 -0.968 0 O-C-N 119.995 -1.691 . . . . 10.0 113.908 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 15.7 mt -104.43 -20.15 13.81 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 108.942 -0.762 . . . . 10.0 108.942 179.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.418 ' CD2' HG22 ' A' ' 32' ' ' ILE . 0.4 OUTLIER -128.29 173.66 9.96 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 113.422 0.897 . . . . 10.0 113.422 -179.953 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 6.5 ptpt -151.32 155.19 34.46 Favored Pre-proline 0 N--CA 1.478 0.949 0 N-CA-C 104.236 -2.505 . . . . 10.0 104.236 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo -101.74 162.56 0.35 Allowed 'Trans proline' 0 N--CA 1.459 -0.547 1 C-N-CA 126.799 4.999 . . . . 10.0 116.672 -179.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -110.42 -175.86 2.83 Favored 'General case' 0 C--O 1.239 0.55 0 N-CA-C 104.927 -2.249 . . . . 10.0 104.927 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.76 140.78 11.1 Favored 'General case' 0 C--N 1.309 -1.153 0 O-C-N 120.517 -1.364 . . . . 10.0 111.73 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -132.16 135.84 46.66 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 105.225 -2.139 . . . . 10.0 105.225 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.406 HG13 ' NE1' ' A' ' 8' ' ' TRP . 0.9 OUTLIER -121.52 141.21 42.92 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.026 0 N-CA-C 109.265 -0.642 . . . . 10.0 109.265 -179.926 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.5 t -137.86 135.35 45.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 105.791 -1.929 . . . . 10.0 105.791 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -126.47 113.3 16.65 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 121.482 0.658 . . . . 10.0 109.85 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -82.08 -17.57 46.09 Favored 'General case' 0 C--O 1.219 -0.543 0 N-CA-C 106.757 -1.572 . . . . 10.0 106.757 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 140.44 -110.67 0.69 Allowed Glycine 0 CA--C 1.521 0.451 0 N-CA-C 107.619 -2.192 . . . . 10.0 107.619 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 60.0 m-20 -71.24 -13.54 61.94 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 119.299 -2.294 . . . . 10.0 108.541 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 31.7 m170 -109.78 144.83 37.66 Favored 'General case' 0 N--CA 1.439 -0.997 0 N-CA-C 105.372 -2.084 . . . . 10.0 105.372 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.528 ' C ' HD12 ' A' ' 50' ' ' ILE . 16.5 ttt -133.14 154.95 50.13 Favored 'General case' 0 C--N 1.317 -0.812 0 O-C-N 125.807 1.942 . . . . 10.0 111.592 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.528 HD12 ' C ' ' A' ' 49' ' ' MET . 4.6 mp -142.26 132.11 23.49 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.058 0 N-CA-C 107.161 -1.422 . . . . 10.0 107.161 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -120.24 125.56 74.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 CA-C-O 117.355 -1.307 . . . . 10.0 108.785 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.401 ' HB2' HD21 ' A' ' 54' ' ' LEU . 3.5 ptp180 -115.83 128.59 55.94 Favored 'General case' 0 C--O 1.221 -0.413 0 O-C-N 126.058 2.099 . . . . 10.0 108.27 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.611 ' C ' HD22 ' A' ' 54' ' ' LEU . 76.9 m -123.99 113.07 17.95 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 104.861 -2.274 . . . . 10.0 104.861 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.611 HD22 ' C ' ' A' ' 53' ' ' THR . 2.5 mm? -119.51 140.3 50.71 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 119.52 3.156 . . . . 10.0 119.52 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -165.29 28.16 0.06 Allowed 'General case' 0 N--CA 1.445 -0.704 0 N-CA-C 109.273 -0.64 . . . . 10.0 109.273 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.49 ' O ' HG22 ' A' ' 56' ' ' THR . 9.0 m 44.14 48.21 7.58 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 112.647 0.61 . . . . 10.0 112.647 179.814 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -159.98 -70.89 0.07 Allowed 'General case' 0 C--O 1.247 0.946 0 N-CA-C 105.849 -1.908 . . . . 10.0 105.849 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.408 ' NE ' ' HA ' ' A' ' 58' ' ' ARG . 0.0 OUTLIER -113.11 118.26 34.25 Favored 'General case' 0 C--O 1.245 0.836 0 CA-C-N 113.628 -1.624 . . . . 10.0 109.74 -179.916 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -102.53 102.34 12.6 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.745 0.784 . . . . 10.0 109.914 179.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.699 ' OH ' HD11 ' A' ' 74' ' ' LEU . 0.1 OUTLIER -87.34 107.76 18.67 Favored 'General case' 0 C--O 1.212 -0.88 0 N-CA-C 105.33 -2.1 . . . . 10.0 105.33 -179.698 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 5.2 mt -135.84 141.48 41.82 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 CA-C-O 122.463 1.125 . . . . 10.0 111.312 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 28.3 mmt -149.57 178.16 9.09 Favored 'General case' 0 CA--C 1.505 -0.76 0 N-CA-C 104.549 -2.389 . . . . 10.0 104.549 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 58.6 m-20 -142.16 69.46 1.32 Allowed 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 102.638 -3.097 . . . . 10.0 102.638 -179.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 6.0 m-30 -70.58 146.12 50.31 Favored 'General case' 0 C--O 1.243 0.732 0 N-CA-C 115.398 1.629 . . . . 10.0 115.398 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -116.93 120.79 39.53 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 107.046 -1.465 . . . . 10.0 107.046 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 43.9 t -65.04 100.95 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.723 0 C-N-CA 123.942 0.897 . . . . 10.0 110.871 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 94.61 68.3 1.04 Allowed Glycine 0 C--O 1.221 -0.695 0 O-C-N 127.868 3.23 . . . . 10.0 112.027 -179.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -167.3 136.46 2.73 Favored 'General case' 0 C--O 1.231 0.091 0 O-C-N 119.472 -2.193 . . . . 10.0 114.851 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -84.57 136.06 33.94 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 118.485 -1.286 . . . . 10.0 111.311 179.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 44.2 p90 -158.62 128.37 5.79 Favored 'General case' 0 C--N 1.322 -0.617 0 O-C-N 120.612 -1.305 . . . . 10.0 109.268 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -61.9 155.14 24.21 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 123.719 1.723 . . . . 10.0 110.902 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 14.8 tp10 -120.95 67.49 0.86 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 113.139 -1.846 . . . . 10.0 113.564 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -68.97 71.82 0.24 Allowed 'General case' 0 C--N 1.316 -0.85 0 C-N-CA 125.395 1.478 . . . . 10.0 107.107 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.699 HD11 ' OH ' ' A' ' 60' ' ' TYR . 0.4 OUTLIER -76.58 137.16 39.35 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 114.082 -1.417 . . . . 10.0 113.721 -179.807 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 51.0 p -152.78 50.91 0.75 Allowed 'General case' 0 C--O 1.242 0.707 0 N-CA-C 106.165 -1.791 . . . . 10.0 106.165 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -128.91 -59.18 0.11 Allowed Glycine 0 N--CA 1.435 -1.425 0 O-C-N 125.266 1.604 . . . . 10.0 112.417 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.492 HG22 ' N ' ' A' ' 78' ' ' ASP . 46.3 mt -112.46 -87.15 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.539 0 O-C-N 124.667 0.863 . . . . 10.0 109.692 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.566 ' HB3' HD13 ' A' ' 23' ' ' LEU . 1.3 p30 -81.26 3.82 22.61 Favored 'General case' 0 CA--C 1.51 -0.566 0 N-CA-C 115.298 1.592 . . . . 10.0 115.298 -179.725 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.8 p30 44.68 -155.76 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 114.545 1.313 . . . . 10.0 114.545 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 72.84 130.77 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 119.477 1.035 . . . . 10.0 111.841 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 6.3 ttpm? -87.73 122.45 31.41 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 104.783 -2.303 . . . . 10.0 104.783 -179.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -121.59 172.4 8.13 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 107.601 -1.259 . . . . 10.0 107.601 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . 0.404 ' CB ' ' HB2' ' A' ' 98' ' ' LYS . 0.0 OUTLIER -116.48 126.6 53.6 Favored 'General case' 0 CA--C 1.512 -0.498 1 N-CA-C 98.902 -4.481 . . . . 10.0 98.902 -179.954 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 33.9 m -127.1 140.11 52.5 Favored 'General case' 0 C--N 1.311 -1.097 0 O-C-N 121.189 -0.945 . . . . 10.0 113.513 -179.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 2.1 m -126.82 101.54 6.64 Favored 'General case' 0 C--N 1.316 -0.872 0 O-C-N 125.052 1.47 . . . . 10.0 109.345 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 1.3 m -81.97 138.13 20.01 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.954 0 N-CA-C 101.332 -3.581 . . . . 10.0 101.332 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 13.7 t -145.89 167.13 24.0 Favored 'General case' 0 C--N 1.317 -0.84 0 C-N-CA 119.364 -0.935 . . . . 10.0 111.037 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 5.7 t90 -97.28 129.23 44.61 Favored 'General case' 0 C--N 1.314 -0.956 0 O-C-N 125.707 1.879 . . . . 10.0 106.554 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -139.85 98.0 3.37 Favored 'General case' 0 CA--C 1.505 -0.771 0 N-CA-C 101.519 -3.512 . . . . 10.0 101.519 -179.773 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 52.19 -130.77 37.43 Favored Glycine 0 N--CA 1.437 -1.29 0 N-CA-C 104.762 -3.335 . . . . 10.0 104.762 179.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -89.37 24.23 2.29 Favored 'General case' 0 N--CA 1.446 -0.628 0 O-C-N 124.288 0.64 . . . . 10.0 112.205 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.7 167.42 12.07 Favored 'General case' 0 CA--C 1.508 -0.641 0 CA-C-O 121.601 0.715 . . . . 10.0 110.651 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -125.05 99.64 6.21 Favored 'General case' 0 C--O 1.241 0.635 0 N-CA-C 102.85 -3.018 . . . . 10.0 102.85 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 18.4 mm-40 -85.76 137.0 33.1 Favored 'General case' 0 CA--C 1.503 -0.851 0 O-C-N 124.756 1.285 . . . . 10.0 113.188 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 7.1 t -137.94 123.86 20.11 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 108.33 -0.989 . . . . 10.0 108.33 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 16.1 t -133.93 117.12 25.03 Favored 'Isoleucine or valine' 0 C--O 1.245 0.84 0 CA-C-N 112.939 -1.937 . . . . 10.0 109.256 -179.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 17.3 mt-30 -90.54 143.23 26.95 Favored 'General case' 0 C--O 1.243 0.758 0 N-CA-C 107.235 -1.394 . . . . 10.0 107.235 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.404 ' HB2' ' CB ' ' A' ' 83' ' ' MET . 0.6 OUTLIER -85.18 17.07 3.17 Favored 'General case' 0 CA--C 1.508 -0.643 0 O-C-N 124.249 0.968 . . . . 10.0 113.255 179.973 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -77.79 -178.08 48.05 Favored Glycine 0 N--CA 1.435 -1.37 0 C-N-CA 118.231 -1.937 . . . . 10.0 109.816 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -70.76 164.06 25.95 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 113.681 0.993 . . . . 10.0 113.681 -179.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 15.0 mttm 82.95 -179.91 0.05 Allowed 'General case' 0 CA--C 1.54 0.575 0 O-C-N 125.773 1.921 . . . . 10.0 112.401 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -108.17 130.76 55.11 Favored 'General case' 0 C--O 1.223 -0.301 0 O-C-N 124.76 1.288 . . . . 10.0 112.306 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 106.09 -20.55 35.47 Favored Glycine 0 C--O 1.215 -1.057 0 N-CA-C 118.338 2.095 . . . . 10.0 118.338 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 10.2 mtt180 -40.98 116.35 0.71 Allowed 'General case' 0 C--N 1.327 -0.407 0 O-C-N 125.956 1.621 . . . . 10.0 110.999 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 125.74 170.95 13.11 Favored Glycine 0 C--O 1.218 -0.898 0 N-CA-C 107.933 -2.067 . . . . 10.0 107.933 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -130.92 174.72 9.71 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 123.036 1.398 . . . . 10.0 110.038 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 48.6 m -130.97 133.69 46.03 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 104.672 -2.344 . . . . 10.0 104.672 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -122.08 125.73 46.86 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 118.254 -0.879 . . . . 10.0 110.699 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' TRP . . . . . 0.496 ' CD1' ' C ' ' A' ' 109' ' ' TRP . 0.0 OUTLIER -138.45 145.14 40.53 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 126.097 2.123 . . . . 10.0 106.74 -179.98 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.447 HD11 ' CD1' ' A' ' 4' ' ' PHE . 4.7 mt -105.36 137.9 32.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 124.184 1.945 . . . . 10.0 115.646 179.718 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -104.45 165.95 10.72 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 104.611 -2.366 . . . . 10.0 104.611 179.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -39.55 -73.07 0.19 Allowed Glycine 0 N--CA 1.448 -0.521 0 O-C-N 126.015 2.072 . . . . 10.0 111.414 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -122.46 35.98 4.75 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 121.576 0.703 . . . . 10.0 110.248 -179.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -150.45 164.12 36.69 Favored 'General case' 0 C--O 1.241 0.62 0 O-C-N 119.402 -2.061 . . . . 10.0 109.722 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -119.2 120.99 38.68 Favored 'General case' 0 C--N 1.314 -0.965 0 N-CA-C 104.351 -2.463 . . . . 10.0 104.351 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -119.0 91.1 3.47 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 119.348 0.976 . . . . 10.0 108.517 179.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.513 HD12 ' H ' ' A' ' 118' ' ' GLU . 30.5 tp -86.98 151.2 23.49 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 124.55 1.156 . . . . 10.0 109.745 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.513 ' H ' HD12 ' A' ' 117' ' ' LEU . 34.6 tt0 -139.46 102.94 4.59 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 114.924 -1.034 . . . . 10.0 109.966 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 4.7 mtp -97.54 154.33 17.58 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 108.437 -0.949 . . . . 10.0 108.437 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -146.89 154.78 41.7 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 114.093 1.146 . . . . 10.0 114.093 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -170.02 118.53 0.59 Allowed 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 105.027 -2.212 . . . . 10.0 105.027 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 63.64 43.31 5.78 Favored 'General case' 0 C--O 1.242 0.7 0 O-C-N 126.664 2.477 . . . . 10.0 113.093 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 64.47 15.92 59.98 Favored Glycine 0 C--O 1.22 -0.763 0 O-C-N 121.236 -0.915 . . . . 10.0 115.37 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 2.6 t -105.16 123.25 59.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 N-CA-C 108.064 -1.087 . . . . 10.0 108.064 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 85.1 m -93.78 117.47 30.14 Favored 'General case' 0 N--CA 1.441 -0.903 0 O-C-N 123.82 0.7 . . . . 10.0 112.484 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . 0.415 ' HA ' ' CB ' ' A' ' 15' ' ' ASN . 51.6 t -116.88 104.93 11.8 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 106.487 -1.672 . . . . 10.0 106.487 179.808 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 28.9 mtpt -106.56 152.38 23.78 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 122.396 1.093 . . . . 10.0 111.822 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -135.3 107.91 7.43 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 108.206 -1.035 . . . . 10.0 108.206 -179.579 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 76.8 t -83.14 122.37 37.38 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.73 0 O-C-N 125.555 1.784 . . . . 10.0 107.694 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 59.6 m-85 -112.07 -172.38 2.03 Favored 'General case' 0 N--CA 1.45 -0.457 0 O-C-N 125.173 1.545 . . . . 10.0 108.506 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 24.1 tptp -151.87 122.48 7.4 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 123.542 1.639 . . . . 10.0 107.745 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . 0.562 ' HG2' ' CZ3' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -78.27 110.78 13.59 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-N 115.01 -0.995 . . . . 10.0 108.866 -179.832 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 4.2 t -100.87 -1.85 9.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 118.209 -0.901 . . . . 10.0 109.313 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.44 -0.936 0 O-C-N 126.044 2.09 . . . . 10.0 110.866 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_exo . . . . . 0 N--CA 1.491 1.368 0 N-CA-C 110.989 -0.427 . . . . 10.0 110.989 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -139.41 -43.21 0.29 Allowed 'Isoleucine or valine' 0 C--O 1.242 0.709 0 CA-C-N 113.28 -1.782 . . . . 10.0 112.589 -179.703 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 170.16 -66.36 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.561 0 O-C-N 125.465 1.728 . . . . 10.0 112.511 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.434 ' CE1' HD12 ' A' ' 110' ' ' ILE . 84.9 m-85 68.86 -49.22 0.58 Allowed 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 126.168 1.787 . . . . 10.0 114.027 -179.706 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -47.55 113.17 0.65 Allowed 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 115.105 1.52 . . . . 10.0 115.105 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 169.96 -116.0 0.63 Allowed Glycine 0 CA--C 1.529 0.968 0 O-C-N 125.467 1.729 . . . . 10.0 113.954 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -165.66 144.4 6.15 Favored 'General case' 0 C--O 1.224 -0.243 0 N-CA-C 100.894 -3.743 . . . . 10.0 100.894 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.577 ' CE2' HD12 ' A' ' 115' ' ' LEU . 87.2 m95 -129.92 114.9 16.43 Favored 'General case' 0 C--N 1.315 -0.919 0 O-C-N 124.53 1.144 . . . . 10.0 109.331 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 9.1 tptt -99.01 116.91 32.32 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.231 -1.35 . . . . 10.0 110.698 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.467 ' HA ' ' HA ' ' A' ' 130' ' ' PHE . 0.0 OUTLIER -61.46 135.51 57.7 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-O 122.234 1.016 . . . . 10.0 111.483 179.265 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 15.0 tp -117.02 -45.02 2.77 Favored 'General case' 0 CA--C 1.514 -0.441 0 O-C-N 120.611 -1.306 . . . . 10.0 111.436 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -122.29 156.93 32.82 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 123.977 1.846 . . . . 10.0 113.992 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -148.43 120.04 8.01 Favored 'General case' 0 CA--C 1.508 -0.666 0 CA-C-N 112.098 -2.319 . . . . 10.0 107.51 179.683 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.5 mt-10 -101.49 -71.57 0.71 Allowed 'General case' 0 C--N 1.319 -0.76 0 C-N-CA 122.861 0.465 . . . . 10.0 112.169 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 10.3 m-20 -107.18 56.38 0.64 Allowed 'General case' 0 C--O 1.24 0.586 0 CA-C-O 123.123 1.439 . . . . 10.0 112.893 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -71.26 -49.75 39.87 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 118.16 -2.838 . . . . 10.0 111.088 179.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -64.62 -36.63 84.88 Favored 'General case' 0 C--N 1.323 -0.565 0 O-C-N 119.396 -2.065 . . . . 10.0 115.633 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.68 -28.92 64.06 Favored 'General case' 0 C--O 1.216 -0.701 0 CA-C-O 122.95 1.357 . . . . 10.0 111.752 179.508 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.429 ' CE1' HD11 ' A' ' 23' ' ' LEU . 4.5 t80 -67.58 -42.96 81.7 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 113.142 -1.844 . . . . 10.0 111.447 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.518 ' HA ' HD12 ' A' ' 23' ' ' LEU . 46.9 mt -75.73 -22.35 56.65 Favored 'General case' 0 C--O 1.212 -0.902 0 O-C-N 120.989 -1.07 . . . . 10.0 110.817 179.739 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.34 -21.53 56.03 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 112.883 -1.962 . . . . 10.0 106.44 179.682 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.8 -35.71 59.98 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-O 125.194 2.426 . . . . 10.0 111.151 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.518 HD12 ' HA ' ' A' ' 20' ' ' LEU . 0.5 OUTLIER -89.41 -7.74 54.51 Favored 'General case' 0 CA--C 1.546 0.808 0 O-C-N 120.265 -1.522 . . . . 10.0 114.618 179.753 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 64.78 38.34 6.84 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 124.232 1.968 . . . . 10.0 113.606 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.555 ' CG2' HD23 ' A' ' 29' ' ' LEU . 0.3 OUTLIER -68.22 160.47 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.709 0 N-CA-C 105.161 -2.162 . . . . 10.0 105.161 -179.909 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 13.0 p30 -63.0 160.14 15.62 Favored 'General case' 0 C--O 1.242 0.663 0 O-C-N 125.412 1.695 . . . . 10.0 114.557 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -67.95 -35.24 71.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 N-CA-C 115.925 1.824 . . . . 10.0 115.925 -179.365 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.449 ' O ' HD12 ' A' ' 32' ' ' ILE . . . -72.66 -34.72 67.44 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 121.259 -0.9 . . . . 10.0 112.086 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.641 HD21 HG22 ' A' ' 77' ' ' ILE . 32.8 tp -66.18 -31.02 71.61 Favored 'General case' 0 C--N 1.32 -0.679 0 O-C-N 120.153 -1.592 . . . . 10.0 112.093 -179.719 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 7.7 ttp180 -78.04 -29.83 49.55 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 113.757 -1.565 . . . . 10.0 109.563 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -78.86 -41.08 30.82 Favored 'General case' 0 N--CA 1.466 0.328 0 O-C-N 124.431 1.082 . . . . 10.0 111.608 -179.783 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.449 HD12 ' O ' ' A' ' 28' ' ' ALA . 1.2 mp -74.72 -30.47 24.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 CA-C-N 113.698 -1.592 . . . . 10.0 109.449 -179.788 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -76.8 -52.23 9.91 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 115.691 1.737 . . . . 10.0 115.691 179.792 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 16.8 p30 -45.65 -23.96 0.3 Allowed 'General case' 0 C--O 1.217 -0.628 0 N-CA-C 115.409 1.633 . . . . 10.0 115.409 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.0 mt -73.56 -46.95 44.37 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-O 124.198 1.951 . . . . 10.0 111.1 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.6 pp -97.51 -178.91 4.29 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 113.783 -1.553 . . . . 10.0 109.815 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 18.8 mttt -142.43 138.53 16.52 Favored Pre-proline 0 N--CA 1.468 0.438 0 N-CA-C 104.293 -2.484 . . . . 10.0 104.293 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -68.83 108.83 1.98 Allowed 'Trans proline' 0 N--CA 1.45 -1.055 0 C-N-CA 124.782 3.655 . . . . 10.0 119.018 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -88.26 136.32 33.03 Favored 'General case' 0 C--O 1.219 -0.521 0 N-CA-C 105.38 -2.082 . . . . 10.0 105.38 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.9 mttm -119.06 138.81 52.61 Favored 'General case' 0 C--O 1.211 -0.922 0 CA-C-O 123.417 1.579 . . . . 10.0 112.29 179.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -134.61 128.36 33.03 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 103.544 -2.761 . . . . 10.0 103.544 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 17.5 mt -118.01 136.84 53.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 O-C-N 125.843 1.964 . . . . 10.0 110.992 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 48.7 t -128.79 103.84 10.28 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.38 0 N-CA-C 105.162 -2.162 . . . . 10.0 105.162 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.26 142.84 27.92 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-O 123.374 1.559 . . . . 10.0 111.804 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -132.45 167.45 19.93 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 102.725 -3.065 . . . . 10.0 102.725 -179.699 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -67.9 118.43 9.65 Favored Glycine 0 C--O 1.246 0.862 0 CA-C-O 117.685 -1.619 . . . . 10.0 109.443 179.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 62.74 18.75 10.91 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 119.198 1.499 . . . . 10.0 112.695 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -156.76 119.98 4.15 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 105.837 -1.912 . . . . 10.0 105.837 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.62 ' CE ' HD11 ' A' ' 93' ' ' LEU . 5.6 ttp -118.88 159.61 23.45 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 114.794 -1.094 . . . . 10.0 112.226 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.63 ' C ' HD13 ' A' ' 51' ' ' ILE . 35.0 mt -145.41 135.45 18.59 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 N-CA-C 108.095 -1.076 . . . . 10.0 108.095 179.746 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.63 HD13 ' C ' ' A' ' 50' ' ' ILE . 2.3 mm -117.42 129.17 74.33 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 N-CA-C 105.262 -2.125 . . . . 10.0 105.262 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.9 mtp-105 -121.85 106.26 11.11 Favored 'General case' 0 N--CA 1.437 -1.091 0 O-C-N 124.338 1.024 . . . . 10.0 113.588 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.3 m -80.81 128.78 34.05 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 101.17 -3.641 . . . . 10.0 101.17 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 64.2 mt -132.94 76.46 1.68 Allowed 'General case' 0 N--CA 1.448 -0.549 1 N-CA-C 122.559 4.281 . . . . 10.0 122.559 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -110.18 129.33 55.73 Favored 'General case' 0 C--O 1.242 0.66 0 C-N-CA 124.992 1.317 . . . . 10.0 107.942 -179.737 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 22.9 p -61.41 89.11 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.728 0 O-C-N 125.145 1.528 . . . . 10.0 109.465 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 3.0 t80 174.11 -69.52 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 126.796 2.56 . . . . 10.0 109.71 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 40.2 ttm180 -148.21 105.72 3.67 Favored 'General case' 0 C--N 1.344 0.368 0 O-C-N 125.246 1.591 . . . . 10.0 114.758 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.66 HD22 ' N ' ' A' ' 59' ' ' ASN . 0.7 OUTLIER -91.04 123.86 34.83 Favored 'General case' 0 C--N 1.319 -0.722 0 O-C-N 125.182 1.551 . . . . 10.0 112.668 -179.746 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.407 ' CD1' ' O ' ' A' ' 60' ' ' TYR . 0.1 OUTLIER -118.09 120.68 38.49 Favored 'General case' 0 C--O 1.211 -0.931 0 N-CA-C 104.041 -2.577 . . . . 10.0 104.041 179.697 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.0 mm -108.56 156.61 9.08 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.476 0 O-C-N 119.049 -2.282 . . . . 10.0 111.895 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.49 ' O ' HG23 ' A' ' 50' ' ' ILE . 0.7 OUTLIER -136.18 -169.07 2.35 Favored 'General case' 0 C--O 1.219 -0.551 0 CA-C-N 112.86 -1.973 . . . . 10.0 107.819 -179.938 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 12.3 t0 -170.62 77.42 0.08 Allowed 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 101.598 -3.482 . . . . 10.0 101.598 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.499 ' CD1' ' CD2' ' A' ' 70' ' ' PHE . 66.4 m-85 -62.96 175.13 0.91 Allowed 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 114.722 1.379 . . . . 10.0 114.722 -179.891 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -134.75 94.05 3.12 Favored 'General case' 0 C--O 1.217 -0.65 0 N-CA-C 104.451 -2.425 . . . . 10.0 104.451 179.517 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 5.3 t -59.99 120.12 5.29 Favored 'Isoleucine or valine' 0 C--O 1.245 0.862 0 O-C-N 124.268 0.98 . . . . 10.0 112.961 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 105.66 23.35 7.56 Favored Glycine 0 CA--C 1.532 1.149 0 CA-C-N 114.903 -1.044 . . . . 10.0 114.957 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -172.43 143.5 1.4 Allowed 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 116.795 -1.574 . . . . 10.0 114.701 179.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.3 118.31 3.72 Favored 'General case' 0 C--N 1.319 -0.747 0 O-C-N 125.333 1.646 . . . . 10.0 108.61 179.757 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.499 ' CD2' ' CD1' ' A' ' 64' ' ' PHE . 81.8 t80 -91.83 -34.29 14.61 Favored 'General case' 0 C--O 1.239 0.525 0 CA-C-N 113.122 -1.854 . . . . 10.0 112.824 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 72.6 161.76 0.25 Allowed 'General case' 0 C--O 1.217 -0.649 0 N-CA-C 105.513 -2.032 . . . . 10.0 105.513 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.492 ' OE1' HD23 ' A' ' 74' ' ' LEU . 32.8 mt-10 -136.85 -46.92 0.59 Allowed 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 114.779 1.4 . . . . 10.0 114.779 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 56.52 28.03 13.19 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 108.405 -0.961 . . . . 10.0 108.405 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.498 HD13 ' H ' ' A' ' 75' ' ' THR . 0.2 OUTLIER -39.57 143.25 0.23 Allowed 'General case' 0 C--N 1.313 -1.009 0 N-CA-C 116.917 2.191 . . . . 10.0 116.917 -179.95 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.498 ' H ' HD13 ' A' ' 74' ' ' LEU . 0.2 OUTLIER -165.84 107.62 0.75 Allowed 'General case' 0 C--O 1.241 0.626 0 N-CA-C 107.314 -1.365 . . . . 10.0 107.314 179.755 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 162.26 -54.88 0.3 Allowed Glycine 0 N--CA 1.438 -1.177 0 N-CA-C 108.988 -1.645 . . . . 10.0 108.988 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.641 HG22 HD21 ' A' ' 29' ' ' LEU . 1.2 pt -121.77 142.94 36.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 N-CA-C 103.441 -2.8 . . . . 10.0 103.441 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.431 ' HA ' HG23 ' A' ' 25' ' ' VAL . 23.5 t0 64.7 -68.5 0.1 Allowed 'General case' 0 N--CA 1.443 -0.804 0 O-C-N 125.712 1.883 . . . . 10.0 113.918 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 81.83 70.52 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.572 0 O-C-N 126.309 2.255 . . . . 10.0 111.46 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 6.3 mtm180 -121.68 -171.96 2.33 Favored 'General case' 0 C--O 1.236 0.358 0 O-C-N 120.506 -1.371 . . . . 10.0 112.733 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 5.4 mtpm? -139.27 135.77 34.2 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 103.439 -2.801 . . . . 10.0 103.439 -179.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 27.5 p -172.22 159.08 4.7 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-O 123.014 1.388 . . . . 10.0 108.993 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -107.05 108.45 19.94 Favored 'General case' 0 N--CA 1.441 -0.923 1 N-CA-C 98.381 -4.674 . . . . 10.0 98.381 -179.726 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 17.7 m -105.04 112.79 26.05 Favored 'General case' 0 N--CA 1.445 -0.693 0 O-C-N 126.805 2.566 . . . . 10.0 116.641 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 25.5 m -106.72 115.66 30.57 Favored 'General case' 0 N--CA 1.439 -0.979 0 O-C-N 125.892 1.995 . . . . 10.0 109.284 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 58.1 t -86.76 143.21 11.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 104.625 -2.361 . . . . 10.0 104.625 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 39.1 t -163.73 133.17 4.01 Favored 'General case' 0 C--O 1.243 0.759 0 CA-C-N 113.986 -1.461 . . . . 10.0 111.712 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -82.61 126.22 32.07 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 119.573 -0.851 . . . . 10.0 110.08 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -75.28 -37.95 60.65 Favored 'General case' 0 C--N 1.313 -1.002 1 N-CA-C 98.803 -4.518 . . . . 10.0 98.803 179.868 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 163.04 -73.75 0.19 Allowed Glycine 0 C--N 1.333 0.4 0 N-CA-C 106.015 -2.834 . . . . 10.0 106.015 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -106.57 8.45 31.29 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.092 -0.643 . . . . 10.0 109.669 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.5 121.04 21.59 Favored 'General case' 0 N--CA 1.442 -0.846 0 N-CA-C 109.195 -0.669 . . . . 10.0 109.195 -179.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.62 HD11 ' CE ' ' A' ' 49' ' ' MET . 0.3 OUTLIER -84.24 83.32 8.01 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 104.931 -2.248 . . . . 10.0 104.931 -179.998 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -86.05 139.45 31.14 Favored 'General case' 0 C--O 1.212 -0.881 0 CA-C-N 113.051 -1.886 . . . . 10.0 113.663 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -130.86 146.05 52.17 Favored 'General case' 0 C--O 1.241 0.631 0 CA-C-N 113.521 -1.672 . . . . 10.0 109.616 -179.753 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 9.1 p -121.16 142.41 37.43 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 N-CA-C 104.765 -2.309 . . . . 10.0 104.765 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -148.82 94.43 2.26 Favored 'General case' 0 C--N 1.321 -0.656 0 O-C-N 125.106 1.504 . . . . 10.0 109.557 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.87 119.88 8.54 Favored 'General case' 0 C--O 1.213 -0.833 0 O-C-N 121.055 -1.028 . . . . 10.0 112.448 -179.697 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -134.77 -160.37 9.08 Favored Glycine 0 C--N 1.312 -0.782 0 CA-C-O 117.808 -1.551 . . . . 10.0 110.62 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -90.33 4.48 50.67 Favored 'General case' 0 C--N 1.316 -0.873 0 O-C-N 126.7 2.059 . . . . 10.0 115.723 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 11.1 mmtt -107.86 -176.27 3.01 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 115.342 1.608 . . . . 10.0 115.342 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -67.31 -60.89 2.21 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 125.546 1.779 . . . . 10.0 108.659 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -141.91 127.28 3.22 Favored Glycine 0 C--N 1.338 0.681 0 N-CA-C 117.639 1.815 . . . . 10.0 117.639 179.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -144.45 127.92 16.96 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-O 117.734 -1.127 . . . . 10.0 109.343 -179.655 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 176.49 160.68 24.11 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 109.21 -1.556 . . . . 10.0 109.21 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 38.6 m0 -116.48 105.29 12.32 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 123.321 0.648 . . . . 10.0 109.726 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.4 m -98.69 77.03 2.24 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 107.518 -1.29 . . . . 10.0 107.518 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.435 ' HG3' HD13 ' A' ' 117' ' ' LEU . 14.5 mp0 -72.02 111.69 7.47 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 122.743 1.259 . . . . 10.0 108.468 -179.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 4.4 t90 -113.53 109.31 18.44 Favored 'General case' 0 C--O 1.214 -0.804 0 O-C-N 120.557 -1.34 . . . . 10.0 110.934 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.434 HD12 ' CE1' ' A' ' 4' ' ' PHE . 10.3 mt -76.58 148.09 7.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 116.568 2.062 . . . . 10.0 116.568 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -130.84 58.66 1.69 Allowed 'General case' 0 C--O 1.219 -0.523 0 N-CA-C 105.429 -2.063 . . . . 10.0 105.429 -179.833 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 65.66 -94.24 0.19 Allowed Glycine 0 C--O 1.22 -0.777 0 N-CA-C 109.785 -1.326 . . . . 10.0 109.785 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -89.6 29.1 1.18 Allowed 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 122.838 1.304 . . . . 10.0 111.787 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -152.63 163.9 38.72 Favored 'General case' 0 CA--C 1.503 -0.827 0 O-C-N 120.736 -1.228 . . . . 10.0 114.082 179.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.577 HD12 ' CE2' ' A' ' 8' ' ' TRP . 2.4 tt -134.37 108.74 8.35 Favored 'General case' 0 N--CA 1.437 -1.12 0 O-C-N 126.201 2.188 . . . . 10.0 106.375 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -103.83 99.64 9.42 Favored 'General case' 0 C--O 1.212 -0.909 0 N-CA-C 105.53 -2.026 . . . . 10.0 105.53 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.435 HD13 ' HG3' ' A' ' 108' ' ' GLN . 17.2 tp -99.7 123.75 44.28 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 115.413 1.634 . . . . 10.0 115.413 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -99.66 73.7 1.82 Allowed 'General case' 0 N--CA 1.446 -0.665 0 O-C-N 123.479 0.487 . . . . 10.0 110.424 179.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 13.9 ttp -57.03 140.7 48.27 Favored 'General case' 0 N--CA 1.449 -0.516 0 O-C-N 124.4 1.063 . . . . 10.0 108.143 -179.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -125.64 156.04 39.85 Favored 'General case' 0 C--N 1.322 -0.621 0 O-C-N 125.928 2.018 . . . . 10.0 109.884 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 178.9 117.85 0.04 OUTLIER 'General case' 0 C--O 1.216 -0.662 0 O-C-N 126.545 2.403 . . . . 10.0 109.241 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 50.85 34.64 10.64 Favored 'General case' 0 N--CA 1.445 -0.72 0 O-C-N 125.447 1.717 . . . . 10.0 113.007 -179.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 85.02 -3.41 87.27 Favored Glycine 0 C--N 1.339 0.707 0 CA-C-O 122.385 0.992 . . . . 10.0 113.348 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 24.7 t -95.12 111.16 25.2 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 N-CA-C 107.632 -1.247 . . . . 10.0 107.632 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 4.1 m -101.1 106.25 17.5 Favored 'General case' 0 N--CA 1.442 -0.859 0 C-N-CA 125.468 1.507 . . . . 10.0 112.004 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -105.5 147.33 28.45 Favored 'General case' 0 C--O 1.214 -0.769 0 N-CA-C 105.047 -2.205 . . . . 10.0 105.047 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 7.8 mtpt -114.55 149.5 36.39 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 123.317 0.647 . . . . 10.0 110.739 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . 0.416 ' NE2' ' CZ ' ' A' ' 130' ' ' PHE . 0.1 OUTLIER -138.52 115.8 11.11 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 118.047 -0.978 . . . . 10.0 109.553 179.942 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 21.3 t -97.26 106.24 18.25 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.28 0 O-C-N 126.659 2.475 . . . . 10.0 110.885 -179.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . 0.467 ' HA ' ' HA ' ' A' ' 10' ' ' MET . 96.3 m-85 -92.75 172.65 8.21 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 106.58 -1.637 . . . . 10.0 106.58 179.827 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 46.5 tptt -140.88 122.13 14.83 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 107.014 -1.476 . . . . 10.0 107.014 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 18.4 ttpt -68.04 138.84 56.14 Favored 'General case' 0 C--O 1.218 -0.572 0 CA-C-N 120.169 1.35 . . . . 10.0 107.951 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -154.03 54.41 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.241 0.646 0 O-C-N 126.069 2.106 . . . . 10.0 111.139 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.441 -0.884 0 CA-C-O 116.392 -1.766 . . . . 10.0 111.925 -179.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_exo . . . . . 0 N--CA 1.481 0.781 0 N-CA-C 109.684 -0.929 . . . . 10.0 109.684 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.416 ' O ' HG13 ' A' ' 2' ' ' VAL . 8.8 p -110.44 61.26 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 CA-C-O 124.07 1.891 . . . . 10.0 111.348 -179.645 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -112.49 130.3 56.04 Favored 'General case' 0 CA--C 1.521 -0.135 0 O-C-N 119.967 -1.708 . . . . 10.0 109.664 179.795 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.406 ' HB3' ' HB ' ' A' ' 42' ' ' ILE . 99.0 m-85 -91.73 -17.39 25.5 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 117.447 2.388 . . . . 10.0 117.447 179.863 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 8.8 m120 -54.19 113.82 1.39 Allowed 'General case' 0 N--CA 1.477 0.89 0 CA-C-O 122.985 1.374 . . . . 10.0 112.858 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -177.61 -110.84 0.28 Allowed Glycine 0 C--N 1.347 1.163 0 N-CA-C 117.704 1.841 . . . . 10.0 117.704 179.75 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.574 ' O ' HG23 ' A' ' 133' ' ' VAL . 0.2 OUTLIER 173.09 93.99 0.01 OUTLIER 'General case' 0 C--O 1.241 0.621 0 N-CA-C 102.767 -3.049 . . . . 10.0 102.767 -179.846 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 10.0 m95 -94.38 105.48 17.45 Favored 'General case' 0 C--O 1.215 -0.724 0 CA-C-N 114.282 -1.326 . . . . 10.0 112.382 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.99 -163.5 0.04 OUTLIER 'General case' 0 C--O 1.239 0.53 0 C-N-CA 118.923 -1.111 . . . . 10.0 109.401 179.789 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -128.7 134.7 48.56 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.406 0.622 . . . . 10.0 112.628 179.813 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -99.73 -63.09 1.16 Allowed 'General case' 0 C--O 1.236 0.352 0 N-CA-C 108.853 -0.795 . . . . 10.0 108.853 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -132.52 173.77 10.97 Favored 'General case' 0 CA--C 1.511 -0.532 0 O-C-N 126.771 2.544 . . . . 10.0 114.59 -179.533 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 23.8 p-10 -150.11 172.48 15.21 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 113.906 -1.497 . . . . 10.0 107.641 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -157.6 132.68 8.79 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 114.673 1.36 . . . . 10.0 114.673 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 52.32 42.95 31.19 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 122.691 1.234 . . . . 10.0 112.425 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -69.36 -44.41 71.62 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 115.004 1.483 . . . . 10.0 115.004 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -71.9 -34.18 68.92 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-O 122.69 1.233 . . . . 10.0 113.758 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 -77.44 -20.35 54.66 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 117.651 -1.166 . . . . 10.0 109.371 179.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.751 ' CE1' HD11 ' A' ' 23' ' ' LEU . 0.1 OUTLIER -76.19 -42.81 45.09 Favored 'General case' 0 CA--C 1.552 1.032 0 O-C-N 126.976 2.673 . . . . 10.0 108.537 179.968 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.634 HD12 ' HA ' ' A' ' 30' ' ' ARG . 3.0 mt -72.03 -21.41 61.54 Favored 'General case' 0 C--O 1.211 -0.947 0 O-C-N 120.764 -1.21 . . . . 10.0 113.211 -179.826 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.6 ttm180 -78.52 -25.37 45.54 Favored 'General case' 0 C--O 1.243 0.737 0 N-CA-C 106.252 -1.759 . . . . 10.0 106.252 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.437 ' HB3' ' O ' ' A' ' 19' ' ' TYR . . . -63.81 -47.23 81.7 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.86 1.059 . . . . 10.0 113.86 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.751 HD11 ' CE1' ' A' ' 19' ' ' TYR . 0.4 OUTLIER -87.36 -6.4 58.49 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 119.25 0.932 . . . . 10.0 110.355 -179.705 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 71.48 19.04 5.3 Favored 'General case' 0 C--O 1.224 -0.273 0 O-C-N 123.815 0.697 . . . . 10.0 111.734 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.448 HG23 ' H ' ' A' ' 78' ' ' ASP . 10.0 p -59.04 163.54 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.219 0 N-CA-C 105.621 -1.992 . . . . 10.0 105.621 -179.833 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -41.81 148.31 0.17 Allowed 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 115.38 1.622 . . . . 10.0 115.38 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 2.9 p -73.32 -23.24 19.66 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.66 0 O-C-N 119.441 -2.037 . . . . 10.0 114.021 -179.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -73.98 -23.75 59.51 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 109.554 -0.535 . . . . 10.0 109.554 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -71.04 -45.49 63.77 Favored 'General case' 0 C--O 1.218 -0.566 0 O-C-N 126.317 2.261 . . . . 10.0 112.694 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.634 ' HA ' HD12 ' A' ' 20' ' ' LEU . 0.0 OUTLIER -68.15 -30.99 70.25 Favored 'General case' 0 CA--C 1.512 -0.499 0 O-C-N 125.107 1.504 . . . . 10.0 111.47 179.986 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.19 -44.72 59.37 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 108.647 -0.871 . . . . 10.0 108.647 -179.623 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 5.4 mt -76.21 -30.54 20.24 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 N-CA-C 108.109 -1.071 . . . . 10.0 108.109 -179.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -49.94 -61.57 2.06 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 127.977 3.298 . . . . 10.0 110.403 179.505 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.661 ' O ' HD12 ' A' ' 35' ' ' LEU . 14.5 t-20 -52.86 154.93 2.57 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 116.134 -1.888 . . . . 10.0 108.632 179.497 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.661 HD12 ' O ' ' A' ' 34' ' ' ASN . 0.4 OUTLIER 77.3 -39.21 0.31 Allowed 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 120.16 1.345 . . . . 10.0 113.167 -179.248 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -100.48 139.68 35.82 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 120.068 1.304 . . . . 10.0 110.948 179.693 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 14.9 mttt -127.13 111.82 21.62 Favored Pre-proline 0 CA--C 1.535 0.404 0 CA-C-O 123.151 1.453 . . . . 10.0 107.677 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -60.04 105.88 0.31 Allowed 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 123.307 2.671 . . . . 10.0 115.954 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.58 -177.98 1.67 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 118.31 0.504 . . . . 10.0 109.687 179.847 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.0 tptt -140.44 153.0 46.12 Favored 'General case' 0 C--N 1.314 -0.966 0 O-C-N 121.043 -1.036 . . . . 10.0 109.526 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.415 ' HB2' HD12 ' A' ' 54' ' ' LEU . 17.0 tt0 -154.6 69.68 0.76 Allowed 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 104.143 -2.54 . . . . 10.0 104.143 -179.894 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.453 HG22 ' N ' ' A' ' 43' ' ' VAL . 25.4 mm -56.99 152.21 2.7 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.01 0 O-C-N 121.791 -0.568 . . . . 10.0 112.181 -179.727 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.453 ' N ' HG22 ' A' ' 42' ' ' ILE . 0.0 OUTLIER -146.49 95.29 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 N-CA-C 104.461 -2.422 . . . . 10.0 104.461 179.969 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 55.8 tt0 -122.78 118.76 28.76 Favored 'General case' 0 C--O 1.218 -0.597 0 O-C-N 119.846 -1.784 . . . . 10.0 108.634 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -69.02 -85.89 0.02 OUTLIER 'General case' 0 C--O 1.236 0.387 0 N-CA-C 105.638 -1.986 . . . . 10.0 105.638 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -160.45 -54.79 0.01 OUTLIER Glycine 0 N--CA 1.461 0.348 0 N-CA-C 106.192 -2.763 . . . . 10.0 106.192 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.9 m-20 -100.78 4.4 42.92 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 108.643 -0.873 . . . . 10.0 108.643 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 34.6 m170 -142.07 174.2 10.82 Favored 'General case' 0 N--CA 1.438 -1.049 0 CA-C-O 117.82 -1.086 . . . . 10.0 110.246 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 14.0 ttp -149.22 165.07 32.98 Favored 'General case' 0 N--CA 1.441 -0.91 0 C-N-CA 118.699 -1.201 . . . . 10.0 111.806 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.437 ' C ' HD12 ' A' ' 51' ' ' ILE . 6.8 mm -149.25 123.5 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 103.563 -2.754 . . . . 10.0 103.563 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.437 HD12 ' C ' ' A' ' 50' ' ' ILE . 1.6 mp -110.51 133.23 56.6 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 N-CA-C 107.833 -1.173 . . . . 10.0 107.833 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.478 HH21 HD21 ' A' ' 54' ' ' LEU . 63.6 mtp180 -127.36 146.87 50.31 Favored 'General case' 0 C--O 1.214 -0.763 0 N-CA-C 109.021 -0.733 . . . . 10.0 109.021 179.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 18.4 m -128.22 108.21 10.42 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 102.402 -3.184 . . . . 10.0 102.402 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.478 HD21 HH21 ' A' ' 52' ' ' ARG . 11.0 mt -105.26 99.24 8.86 Favored 'General case' 0 C--N 1.32 -0.707 1 N-CA-C 122.095 4.109 . . . . 10.0 122.095 -179.775 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.5 m -129.94 173.29 10.83 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 104.879 -2.267 . . . . 10.0 104.879 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 32.5 p -101.49 31.5 3.73 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 107.211 -1.403 . . . . 10.0 107.211 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -124.5 -43.85 2.01 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-O 118.277 -0.868 . . . . 10.0 110.123 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -176.3 137.38 0.29 Allowed 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 118.006 -0.997 . . . . 10.0 112.389 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.412 ' N ' ' ND2' ' A' ' 59' ' ' ASN . 0.9 OUTLIER -101.55 171.07 7.79 Favored 'General case' 0 C--O 1.241 0.621 0 O-C-N 125.012 1.445 . . . . 10.0 113.81 179.833 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -130.32 117.25 19.49 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 104.533 -2.395 . . . . 10.0 104.533 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 26.0 mm -122.8 112.86 35.78 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 N-CA-C 115.024 1.49 . . . . 10.0 115.024 179.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 3.2 mmt -130.67 178.25 6.78 Favored 'General case' 0 C--O 1.212 -0.876 0 CA-C-O 123.507 1.622 . . . . 10.0 108.372 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -151.59 107.53 3.4 Favored 'General case' 0 N--CA 1.437 -1.102 0 N-CA-C 101.929 -3.36 . . . . 10.0 101.929 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -107.73 174.31 5.94 Favored 'General case' 0 C--O 1.247 0.964 0 N-CA-C 116.854 2.168 . . . . 10.0 116.854 -179.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 5.7 mm100 -126.06 115.27 19.58 Favored 'General case' 0 N--CA 1.444 -0.743 0 N-CA-C 104.934 -2.247 . . . . 10.0 104.934 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 3.4 t -71.12 95.25 0.49 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.728 0 N-CA-C 109.218 -0.66 . . . . 10.0 109.218 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 112.29 55.74 0.46 Allowed Glycine 0 CA--C 1.532 1.131 0 C-N-CA 124.705 1.145 . . . . 10.0 115.46 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -174.06 121.9 0.3 Allowed 'General case' 0 C--O 1.236 0.388 0 C-N-CA 123.386 0.674 . . . . 10.0 112.562 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -56.08 135.81 52.65 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 124.521 1.128 . . . . 10.0 112.708 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -120.5 -174.66 2.85 Favored 'General case' 0 N--CA 1.437 -1.085 0 C-N-CA 124.165 0.986 . . . . 10.0 110.74 -179.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -148.9 66.72 1.04 Allowed 'General case' 0 C--N 1.312 -1.039 0 N-CA-C 108.149 -1.056 . . . . 10.0 108.149 179.639 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -51.4 118.39 3.26 Favored 'General case' 0 CA--C 1.509 -0.624 0 O-C-N 124.682 1.239 . . . . 10.0 111.529 179.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -71.54 -36.91 71.14 Favored 'General case' 0 C--N 1.318 -0.768 0 O-C-N 125.539 1.774 . . . . 10.0 110.544 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 19.4 mt 41.76 71.71 0.2 Allowed 'General case' 0 N--CA 1.441 -0.88 0 C-N-CA 124.813 1.245 . . . . 10.0 114.268 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -113.79 116.75 29.85 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 106.722 -1.584 . . . . 10.0 106.722 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 140.35 -67.84 0.49 Allowed Glycine 0 N--CA 1.444 -0.825 0 CA-C-O 118.778 -1.012 . . . . 10.0 111.361 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -111.14 147.15 15.35 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 N-CA-C 105.539 -2.022 . . . . 10.0 105.539 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.448 ' H ' HG23 ' A' ' 25' ' ' VAL . 77.7 m-20 55.28 16.5 1.71 Allowed 'General case' 0 N--CA 1.443 -0.8 0 CA-C-O 116.019 -1.943 . . . . 10.0 113.414 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -2.35 68.41 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 118.062 2.615 . . . . 10.0 118.062 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.64 -163.43 1.37 Allowed 'General case' 0 N--CA 1.452 -0.337 0 O-C-N 119.936 -1.727 . . . . 10.0 111.868 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 2.1 tptp -153.18 147.64 25.98 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 102.998 -2.964 . . . . 10.0 102.998 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 5.7 p -158.84 140.6 13.55 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 122.395 1.093 . . . . 10.0 110.562 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.1 ttt -93.77 67.6 3.84 Favored 'General case' 0 N--CA 1.441 -0.895 0 N-CA-C 102.797 -3.038 . . . . 10.0 102.797 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.552 HG23 ' N ' ' A' ' 85' ' ' THR . 0.6 OUTLIER -50.89 166.21 0.09 Allowed 'General case' 0 N--CA 1.434 -1.263 0 CA-C-N 112.958 -1.928 . . . . 10.0 115.479 179.921 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.552 ' N ' HG23 ' A' ' 84' ' ' THR . 0.2 OUTLIER -164.27 106.05 0.89 Allowed 'General case' 0 N--CA 1.442 -0.842 0 N-CA-C 108.217 -1.031 . . . . 10.0 108.217 179.608 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.459 ' CG1' HD11 ' A' ' 93' ' ' LEU . 32.6 t -108.15 118.05 54.99 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.974 0 N-CA-C 103.237 -2.875 . . . . 10.0 103.237 -179.903 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -124.65 149.44 47.13 Favored 'General case' 0 C--N 1.315 -0.895 0 O-C-N 124.786 1.304 . . . . 10.0 114.483 -179.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 4.0 t90 -85.4 127.88 34.53 Favored 'General case' 0 C--N 1.329 -0.319 0 O-C-N 121.567 -0.708 . . . . 10.0 110.055 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -92.24 -55.33 3.47 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 101.434 -3.543 . . . . 10.0 101.434 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 146.59 -76.87 0.26 Allowed Glycine 0 C--O 1.245 0.787 0 N-CA-C 107.691 -2.164 . . . . 10.0 107.691 179.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.0 -24.12 67.59 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 114.837 -0.681 . . . . 10.0 111.078 -179.768 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.33 168.08 23.51 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-O 122.249 1.023 . . . . 10.0 110.129 179.831 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.68 HD13 ' N ' ' A' ' 94' ' ' GLN . 1.5 tm? -108.81 136.9 47.6 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 104.298 -2.482 . . . . 10.0 104.298 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . 0.68 ' N ' HD13 ' A' ' 93' ' ' LEU . 1.0 OUTLIER -138.33 145.25 40.95 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 118.772 0.715 . . . . 10.0 110.199 -179.911 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 6.7 m -123.03 159.98 27.27 Favored 'General case' 0 CA--C 1.505 -0.784 0 O-C-N 126.163 2.165 . . . . 10.0 114.129 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -159.02 128.75 0.75 Allowed 'Isoleucine or valine' 0 C--O 1.246 0.903 0 N-CA-C 105.134 -2.173 . . . . 10.0 105.134 -179.662 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.6 140.05 48.06 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 122.673 1.225 . . . . 10.0 110.998 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -86.92 179.69 6.67 Favored 'General case' 0 C--N 1.343 0.297 0 N-CA-C 115.013 1.486 . . . . 10.0 115.013 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 142.37 -157.01 26.44 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.972 -0.632 . . . . 10.0 112.281 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -89.03 -17.04 30.19 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 118.387 2.736 . . . . 10.0 118.387 179.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 17.3 mmtt -81.96 179.55 7.78 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 115.203 1.557 . . . . 10.0 115.203 -179.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -108.71 14.87 24.1 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 126.764 2.026 . . . . 10.0 113.004 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -148.24 -88.24 0.07 OUTLIER Glycine 0 C--N 1.342 0.914 0 CA-C-N 113.547 -1.661 . . . . 10.0 114.549 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 6.2 mtp180 31.71 92.17 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.808 0 O-C-N 126.912 2.183 . . . . 10.0 114.889 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 169.97 149.88 6.57 Favored Glycine 0 N--CA 1.441 -0.97 0 N-CA-C 110.085 -1.206 . . . . 10.0 110.085 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -112.26 168.08 9.91 Favored 'General case' 0 C--N 1.32 -0.679 0 O-C-N 120.64 -1.506 . . . . 10.0 109.257 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.7 m -151.01 120.06 6.7 Favored 'General case' 0 C--O 1.215 -0.72 0 N-CA-C 107.703 -1.221 . . . . 10.0 107.703 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -117.38 102.0 8.87 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 124.426 2.06 . . . . 10.0 114.738 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' TRP . . . . . 0.489 ' CD1' ' C ' ' A' ' 109' ' ' TRP . 0.0 OUTLIER -111.99 133.48 54.14 Favored 'General case' 0 C--O 1.217 -0.645 0 O-C-N 119.6 -1.938 . . . . 10.0 107.333 179.956 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 33.1 mt -98.93 142.13 15.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 O-C-N 126.603 2.439 . . . . 10.0 114.4 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -130.57 97.29 4.34 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 104.619 -2.363 . . . . 10.0 104.619 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 55.61 -118.13 10.04 Favored Glycine 0 C--O 1.221 -0.714 0 N-CA-C 109.721 -1.351 . . . . 10.0 109.721 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -92.4 12.72 21.76 Favored 'General case' 0 C--N 1.327 -0.392 0 O-C-N 126.06 1.682 . . . . 10.0 111.277 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -109.74 -179.18 3.74 Favored 'General case' 0 CA--C 1.513 -0.448 0 CA-C-O 117.701 -1.142 . . . . 10.0 111.234 179.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.707 HD23 ' CG ' ' A' ' 130' ' ' PHE . 2.3 tp -157.0 117.97 3.66 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 127.128 2.171 . . . . 10.0 106.725 179.749 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -104.47 121.21 42.96 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 106.367 -1.716 . . . . 10.0 106.367 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 10.8 tp -106.16 132.48 52.18 Favored 'General case' 0 C--N 1.315 -0.895 0 O-C-N 123.285 0.366 . . . . 10.0 111.101 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -119.25 100.53 7.38 Favored 'General case' 0 C--N 1.315 -0.893 0 O-C-N 125.149 1.531 . . . . 10.0 107.694 -179.664 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.537 ' HE1' ' CZ ' ' A' ' 19' ' ' TYR . 1.3 tmm? -109.55 136.67 48.55 Favored 'General case' 0 N--CA 1.444 -0.767 0 O-C-N 124.767 1.292 . . . . 10.0 109.372 -179.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -124.03 147.76 47.58 Favored 'General case' 0 C--N 1.315 -0.922 0 O-C-N 125.947 2.03 . . . . 10.0 113.172 179.756 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -156.17 131.49 9.41 Favored 'General case' 0 CA--C 1.501 -0.916 0 O-C-N 124.473 1.108 . . . . 10.0 109.314 179.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 47.42 29.5 1.35 Allowed 'General case' 0 C--N 1.319 -0.754 0 O-C-N 125.176 1.548 . . . . 10.0 114.409 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 93.6 -0.84 68.24 Favored Glycine 0 CA--C 1.528 0.881 0 N-CA-C 116.333 1.293 . . . . 10.0 116.333 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 21.2 t -107.21 158.9 7.0 Favored 'Isoleucine or valine' 0 C--O 1.242 0.676 0 N-CA-C 106.699 -1.593 . . . . 10.0 106.699 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -138.86 130.3 27.21 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 118.72 0.691 . . . . 10.0 111.94 -179.744 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 1.1 t -98.18 148.56 23.46 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 104.837 -2.282 . . . . 10.0 104.837 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 20.1 mtpt -126.83 111.48 14.24 Favored 'General case' 0 C--O 1.218 -0.605 0 O-C-N 125.491 1.744 . . . . 10.0 108.988 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -114.53 113.59 24.63 Favored 'General case' 0 N--CA 1.447 -0.622 0 O-C-N 127.287 2.867 . . . . 10.0 114.136 179.821 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 2.3 t -91.56 133.01 34.49 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.768 0 O-C-N 123.905 0.753 . . . . 10.0 109.043 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . 0.707 ' CG ' HD23 ' A' ' 115' ' ' LEU . 9.3 m-85 -121.58 177.62 5.16 Favored 'General case' 0 C--O 1.214 -0.802 0 C-N-CA 126.178 1.791 . . . . 10.0 107.259 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 4.9 ttpt -158.07 138.66 12.84 Favored 'General case' 0 N--CA 1.445 -0.715 0 O-C-N 126.281 2.238 . . . . 10.0 106.376 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 2.2 tttp -74.16 130.11 39.14 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 123.035 1.398 . . . . 10.0 108.692 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . 0.574 HG23 ' O ' ' A' ' 7' ' ' TYR . 2.1 t -96.83 -0.69 10.52 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 CA-C-N 114.846 -1.07 . . . . 10.0 109.219 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.24 0.604 0 O-C-N 126.773 2.545 . . . . 10.0 108.778 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo . . . . . 0 N--CA 1.488 1.176 0 CA-C-O 122.105 0.794 . . . . 10.0 113.359 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -123.67 61.08 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 O-C-N 120.679 -1.263 . . . . 10.0 110.191 179.808 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -94.85 110.02 21.94 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.351 1.46 . . . . 10.0 113.857 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -56.82 -28.7 61.92 Favored 'General case' 0 C--O 1.222 -0.358 0 N-CA-C 117.869 2.544 . . . . 10.0 117.869 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.4 p30 -52.46 153.15 3.14 Favored 'General case' 0 N--CA 1.478 0.962 0 O-C-N 125.75 1.906 . . . . 10.0 113.673 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 148.06 -140.91 8.71 Favored Glycine 0 C--N 1.336 0.533 0 N-CA-C 116.659 1.423 . . . . 10.0 116.659 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -144.17 156.9 44.51 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 103.392 -2.818 . . . . 10.0 103.392 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.751 ' CE2' HD22 ' A' ' 115' ' ' LEU . 3.8 m0 -160.11 72.73 0.5 Allowed 'General case' 0 C--N 1.315 -0.897 0 O-C-N 126.313 2.258 . . . . 10.0 113.202 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.31 113.83 1.73 Allowed 'General case' 0 C--O 1.238 0.458 0 N-CA-C 107.21 -1.404 . . . . 10.0 107.21 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -68.32 146.31 53.4 Favored 'General case' 0 CA--C 1.512 -0.51 0 O-C-N 119.338 -2.101 . . . . 10.0 113.424 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.0 mt -103.98 -46.56 4.44 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.994 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.5 t -155.31 153.82 31.13 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 116.182 1.919 . . . . 10.0 116.182 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -120.37 115.12 22.9 Favored 'General case' 0 C--N 1.318 -0.789 0 O-C-N 127.059 2.725 . . . . 10.0 104.508 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -92.68 139.22 30.78 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 120.243 1.383 . . . . 10.0 112.923 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 8.2 m120 56.09 31.66 18.59 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 113.683 0.994 . . . . 10.0 113.683 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 22.0 t80 -67.5 -32.13 72.74 Favored 'General case' 0 CA--C 1.55 0.967 0 O-C-N 120.778 -1.201 . . . . 10.0 113.733 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.65 -37.43 42.06 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-O 122.729 1.252 . . . . 10.0 110.565 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.33 -20.22 60.18 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-O 123.897 1.808 . . . . 10.0 107.064 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -74.81 -39.26 61.78 Favored 'General case' 0 CA--C 1.553 1.093 0 CA-C-N 114.141 -1.391 . . . . 10.0 111.105 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.591 HD12 ' HG3' ' A' ' 30' ' ' ARG . 4.0 mt -78.02 -21.13 51.22 Favored 'General case' 0 C--O 1.21 -0.987 0 O-C-N 125.152 1.532 . . . . 10.0 109.73 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 26.9 ttp180 -77.27 -24.13 51.11 Favored 'General case' 0 C--O 1.245 0.846 0 CA-C-N 114.015 -1.448 . . . . 10.0 109.101 179.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.22 -51.46 67.68 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 126.224 1.809 . . . . 10.0 113.731 -179.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -110.78 6.98 21.84 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 119.094 0.861 . . . . 10.0 112.001 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 50.57 80.77 0.07 Allowed 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.795 1.035 . . . . 10.0 113.795 179.568 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.449 ' CG1' HD13 ' A' ' 20' ' ' LEU . 8.7 p -99.09 39.69 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.808 0 CA-C-N 115.162 -0.926 . . . . 10.0 110.074 -179.624 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 75.11 143.7 0.08 Allowed 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 117.151 2.278 . . . . 10.0 117.151 -179.48 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 63.3 t -75.4 -33.42 27.57 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 O-C-N 124.893 1.371 . . . . 10.0 114.647 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -71.51 -27.87 63.5 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 122.933 1.349 . . . . 10.0 111.223 179.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.441 HD22 HG22 ' A' ' 25' ' ' VAL . 1.3 tp -79.17 -34.65 42.91 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 123.685 0.794 . . . . 10.0 110.206 179.751 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.591 ' HG3' HD12 ' A' ' 20' ' ' LEU . 42.8 ttp85 -77.37 -30.86 53.97 Favored 'General case' 0 C--O 1.242 0.702 0 O-C-N 120.742 -1.224 . . . . 10.0 111.746 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.66 -39.5 80.64 Favored 'General case' 0 C--N 1.314 -0.947 0 C-N-CA 126.45 1.9 . . . . 10.0 109.38 179.715 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 80.1 mt -79.41 -57.16 5.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 O-C-N 125.284 1.615 . . . . 10.0 112.595 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -50.01 -31.79 13.71 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 115.127 1.528 . . . . 10.0 115.127 -179.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -61.05 -26.76 67.86 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 123.38 1.562 . . . . 10.0 113.377 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.662 ' N ' HD22 ' A' ' 35' ' ' LEU . 0.9 OUTLIER -97.17 -6.3 35.15 Favored 'General case' 0 C--N 1.323 -0.576 0 O-C-N 119.074 -2.266 . . . . 10.0 113.666 179.848 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 47.2 mt -96.64 109.03 21.73 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 124.933 1.395 . . . . 10.0 108.023 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 20.1 mttp -120.01 93.86 48.17 Favored Pre-proline 0 C--O 1.236 0.392 0 O-C-N 119.657 -1.902 . . . . 10.0 106.935 -179.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -69.41 172.1 12.9 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 125.205 3.937 . . . . 10.0 118.211 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -122.0 113.63 19.83 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 104.429 -2.434 . . . . 10.0 104.429 -179.825 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.1 mttm -81.26 138.17 35.77 Favored 'General case' 0 C--N 1.316 -0.883 0 O-C-N 120.752 -1.218 . . . . 10.0 112.431 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -128.32 107.62 9.91 Favored 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 103.783 -2.673 . . . . 10.0 103.783 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.6 mt -95.82 149.34 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 CA-C-O 123.573 1.654 . . . . 10.0 108.968 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -147.41 131.03 9.07 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 CA-C-O 123.92 1.819 . . . . 10.0 106.105 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -116.61 143.95 44.99 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 105.638 -1.986 . . . . 10.0 105.638 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -126.29 -66.65 0.91 Allowed 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 108.31 -0.996 . . . . 10.0 108.31 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -171.54 92.78 0.1 OUTLIER Glycine 0 CA--C 1.522 0.479 0 N-CA-C 107.82 -2.112 . . . . 10.0 107.82 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 60.89 19.29 9.59 Favored 'General case' 0 C--N 1.32 -0.686 0 O-C-N 121.72 -0.871 . . . . 10.0 109.663 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 5.9 m80 -137.88 78.18 1.67 Allowed 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 104.884 -2.265 . . . . 10.0 104.884 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.479 ' HB2' ' CG2' ' A' ' 66' ' ' VAL . 1.0 OUTLIER -78.3 126.27 30.54 Favored 'General case' 0 N--CA 1.441 -0.889 0 CA-C-N 114.114 -1.403 . . . . 10.0 112.133 179.925 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.617 ' C ' HD12 ' A' ' 51' ' ' ILE . 76.3 mt -110.6 139.68 33.14 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.544 0 N-CA-C 107.872 -1.159 . . . . 10.0 107.872 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.617 HD12 ' C ' ' A' ' 50' ' ' ILE . 1.8 mp -132.43 109.56 15.0 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 N-CA-C 105.629 -1.989 . . . . 10.0 105.629 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 36.7 mtt180 -106.15 116.15 31.44 Favored 'General case' 0 C--N 1.315 -0.904 0 O-C-N 126.802 2.564 . . . . 10.0 111.487 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.1 m -105.28 127.59 53.02 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 100.441 -3.911 . . . . 10.0 100.441 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 11.6 mt -117.29 98.28 6.35 Favored 'General case' 0 C--N 1.321 -0.662 1 N-CA-C 121.929 4.048 . . . . 10.0 121.929 179.772 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 82.7 p -108.72 138.75 44.54 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 126.926 2.09 . . . . 10.0 106.342 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -82.36 9.22 9.43 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 116.873 -1.537 . . . . 10.0 111.564 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 29.1 t80 -110.1 -46.62 3.43 Favored 'General case' 0 C--O 1.24 0.599 0 N-CA-C 108.27 -1.011 . . . . 10.0 108.27 -179.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 2.4 tpm_? -163.86 102.62 0.9 Allowed 'General case' 0 C--O 1.241 0.618 0 O-C-N 124.65 1.219 . . . . 10.0 111.93 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -76.05 170.09 16.94 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 120.737 -1.227 . . . . 10.0 111.435 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.459 ' CG ' ' O ' ' A' ' 60' ' ' TYR . 0.1 OUTLIER -151.44 56.19 0.87 Allowed 'General case' 0 C--O 1.214 -0.802 0 CA-C-O 125.088 2.375 . . . . 10.0 107.194 179.902 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.436 HD13 ' N ' ' A' ' 61' ' ' ILE . 2.9 mm -39.79 134.15 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 O-C-N 120.429 -1.42 . . . . 10.0 114.593 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -106.92 -178.06 3.54 Favored 'General case' 0 CA--C 1.513 -0.457 0 O-C-N 125.426 1.704 . . . . 10.0 107.345 -179.668 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -166.76 87.76 0.32 Allowed 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 101.878 -3.378 . . . . 10.0 101.878 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -93.2 164.87 13.08 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 116.249 1.944 . . . . 10.0 116.249 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.64 125.22 33.49 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 102.79 -3.041 . . . . 10.0 102.79 -179.715 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.479 ' CG2' ' HB2' ' A' ' 49' ' ' MET . 5.1 t -80.18 95.51 2.37 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 O-C-N 124.143 0.902 . . . . 10.0 112.803 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 102.8 39.8 2.64 Favored Glycine 0 CA--C 1.52 0.383 0 N-CA-C 114.99 0.756 . . . . 10.0 114.99 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -160.96 144.84 13.41 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 115.256 1.576 . . . . 10.0 115.256 -179.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -91.91 129.2 37.93 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 108.639 -0.874 . . . . 10.0 108.639 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 29.6 p90 -150.05 31.17 0.69 Allowed 'General case' 0 N--CA 1.439 -0.989 0 CA-C-O 116.113 -1.898 . . . . 10.0 113.413 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 12.6 pm0 36.18 84.53 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.773 0 O-C-N 126.243 2.215 . . . . 10.0 110.762 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -23.65 -43.51 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.959 0 O-C-N 126.764 2.54 . . . . 10.0 117.124 -179.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 73.29 89.68 0.09 Allowed 'General case' 0 C--O 1.224 -0.277 0 CA-C-N 113.223 -1.808 . . . . 10.0 109.871 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.558 HD22 ' CD1' ' A' ' 77' ' ' ILE . 8.6 mt -104.41 65.46 0.78 Allowed 'General case' 0 C--N 1.313 -0.988 0 O-C-N 121.145 -0.972 . . . . 10.0 112.798 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 11.0 p -107.99 33.22 4.22 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.447 -0.946 . . . . 10.0 108.447 179.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -116.98 -26.68 2.93 Favored Glycine 0 CA--C 1.509 -0.334 0 CA-C-O 117.617 -1.657 . . . . 10.0 113.277 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.558 ' CD1' HD22 ' A' ' 74' ' ' LEU . 0.1 OUTLIER -132.11 -80.1 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.721 0 CA-C-N 119.202 1.501 . . . . 10.0 110.022 -179.826 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -87.52 36.85 0.76 Allowed 'General case' 0 N--CA 1.444 -0.768 0 CA-C-O 116.697 -1.621 . . . . 10.0 115.02 -179.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 25.0 t0 11.75 74.93 0.01 OUTLIER 'General case' 0 C--O 1.219 -0.501 0 O-C-N 126.283 2.24 . . . . 10.0 116.45 179.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.86 96.09 1.11 Allowed 'General case' 0 CA--C 1.508 -0.653 0 O-C-N 126.667 2.48 . . . . 10.0 114.299 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 11.1 ttpt -67.75 128.6 37.08 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 106.378 -1.712 . . . . 10.0 106.378 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 41.3 m -120.97 171.82 8.37 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 126.856 2.598 . . . . 10.0 108.159 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 18.5 mtt -95.54 107.35 19.52 Favored 'General case' 0 C--N 1.314 -0.977 1 N-CA-C 99.697 -4.186 . . . . 10.0 99.697 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 5.2 m -122.89 144.14 49.42 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 117.665 2.468 . . . . 10.0 117.665 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -136.52 125.61 24.49 Favored 'General case' 0 N--CA 1.441 -0.878 0 N-CA-C 107.661 -1.237 . . . . 10.0 107.661 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -100.1 149.62 5.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 N-CA-C 102.798 -3.038 . . . . 10.0 102.798 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -165.77 156.86 13.71 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 114.306 1.224 . . . . 10.0 114.306 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -97.55 112.32 24.22 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 114.574 -1.194 . . . . 10.0 109.49 -179.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -118.8 85.03 2.29 Favored 'General case' 0 CA--C 1.532 0.288 1 N-CA-C 99.998 -4.075 . . . . 10.0 99.998 -179.774 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 92.93 -133.91 11.93 Favored Glycine 0 CA--C 1.498 -0.977 0 N-CA-C 105.308 -3.117 . . . . 10.0 105.308 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -104.43 35.17 2.81 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 122.841 0.457 . . . . 10.0 110.0 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 7.5 mtpt -128.18 172.33 11.1 Favored 'General case' 0 N--CA 1.463 0.18 0 O-C-N 126.506 2.379 . . . . 10.0 106.817 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -133.65 89.48 2.59 Favored 'General case' 0 C--N 1.323 -0.572 0 O-C-N 126.715 2.509 . . . . 10.0 107.275 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -76.16 154.99 34.97 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 116.465 -0.334 . . . . 10.0 110.828 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 3.3 m -144.27 133.74 23.34 Favored 'General case' 0 C--O 1.218 -0.587 0 O-C-N 126.212 2.195 . . . . 10.0 110.506 179.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -136.83 132.84 48.05 Favored 'Isoleucine or valine' 0 C--O 1.243 0.747 0 CA-C-N 113.42 -1.718 . . . . 10.0 107.395 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -118.54 121.1 39.42 Favored 'General case' 0 C--O 1.24 0.597 0 C-N-CA 124.36 1.064 . . . . 10.0 110.776 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 6.9 mttm -90.7 87.31 6.64 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 119.123 0.874 . . . . 10.0 109.979 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -131.11 75.55 0.42 Allowed Glycine 0 N--CA 1.438 -1.174 0 CA-C-O 116.458 -2.301 . . . . 10.0 114.082 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 28.04 39.74 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 117.549 2.426 . . . . 10.0 117.549 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 5.8 mmtt -131.46 160.01 36.41 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 115.31 1.596 . . . . 10.0 115.31 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -73.75 -37.95 64.88 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 112.676 -2.056 . . . . 10.0 108.829 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -135.78 134.0 6.97 Favored Glycine 0 C--O 1.222 -0.617 0 CA-C-O 117.201 -1.888 . . . . 10.0 113.681 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 173.72 106.07 0.01 OUTLIER 'General case' 0 N--CA 1.439 -0.983 0 O-C-N 124.91 1.006 . . . . 10.0 110.034 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 166.45 160.31 13.49 Favored Glycine 0 C--O 1.215 -1.063 0 N-CA-C 109.313 -1.515 . . . . 10.0 109.313 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 6.2 m0 -123.04 -179.65 4.35 Favored 'General case' 0 N--CA 1.442 -0.841 0 O-C-N 126.496 1.939 . . . . 10.0 109.268 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -164.47 151.55 11.46 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 104.163 -2.532 . . . . 10.0 104.163 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.595 ' NE2' HD13 ' A' ' 117' ' ' LEU . 3.4 tp-100 -140.32 151.98 45.48 Favored 'General case' 0 N--CA 1.444 -0.744 0 O-C-N 125.731 1.894 . . . . 10.0 108.808 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' TRP . . . . . 0.458 ' CD1' ' C ' ' A' ' 109' ' ' TRP . 0.0 OUTLIER -167.34 137.39 2.88 Favored 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 125.156 1.382 . . . . 10.0 107.529 179.977 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 33.6 mt -96.92 114.98 35.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 118.624 2.824 . . . . 10.0 118.624 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -95.97 161.75 13.86 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 102.645 -3.094 . . . . 10.0 102.645 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -57.75 106.25 0.75 Allowed Glycine 0 N--CA 1.443 -0.843 0 CA-C-O 118.571 -1.127 . . . . 10.0 110.835 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 69.34 11.76 8.18 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 126.133 1.725 . . . . 10.0 112.701 -179.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -151.86 120.57 6.53 Favored 'General case' 0 CA--C 1.499 -0.989 0 CA-C-O 124.712 2.196 . . . . 10.0 114.559 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.751 HD22 ' CE2' ' A' ' 8' ' ' TRP . 2.9 tp -78.07 138.06 38.57 Favored 'General case' 0 C--N 1.319 -0.717 0 CA-C-N 113.903 -1.498 . . . . 10.0 107.52 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -117.81 112.01 19.83 Favored 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 106.601 -1.629 . . . . 10.0 106.601 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.595 HD13 ' NE2' ' A' ' 108' ' ' GLN . 6.9 tp -122.65 131.83 53.99 Favored 'General case' 0 C--N 1.315 -0.921 0 C-N-CA 124.952 1.301 . . . . 10.0 107.922 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -135.81 151.93 50.57 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 106.183 -1.784 . . . . 10.0 106.183 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -156.39 160.42 39.63 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.328 -0.851 . . . . 10.0 109.641 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 3.4 mtm180 -138.82 179.55 6.42 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 117.289 -1.338 . . . . 10.0 114.042 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -173.62 132.5 0.45 Allowed 'General case' 0 CA--C 1.499 -1.016 0 O-C-N 125.269 1.606 . . . . 10.0 106.734 179.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 35.56 60.46 0.75 Allowed 'General case' 0 N--CA 1.475 0.821 0 O-C-N 126.669 2.481 . . . . 10.0 116.661 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 64.52 10.33 42.63 Favored Glycine 0 N--CA 1.444 -0.813 0 C-N-CA 123.877 0.751 . . . . 10.0 113.091 179.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 14.9 t -107.81 151.42 9.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 CA-C-N 118.958 1.379 . . . . 10.0 108.203 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 3.1 m -121.85 140.01 52.92 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 122.648 1.213 . . . . 10.0 112.279 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -137.77 175.23 9.77 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 113.165 -1.834 . . . . 10.0 106.466 -179.749 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 177.74 163.33 0.6 Allowed 'General case' 0 C--O 1.24 0.553 0 O-C-N 123.973 0.795 . . . . 10.0 111.309 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -131.01 133.51 45.83 Favored 'General case' 0 CA--C 1.5 -0.961 0 CA-C-N 115.708 -0.678 . . . . 10.0 111.461 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 55.5 t -100.21 90.56 1.94 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.43 0 C-N-CA 124.675 1.19 . . . . 10.0 109.68 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . 0.46 ' HB2' ' HB3' ' A' ' 115' ' ' LEU . 13.4 m-30 -81.96 166.57 19.74 Favored 'General case' 0 N--CA 1.442 -0.85 0 CA-C-O 122.557 1.17 . . . . 10.0 111.31 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.23 127.14 16.36 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 106.318 -1.734 . . . . 10.0 106.318 179.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 8.6 tttp -77.55 142.98 38.72 Favored 'General case' 0 CA--C 1.504 -0.807 0 N-CA-C 106.376 -1.713 . . . . 10.0 106.376 179.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 10.4 p -97.03 -14.26 7.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 119.369 0.986 . . . . 10.0 111.978 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 12.0 t-80 . . . . . 0 C--N 1.314 -0.946 0 O-C-N 126.315 2.259 . . . . 10.0 110.87 -179.958 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo . . . . . 0 N--CA 1.484 0.968 0 CA-C-O 123.068 1.195 . . . . 10.0 113.398 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 1.4 p -122.22 97.53 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 CA-C-N 113.553 -1.658 . . . . 10.0 109.502 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -56.54 117.22 3.65 Favored 'General case' 0 C--O 1.239 0.52 0 N-CA-C 113.89 1.07 . . . . 10.0 113.89 179.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -85.45 24.32 1.2 Allowed 'General case' 0 C--O 1.243 0.719 0 O-C-N 121.119 -0.988 . . . . 10.0 111.759 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 13.2 m-80 -55.92 125.51 21.74 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 120.909 -1.12 . . . . 10.0 111.762 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 159.26 -163.38 33.35 Favored Glycine 0 C--O 1.214 -1.132 0 C-N-CA 117.963 -2.065 . . . . 10.0 116.409 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -122.7 173.26 7.84 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 105.058 -2.201 . . . . 10.0 105.058 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.657 ' CE3' HD12 ' A' ' 115' ' ' LEU . 1.1 m0 -169.56 98.58 0.33 Allowed 'General case' 0 N--CA 1.445 -0.698 0 O-C-N 125.306 1.629 . . . . 10.0 114.782 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.53 146.95 28.06 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 104.362 -2.458 . . . . 10.0 104.362 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -93.39 132.4 37.67 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 117.554 -1.658 . . . . 10.0 114.447 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -80.92 -54.98 5.1 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 113.731 -1.577 . . . . 10.0 110.07 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 33.9 m -156.47 130.79 8.68 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 115.598 1.703 . . . . 10.0 115.598 -179.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 5.1 p30 -116.18 171.36 7.86 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 112.534 -2.121 . . . . 10.0 105.521 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -136.57 -56.51 0.74 Allowed 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 116.703 2.112 . . . . 10.0 116.703 -179.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -92.96 51.05 1.62 Allowed 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 114.029 1.122 . . . . 10.0 114.029 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 27.9 t80 -71.72 -49.58 38.05 Favored 'General case' 0 C--O 1.243 0.761 0 CA-C-O 117.219 -1.372 . . . . 10.0 112.861 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.407 ' OE2' ' ND2' ' A' ' 34' ' ' ASN . 1.7 mp0 -72.66 -39.09 67.39 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 114.362 1.245 . . . . 10.0 114.362 -179.766 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.94 -24.7 63.39 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 121.831 0.824 . . . . 10.0 110.871 -179.816 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -74.63 -42.8 57.92 Favored 'General case' 0 C--N 1.319 -0.756 0 O-C-N 120.292 -1.505 . . . . 10.0 107.803 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 45.7 mt -75.92 -20.13 58.23 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-O 123.408 1.575 . . . . 10.0 109.64 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -79.7 -29.1 40.61 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 107.577 -1.268 . . . . 10.0 107.577 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.468 ' HB1' ' HB3' ' A' ' 122' ' ' GLU . . . -68.82 -23.23 64.24 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 120.427 -1.421 . . . . 10.0 111.977 -179.61 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 85.2 mt -102.42 -21.92 14.17 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 118.247 -0.882 . . . . 10.0 111.394 179.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 50.0 m-20 70.86 63.85 0.18 Allowed 'General case' 0 C--O 1.247 0.935 0 O-C-N 126.965 2.666 . . . . 10.0 114.561 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -93.1 167.22 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 106.203 -1.777 . . . . 10.0 106.203 179.811 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 43.9 t30 -43.67 159.02 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 117.154 2.279 . . . . 10.0 117.154 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.4 t -77.19 -40.92 30.33 Favored 'Isoleucine or valine' 0 C--O 1.232 0.158 0 CA-C-N 113.057 -1.883 . . . . 10.0 112.791 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.75 -33.9 71.29 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.212 -0.904 . . . . 10.0 111.798 -179.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.625 HD23 ' O ' ' A' ' 29' ' ' LEU . 10.5 tt -72.31 -26.94 62.15 Favored 'General case' 0 C--O 1.218 -0.585 0 CA-C-N 115.662 -0.699 . . . . 10.0 111.969 -179.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.1 -31.35 62.76 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 125.024 1.33 . . . . 10.0 110.535 179.703 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 30.4 tttp -78.24 -41.28 34.7 Favored 'General case' 0 N--CA 1.447 -0.606 0 O-C-N 123.735 0.647 . . . . 10.0 112.736 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 40.2 mt -75.46 -44.48 41.43 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.321 0 O-C-N 124.048 0.843 . . . . 10.0 111.623 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.421 ' HA ' HD11 ' A' ' 36' ' ' LEU . . . -63.12 -22.57 66.95 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.267 -0.879 . . . . 10.0 113.034 -179.733 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.407 ' ND2' ' OE2' ' A' ' 17' ' ' GLU . 49.4 t30 -81.25 -5.35 57.68 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 113.934 1.087 . . . . 10.0 113.934 179.761 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.5 13.05 36.16 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-O 116.711 -1.614 . . . . 10.0 112.859 -179.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.421 HD11 ' HA ' ' A' ' 33' ' ' ALA . 0.0 OUTLIER -137.14 172.98 12.2 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 119.557 1.071 . . . . 10.0 110.184 179.791 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -127.94 102.29 22.15 Favored Pre-proline 0 C--O 1.24 0.601 0 N-CA-C 104.853 -2.277 . . . . 10.0 104.853 -179.593 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -57.56 87.57 0.05 OUTLIER 'Trans proline' 0 C--O 1.221 -0.374 0 N-CA-C 116.947 1.864 . . . . 10.0 116.947 179.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -61.55 152.57 30.0 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 122.165 0.983 . . . . 10.0 108.819 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -108.75 156.39 19.67 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.038 -1.437 . . . . 10.0 110.335 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.428 ' OE1' HG23 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -149.62 103.05 3.22 Favored 'General case' 0 N--CA 1.439 -1.007 0 N-CA-C 103.477 -2.786 . . . . 10.0 103.477 -179.866 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 5.0 mt -101.66 133.99 43.43 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 CA-C-N 115.586 -0.734 . . . . 10.0 111.885 179.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.428 HG23 ' OE1' ' A' ' 41' ' ' GLU . 47.2 t -136.66 90.62 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.883 0 N-CA-C 105.265 -2.124 . . . . 10.0 105.265 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 21.8 tt0 -90.0 126.76 35.87 Favored 'General case' 0 C--N 1.313 -0.983 0 O-C-N 125.6 1.813 . . . . 10.0 109.288 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -95.71 -22.48 17.52 Favored 'General case' 0 C--N 1.319 -0.747 0 O-C-N 120.571 -1.331 . . . . 10.0 108.829 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 140.34 -126.49 3.2 Favored Glycine 0 CA--C 1.534 1.243 0 N-CA-C 105.943 -2.863 . . . . 10.0 105.943 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -47.25 -30.75 3.23 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 119.737 1.769 . . . . 10.0 111.672 -179.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 40.7 m170 -102.37 128.46 48.94 Favored 'General case' 0 N--CA 1.444 -0.766 0 O-C-N 120.037 -1.664 . . . . 10.0 106.571 179.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 31.7 ttm -122.2 142.11 50.77 Favored 'General case' 0 N--CA 1.437 -1.102 0 O-C-N 119.698 -1.876 . . . . 10.0 112.374 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 10.1 mt -131.33 121.85 49.62 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.068 0 N-CA-C 107.383 -1.339 . . . . 10.0 107.383 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mp -116.16 125.98 73.46 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 N-CA-C 104.985 -2.228 . . . . 10.0 104.985 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.592 ' HA ' HG22 ' A' ' 61' ' ' ILE . 3.9 mtt85 -120.16 94.96 4.56 Favored 'General case' 0 C--O 1.214 -0.766 0 O-C-N 126.069 2.106 . . . . 10.0 109.074 -179.781 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.8 m -83.16 113.5 20.68 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 101.323 -3.584 . . . . 10.0 101.323 -179.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 6.6 mp -102.74 93.97 5.37 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 118.267 2.691 . . . . 10.0 118.267 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -100.21 132.0 45.83 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 104.413 -2.439 . . . . 10.0 104.413 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 8.4 p -46.88 -28.57 1.63 Allowed 'General case' 0 CA--C 1.545 0.776 0 O-C-N 125.252 1.595 . . . . 10.0 109.041 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -106.01 99.79 9.36 Favored 'General case' 0 C--O 1.245 0.817 0 C-N-CA 125.048 1.339 . . . . 10.0 110.446 -179.609 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 67.79 149.74 0.06 Allowed 'General case' 0 C--N 1.321 -0.659 0 O-C-N 126.697 2.498 . . . . 10.0 110.743 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -108.73 150.37 27.68 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 113.594 -1.639 . . . . 10.0 110.785 179.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 6.5 t80 -137.59 84.67 2.06 Favored 'General case' 0 N--CA 1.434 -1.244 0 CA-C-N 114.035 -1.438 . . . . 10.0 107.468 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.592 HG22 ' HA ' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -102.99 157.33 4.94 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-N 120.492 1.496 . . . . 10.0 112.488 179.821 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 2.4 mtp -134.82 158.97 42.83 Favored 'General case' 0 C--N 1.32 -0.686 0 O-C-N 126.378 2.299 . . . . 10.0 107.826 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -145.55 95.84 2.72 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 100.79 -3.782 . . . . 10.0 100.79 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 8.6 m-30 -116.87 163.38 16.28 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 117.026 2.232 . . . . 10.0 117.026 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 82.2 mt-30 -117.23 116.33 27.05 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 103.611 -2.737 . . . . 10.0 103.611 179.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.9 t -66.95 138.99 21.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 124.025 1.869 . . . . 10.0 109.483 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 66.06 24.39 71.73 Favored Glycine 0 C--N 1.336 0.553 0 CA-C-N 114.081 -1.418 . . . . 10.0 113.818 179.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 11.7 mttt -141.41 158.22 44.15 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 118.417 -1.313 . . . . 10.0 113.389 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -72.74 167.88 19.94 Favored 'General case' 0 C--N 1.316 -0.885 0 O-C-N 124.87 1.357 . . . . 10.0 109.145 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -157.48 -175.28 5.31 Favored 'General case' 0 C--O 1.247 0.941 0 C-N-CA 124.482 1.113 . . . . 10.0 110.547 -179.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -163.14 127.51 2.96 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 105.304 -2.11 . . . . 10.0 105.304 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -120.17 169.51 10.17 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 114.913 -1.039 . . . . 10.0 113.543 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -100.22 -15.24 18.17 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 107.258 -1.386 . . . . 10.0 107.258 179.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 3.3 pp -141.72 -174.64 4.12 Favored 'General case' 0 C--N 1.314 -0.954 0 O-C-N 125.495 1.747 . . . . 10.0 114.706 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -141.88 -76.1 0.29 Allowed 'General case' 0 C--O 1.218 -0.582 0 N-CA-C 106.899 -1.519 . . . . 10.0 106.899 179.829 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -130.78 76.33 0.41 Allowed Glycine 0 C--O 1.238 0.37 0 CA-C-O 119.702 -0.499 . . . . 10.0 112.273 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 19.5 mt 64.63 -71.22 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.714 0 CA-C-O 118.262 -0.875 . . . . 10.0 109.928 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -45.25 -29.81 1.08 Allowed 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 124.917 1.287 . . . . 10.0 110.536 -179.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.8 p30 56.25 168.77 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 129.386 3.074 . . . . 10.0 118.595 179.348 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.9 ttm-85 169.03 118.23 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 116.107 -1.902 . . . . 10.0 108.134 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 23.3 mtpt -47.52 121.19 3.76 Favored 'General case' 0 C--N 1.314 -0.973 0 O-C-N 125.336 1.648 . . . . 10.0 107.583 -179.545 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -133.93 170.61 15.36 Favored 'General case' 0 C--N 1.315 -0.901 0 O-C-N 125.933 2.021 . . . . 10.0 109.696 179.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 4.3 mtp -126.75 98.43 5.37 Favored 'General case' 0 N--CA 1.44 -0.964 1 N-CA-C 100.063 -4.051 . . . . 10.0 100.063 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 26.1 m -99.94 131.24 46.03 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 124.371 2.034 . . . . 10.0 114.762 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 1.2 m -115.88 128.93 56.18 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 112.773 -2.012 . . . . 10.0 107.032 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 2.2 t -106.2 127.32 61.51 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.929 0 N-CA-C 103.384 -2.821 . . . . 10.0 103.384 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.2 t -151.13 147.11 26.65 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 123.143 1.449 . . . . 10.0 111.547 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 2.2 p-90 -95.75 130.4 42.68 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 105.589 -2.004 . . . . 10.0 105.589 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -78.3 -51.17 10.53 Favored 'General case' 0 C--O 1.247 0.93 1 N-CA-C 99.904 -4.11 . . . . 10.0 99.904 179.888 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -157.25 -76.55 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.445 0 N-CA-C 108.192 -1.963 . . . . 10.0 108.192 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -114.48 19.05 16.45 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 115.103 1.52 . . . . 10.0 115.103 179.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 9.0 mttm -129.98 -171.96 2.66 Favored 'General case' 0 C--O 1.244 0.792 0 CA-C-O 118.24 -0.886 . . . . 10.0 108.725 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.3 tt -137.34 131.92 32.86 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 104.57 -2.382 . . . . 10.0 104.57 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -137.43 -173.62 3.53 Favored 'General case' 0 C--O 1.219 -0.508 0 N-CA-C 114.78 1.4 . . . . 10.0 114.78 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 1.1 m -156.33 137.28 13.53 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 118.817 0.735 . . . . 10.0 110.156 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 3.7 t -95.8 -52.83 8.9 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 N-CA-C 106.845 -1.539 . . . . 10.0 106.845 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 1.9 mm-40 71.44 114.37 0.05 Allowed 'General case' 0 C--O 1.244 0.809 0 C-N-CA 127.395 2.278 . . . . 10.0 109.572 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 13.4 mttt -97.21 74.58 2.54 Favored 'General case' 0 C--N 1.343 0.306 0 CA-C-O 116.756 -1.593 . . . . 10.0 112.41 -179.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -107.5 -93.22 2.29 Favored Glycine 0 N--CA 1.451 -0.305 0 O-C-N 125.473 1.733 . . . . 10.0 109.967 179.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -167.55 -39.01 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 117.553 2.427 . . . . 10.0 117.553 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.05 146.34 11.43 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 113.808 1.04 . . . . 10.0 113.808 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -78.82 83.37 4.95 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 125.08 1.352 . . . . 10.0 112.341 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 142.23 -1.75 1.71 Allowed Glycine 0 C--O 1.219 -0.802 0 O-C-N 126.516 2.385 . . . . 10.0 115.544 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 23.7 mtt180 -52.63 161.81 0.66 Allowed 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 118.572 1.186 . . . . 10.0 112.835 -179.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 107.65 152.88 17.82 Favored Glycine 0 C--O 1.224 -0.485 0 CA-C-N 112.522 -2.126 . . . . 10.0 110.562 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' TRP . . . . . 0.423 ' CD1' ' N ' ' A' ' 106' ' ' TRP . 0.0 OUTLIER -117.39 179.28 4.09 Favored 'General case' 0 C--N 1.33 -0.249 0 O-C-N 120.198 -1.766 . . . . 10.0 110.246 179.909 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -153.51 99.08 2.3 Favored 'General case' 0 CA--C 1.503 -0.839 0 O-C-N 124.748 1.28 . . . . 10.0 108.517 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 62.4 mt-30 -98.49 147.41 24.78 Favored 'General case' 0 C--O 1.239 0.52 0 O-C-N 126.564 2.415 . . . . 10.0 112.309 -179.674 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -169.41 128.76 1.01 Allowed 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 105.966 -1.864 . . . . 10.0 105.966 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 69.5 mt -88.56 160.28 2.86 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.802 0 N-CA-C 116.894 2.183 . . . . 10.0 116.894 -179.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -139.28 63.04 1.51 Allowed 'General case' 0 N--CA 1.463 0.194 0 O-C-N 126.36 2.287 . . . . 10.0 106.474 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 72.89 -98.64 0.88 Allowed Glycine 0 CA--C 1.531 1.036 0 N-CA-C 107.928 -2.069 . . . . 10.0 107.928 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -108.13 19.63 19.71 Favored 'General case' 0 C--N 1.321 -0.655 0 O-C-N 121.453 -1.028 . . . . 10.0 113.078 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -128.86 95.8 4.19 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 120.554 -1.341 . . . . 10.0 111.071 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.657 HD12 ' CE3' ' A' ' 8' ' ' TRP . 0.2 OUTLIER -64.89 120.1 11.91 Favored 'General case' 0 C--N 1.319 -0.738 0 O-C-N 121.123 -0.985 . . . . 10.0 109.677 -179.838 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 5.0 t60 -109.97 103.28 12.01 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 107.083 -1.451 . . . . 10.0 107.083 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.529 ' O ' HD23 ' A' ' 117' ' ' LEU . 0.2 OUTLIER -110.09 115.94 30.66 Favored 'General case' 0 C--N 1.321 -0.653 0 O-C-N 125.237 1.586 . . . . 10.0 109.11 -179.853 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -108.83 90.99 3.46 Favored 'General case' 0 CA--C 1.507 -0.711 0 N-CA-C 105.408 -2.071 . . . . 10.0 105.408 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -78.01 154.93 31.03 Favored 'General case' 0 N--CA 1.443 -0.823 0 C-N-CA 126.336 1.854 . . . . 10.0 111.15 179.776 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -136.98 137.62 39.68 Favored 'General case' 0 C--N 1.319 -0.734 0 O-C-N 126.027 2.079 . . . . 10.0 113.809 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . 0.722 ' O ' HG22 ' A' ' 124' ' ' VAL . . . -160.91 129.97 4.72 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 116.362 -1.78 . . . . 10.0 109.291 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . 0.468 ' HB3' ' HB1' ' A' ' 22' ' ' ALA . 3.5 tt0 40.23 49.42 2.46 Favored 'General case' 0 C--O 1.241 0.647 0 N-CA-C 115.639 1.718 . . . . 10.0 115.639 -179.747 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 70.49 16.87 74.1 Favored Glycine 0 CA--C 1.538 1.512 0 CA-C-O 115.945 -2.586 . . . . 10.0 115.847 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.722 HG22 ' O ' ' A' ' 121' ' ' ALA . 4.0 m -108.1 169.45 3.04 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 O-C-N 125.723 1.484 . . . . 10.0 108.698 179.758 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 2.7 m -136.39 91.08 2.63 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.98 -0.554 . . . . 10.0 111.573 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 26.2 t -95.23 99.62 11.55 Favored 'General case' 0 C--O 1.216 -0.66 0 N-CA-C 105.691 -1.966 . . . . 10.0 105.691 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.33 151.01 22.4 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 114.055 -1.429 . . . . 10.0 109.564 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 14.1 mt-30 -144.4 125.5 14.53 Favored 'General case' 0 C--N 1.315 -0.911 0 O-C-N 126.136 2.147 . . . . 10.0 113.462 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 19.4 t -91.03 114.4 28.31 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 107.077 -1.453 . . . . 10.0 107.077 -179.663 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -101.99 177.21 4.96 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.661 -0.866 . . . . 10.0 108.661 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -148.17 120.06 8.16 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 106.339 -1.726 . . . . 10.0 106.339 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -79.64 125.58 29.81 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 117.86 -1.536 . . . . 10.0 107.632 -179.619 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 18.3 t -82.61 -66.18 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-O 117.934 -1.031 . . . . 10.0 109.996 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.255 1.364 0 O-C-N 125.289 1.618 . . . . 10.0 109.711 179.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.482 0.852 0 CA-C-O 118.287 -0.797 . . . . 10.0 112.575 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 60.0 t 73.65 -56.77 0.28 Allowed 'Isoleucine or valine' 0 C--O 1.241 0.632 0 C-N-CA 125.167 1.387 . . . . 10.0 110.44 179.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 62.49 -68.33 0.07 Allowed 'General case' 0 C--N 1.32 -0.692 0 O-C-N 126.53 2.394 . . . . 10.0 112.59 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 68.1 -28.97 0.15 Allowed 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 117.296 2.332 . . . . 10.0 117.296 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -37.39 115.14 0.38 Allowed 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 116.499 2.037 . . . . 10.0 116.499 179.695 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -176.16 164.19 33.98 Favored Glycine 0 CA--C 1.527 0.808 0 N-CA-C 117.384 1.714 . . . . 10.0 117.384 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 16.9 m-30 -94.96 141.92 28.08 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 101.138 -3.653 . . . . 10.0 101.138 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.758 ' NE1' HD12 ' A' ' 42' ' ' ILE . 57.8 m95 -134.82 85.73 2.2 Favored 'General case' 0 C--N 1.313 -1.0 0 O-C-N 126.012 2.07 . . . . 10.0 111.591 179.726 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.06 149.39 27.82 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 104.912 -2.255 . . . . 10.0 104.912 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.455 ' HE2' ' CZ ' ' A' ' 130' ' ' PHE . 27.4 ttm -99.93 150.09 22.76 Favored 'General case' 0 N--CA 1.444 -0.748 0 N-CA-C 115.171 1.545 . . . . 10.0 115.171 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.8 mp -108.71 -64.71 1.2 Allowed 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 113.394 -1.73 . . . . 10.0 107.281 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -156.42 154.61 30.74 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 117.023 2.231 . . . . 10.0 117.023 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -113.8 165.79 12.21 Favored 'General case' 0 CA--C 1.509 -0.616 0 O-C-N 128.406 3.566 . . . . 10.0 109.154 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -142.37 138.06 30.92 Favored 'General case' 0 C--O 1.24 0.565 0 O-C-N 120.659 -1.275 . . . . 10.0 112.962 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 60.79 17.71 7.94 Favored 'General case' 0 C--O 1.247 0.959 0 CA-C-O 124.737 2.208 . . . . 10.0 115.686 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -52.24 -50.48 61.94 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 116.607 -3.808 . . . . 10.0 115.966 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 59.7 mt-10 -63.33 -30.43 71.57 Favored 'General case' 0 C--O 1.219 -0.535 0 N-CA-C 114.748 1.388 . . . . 10.0 114.748 179.496 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -79.87 -28.99 39.92 Favored 'General case' 0 C--N 1.328 -0.361 0 O-C-N 127.022 2.701 . . . . 10.0 109.989 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -65.5 -53.26 44.95 Favored 'General case' 0 C--N 1.317 -0.823 0 O-C-N 124.209 0.943 . . . . 10.0 111.369 179.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.55 ' HB3' HG22 ' A' ' 25' ' ' VAL . 12.8 mt -65.45 -21.7 66.68 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 114.091 1.145 . . . . 10.0 114.091 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -71.18 -31.41 67.62 Favored 'General case' 0 C--N 1.317 -0.81 0 C-N-CA 124.316 1.046 . . . . 10.0 110.534 -179.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.68 -48.64 79.89 Favored 'General case' 0 CA--C 1.531 0.24 0 O-C-N 125.204 1.565 . . . . 10.0 113.396 179.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -90.76 -12.3 36.96 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.406 -1.27 . . . . 10.0 109.167 179.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.2 t0 55.83 57.82 4.91 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 114.512 -1.222 . . . . 10.0 113.529 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.55 HG22 ' HB3' ' A' ' 20' ' ' LEU . 14.5 m -73.37 -164.8 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-N 114.703 -1.135 . . . . 10.0 109.123 -179.837 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -64.17 140.83 58.91 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 116.232 1.938 . . . . 10.0 116.232 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.408 ' H ' HG12 ' A' ' 27' ' ' VAL . 1.4 p -60.15 -39.14 79.67 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.945 0 C-N-CA 126.188 1.795 . . . . 10.0 115.775 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.63 -21.16 64.49 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 114.16 -1.382 . . . . 10.0 111.043 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.41 -43.18 23.87 Favored 'General case' 0 C--O 1.218 -0.603 0 O-C-N 124.773 1.296 . . . . 10.0 110.719 -179.762 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.5 ttm180 -59.58 -34.12 72.31 Favored 'General case' 0 C--O 1.243 0.763 0 C-N-CA 125.709 1.604 . . . . 10.0 114.291 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.0 ttpt -75.89 -46.73 28.6 Favored 'General case' 0 N--CA 1.438 -1.032 0 O-C-N 125.715 1.885 . . . . 10.0 112.659 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 7.8 mm -76.19 -39.36 35.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 O-C-N 121.427 -0.796 . . . . 10.0 111.451 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.468 ' HA ' ' HB3' ' A' ' 36' ' ' LEU . . . -63.64 -24.23 67.71 Favored 'General case' 0 C--O 1.215 -0.752 0 N-CA-C 115.732 1.752 . . . . 10.0 115.732 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -65.32 -56.54 12.06 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 119.522 -0.871 . . . . 10.0 109.903 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.534 ' C ' HD12 ' A' ' 35' ' ' LEU . 4.5 pp -79.89 0.87 29.38 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 113.031 0.752 . . . . 10.0 113.031 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.468 ' HB3' ' HA ' ' A' ' 33' ' ' ALA . 12.3 tp -105.68 125.1 50.6 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 124.451 1.094 . . . . 10.0 108.728 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.56 103.06 53.08 Favored Pre-proline 0 C--N 1.316 -0.862 0 CA-C-N 120.463 1.483 . . . . 10.0 109.582 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -70.59 112.41 3.22 Favored 'Trans proline' 0 C--N 1.354 0.826 0 CA-C-O 123.906 1.544 . . . . 10.0 114.516 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -71.5 169.61 15.07 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 114.407 -1.27 . . . . 10.0 109.443 -179.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.6 mtmt -136.58 153.21 51.03 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-O 122.575 1.178 . . . . 10.0 112.527 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -142.1 115.35 8.89 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 103.003 -2.962 . . . . 10.0 103.003 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.758 HD12 ' NE1' ' A' ' 8' ' ' TRP . 61.7 mt -100.49 147.65 7.58 Favored 'Isoleucine or valine' 0 C--O 1.247 0.925 0 N-CA-C 108.757 -0.831 . . . . 10.0 108.757 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.5 t -147.96 130.32 7.05 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.836 0 N-CA-C 105.727 -1.953 . . . . 10.0 105.727 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -132.56 151.98 51.75 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 122.68 1.229 . . . . 10.0 109.667 -179.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -149.82 100.47 2.96 Favored 'General case' 0 N--CA 1.444 -0.763 0 N-CA-C 106.876 -1.528 . . . . 10.0 106.876 179.841 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.17 -115.49 4.04 Favored Glycine 0 C--N 1.345 1.045 0 N-CA-C 109.056 -1.618 . . . . 10.0 109.056 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -119.12 18.46 13.09 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 108.62 -0.882 . . . . 10.0 108.62 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 7.6 t-160 -107.85 122.24 46.39 Favored 'General case' 0 CA--C 1.508 -0.671 0 N-CA-C 106.601 -1.629 . . . . 10.0 106.601 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 4.1 ttt -109.68 134.43 51.98 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 114.333 1.234 . . . . 10.0 114.333 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 7.1 mt -118.63 98.79 6.85 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.994 0 N-CA-C 107.751 -1.204 . . . . 10.0 107.751 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.418 ' N ' HD12 ' A' ' 51' ' ' ILE . 2.0 mp -89.0 131.37 36.5 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.969 0 N-CA-C 105.527 -2.027 . . . . 10.0 105.527 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 22.0 mtm180 -129.31 133.96 47.7 Favored 'General case' 0 C--O 1.215 -0.745 0 N-CA-C 113.506 0.928 . . . . 10.0 113.506 -179.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 54.1 m -114.13 99.37 7.58 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 101.048 -3.686 . . . . 10.0 101.048 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 8.4 mt -99.41 133.22 44.04 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 120.194 3.405 . . . . 10.0 120.194 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -158.33 155.26 28.46 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 126.679 1.992 . . . . 10.0 105.683 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 7.0 t -87.05 -1.96 58.27 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 105.753 -1.943 . . . . 10.0 105.753 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -124.49 102.41 7.63 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 105.27 -2.122 . . . . 10.0 105.27 179.761 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 63.85 129.83 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 125.434 2.54 . . . . 10.0 110.825 179.799 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -150.28 157.24 42.86 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-O 125.15 2.405 . . . . 10.0 110.376 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 32.3 p90 -152.25 139.74 19.62 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 104.743 -2.317 . . . . 10.0 104.743 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.534 ' N ' HD12 ' A' ' 61' ' ' ILE . 2.0 mp -130.87 139.64 50.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 O-C-N 125.299 1.625 . . . . 10.0 111.443 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 5.0 ptp -115.89 179.78 3.88 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 127.322 2.249 . . . . 10.0 104.975 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -157.08 102.93 1.99 Allowed 'General case' 0 N--CA 1.441 -0.876 0 N-CA-C 102.575 -3.12 . . . . 10.0 102.575 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -114.47 160.67 18.94 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 117.696 2.48 . . . . 10.0 117.696 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 5.6 mm-40 -116.31 152.01 34.71 Favored 'General case' 0 C--O 1.216 -0.706 0 N-CA-C 107.734 -1.21 . . . . 10.0 107.734 179.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 14.7 t -95.19 115.9 35.25 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 CA-C-O 123.492 1.615 . . . . 10.0 111.062 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 79.41 23.94 61.91 Favored Glycine 0 C--O 1.224 -0.481 0 CA-C-N 113.943 -1.481 . . . . 10.0 113.729 179.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.86 145.08 51.33 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 123.346 0.658 . . . . 10.0 111.145 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 66.5 tt0 -68.95 165.17 20.58 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 107.56 -1.274 . . . . 10.0 107.56 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -160.26 131.44 5.76 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 122.741 1.258 . . . . 10.0 112.465 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -96.24 67.52 2.56 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.514 -1.221 . . . . 10.0 109.916 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 57.1 tt0 -58.79 125.11 22.13 Favored 'General case' 0 N--CA 1.442 -0.865 0 O-C-N 126.798 2.561 . . . . 10.0 115.985 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -111.61 105.11 13.56 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-O 122.853 1.311 . . . . 10.0 108.337 179.729 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 20.9 mt -80.53 137.39 36.42 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 114.752 -1.113 . . . . 10.0 113.587 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 53.8 p -120.2 105.38 10.91 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 106.155 -1.794 . . . . 10.0 106.155 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 98.79 -169.39 23.17 Favored Glycine 0 C--O 1.243 0.69 0 CA-C-O 117.171 -1.905 . . . . 10.0 108.98 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.404 HG23 ' O ' ' A' ' 77' ' ' ILE . 0.1 OUTLIER 39.64 54.11 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 O-C-N 126.739 2.082 . . . . 10.0 110.474 179.83 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 5.0 t70 86.97 -26.85 0.08 Allowed 'General case' 0 C--O 1.239 0.526 0 O-C-N 126.126 2.141 . . . . 10.0 112.426 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 47.07 100.24 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 123.947 1.832 . . . . 10.0 115.931 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.89 93.73 1.98 Allowed 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 114.222 -1.354 . . . . 10.0 110.187 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 5.4 pttt -58.44 141.02 52.84 Favored 'General case' 0 N--CA 1.444 -0.743 0 N-CA-C 104.51 -2.404 . . . . 10.0 104.51 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -134.64 -177.3 4.55 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 113.715 -1.584 . . . . 10.0 110.002 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 25.6 mtm -119.85 66.15 0.81 Allowed 'General case' 0 CA--C 1.503 -0.844 0 N-CA-C 102.564 -3.125 . . . . 10.0 102.564 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 96.7 m -72.17 139.12 48.09 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 117.623 2.453 . . . . 10.0 117.623 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -120.63 116.64 25.73 Favored 'General case' 0 C--N 1.319 -0.752 0 O-C-N 126.955 2.659 . . . . 10.0 105.566 179.782 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 1.4 t -107.36 146.89 13.01 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 O-C-N 126.961 2.663 . . . . 10.0 104.407 179.647 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.9 t -148.78 -173.83 4.46 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 123.65 0.78 . . . . 10.0 109.091 -179.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 1.1 p-90 -151.65 122.71 7.64 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 106.834 -1.543 . . . . 10.0 106.834 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -112.24 56.67 0.66 Allowed 'General case' 0 CA--C 1.5 -0.976 0 N-CA-C 101.648 -3.464 . . . . 10.0 101.648 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 117.43 -154.0 16.94 Favored Glycine 0 C--N 1.338 0.659 0 N-CA-C 104.92 -3.272 . . . . 10.0 104.92 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 12.0 t0 -82.85 58.63 4.42 Favored 'General case' 0 C--O 1.219 -0.528 0 O-C-N 120.024 -1.868 . . . . 10.0 112.027 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.5 mtmt -136.03 -172.11 3.04 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 122.644 1.211 . . . . 10.0 108.249 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 1.5 tp -152.64 98.29 2.34 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 108.385 -0.968 . . . . 10.0 108.385 -179.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.31 138.31 40.25 Favored 'General case' 0 C--O 1.216 -0.688 0 CA-C-O 121.863 0.84 . . . . 10.0 110.023 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 7.7 m -128.81 143.99 51.05 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 123.784 0.834 . . . . 10.0 111.7 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 23.8 t -137.46 110.48 7.75 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 N-CA-C 105.157 -2.164 . . . . 10.0 105.157 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 -101.65 127.29 48.45 Favored 'General case' 0 C--O 1.244 0.79 0 C-N-CA 123.219 0.608 . . . . 10.0 110.041 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 1.3 pttt -114.62 88.39 2.85 Favored 'General case' 0 C--O 1.233 0.204 0 N-CA-C 113.06 0.763 . . . . 10.0 113.06 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -115.17 -91.49 1.77 Allowed Glycine 0 N--CA 1.437 -1.252 0 N-CA-C 110.361 -1.096 . . . . 10.0 110.361 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -134.83 -8.15 2.4 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 116.966 2.21 . . . . 10.0 116.966 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.04 -177.53 4.52 Favored 'General case' 0 C--N 1.326 -0.423 0 O-C-N 126.682 2.489 . . . . 10.0 113.856 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -123.04 30.64 6.29 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 126.962 2.105 . . . . 10.0 112.869 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -161.93 -19.32 0.03 OUTLIER Glycine 0 N--CA 1.467 0.758 0 N-CA-C 119.855 2.702 . . . . 10.0 119.855 -179.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 1.5 mtt180 -51.42 116.12 1.92 Allowed 'General case' 0 C--O 1.223 -0.339 0 CA-C-O 124.133 1.921 . . . . 10.0 110.989 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 165.11 150.39 6.18 Favored Glycine 0 CA--C 1.518 0.26 0 N-CA-C 108.963 -1.655 . . . . 10.0 108.963 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -135.27 -173.05 3.22 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-N 114.181 -1.01 . . . . 10.0 112.227 -179.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . 0.518 ' O ' HD12 ' A' ' 117' ' ' LEU . 35.5 m -165.63 136.03 3.64 Favored 'General case' 0 N--CA 1.443 -0.782 0 C-N-CA 124.651 1.18 . . . . 10.0 108.544 -179.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -125.94 103.75 7.92 Favored 'General case' 0 C--O 1.244 0.807 0 C-N-CA 126.675 1.99 . . . . 10.0 108.944 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' TRP . . . . . 0.476 ' C ' ' CD1' ' A' ' 109' ' ' TRP . 0.0 OUTLIER -100.9 161.48 13.56 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 106.254 -1.758 . . . . 10.0 106.254 -179.805 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.421 ' N ' ' CD1' ' A' ' 109' ' ' TRP . 0.6 OUTLIER -131.28 143.03 41.87 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.028 0 N-CA-C 114.957 1.466 . . . . 10.0 114.957 179.999 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -136.59 90.14 2.53 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 112.703 -2.044 . . . . 10.0 108.993 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 47.4 -91.86 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.672 0 N-CA-C 109.278 -1.529 . . . . 10.0 109.278 179.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -96.94 -19.83 18.53 Favored 'General case' 0 C--N 1.333 -0.146 0 O-C-N 120.57 -1.547 . . . . 10.0 113.95 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -98.09 148.87 23.1 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 121.162 1.801 . . . . 10.0 113.937 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.442 ' HB3' ' HB2' ' A' ' 130' ' ' PHE . 13.7 tp -116.53 138.0 51.73 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 106.483 -1.673 . . . . 10.0 106.483 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 48.3 m80 -132.76 89.38 2.63 Favored 'General case' 0 C--N 1.315 -0.928 0 O-C-N 121.006 -1.058 . . . . 10.0 108.62 -179.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.518 HD12 ' O ' ' A' ' 107' ' ' THR . 31.6 tp -94.68 142.95 26.85 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 114.317 -1.31 . . . . 10.0 109.686 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -140.78 107.5 5.36 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 119.239 -0.984 . . . . 10.0 108.769 179.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 6.4 mtt -87.83 149.3 24.22 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 109.446 -0.575 . . . . 10.0 109.446 179.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -133.61 142.93 48.33 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 118.814 0.734 . . . . 10.0 109.481 179.616 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -154.27 134.5 13.28 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 108.828 -0.805 . . . . 10.0 108.828 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 36.0 44.14 0.24 Allowed 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 116.298 1.962 . . . . 10.0 116.298 -179.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 91.46 2.35 70.46 Favored Glycine 0 N--CA 1.468 0.807 0 CA-C-O 118.15 -1.361 . . . . 10.0 115.878 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -109.9 162.56 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 CA-C-N 120.398 2.099 . . . . 10.0 109.667 179.873 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 20.9 m -135.92 101.68 4.81 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 114.966 1.469 . . . . 10.0 114.966 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -86.09 143.78 27.88 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 107.538 -1.282 . . . . 10.0 107.538 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 2.1 mttt -140.17 118.8 12.32 Favored 'General case' 0 C--N 1.322 -0.612 0 O-C-N 124.081 0.863 . . . . 10.0 111.539 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -111.02 130.01 55.72 Favored 'General case' 0 C--O 1.244 0.811 0 O-C-N 125.068 1.48 . . . . 10.0 113.106 -179.491 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 4.8 t -97.58 127.12 50.22 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-O 122.302 1.048 . . . . 10.0 111.516 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . 0.455 ' CZ ' ' HE2' ' A' ' 10' ' ' MET . 0.0 OUTLIER -121.39 155.7 34.24 Favored 'General case' 0 N--CA 1.443 -0.793 0 C-N-CA 126.156 1.782 . . . . 10.0 110.646 179.952 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 4.9 tptt -125.59 120.45 30.85 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 105.128 -2.175 . . . . 10.0 105.128 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.81 116.14 8.15 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 120.928 1.694 . . . . 10.0 111.182 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 27.6 m -122.98 52.29 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 113.772 1.027 . . . . 10.0 113.772 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 . . . . . 0 C--O 1.242 0.7 0 CA-C-N 114.639 -1.164 . . . . 10.0 113.701 -180.0 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo . . . . . 0 N--CA 1.48 0.69 0 N-CA-C 108.901 -1.23 . . . . 10.0 108.901 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 14.5 p -78.9 154.63 4.87 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.417 0 O-C-N 126.184 2.177 . . . . 10.0 112.815 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -96.04 126.16 41.08 Favored 'General case' 0 C--N 1.329 -0.309 0 O-C-N 120.899 -1.126 . . . . 10.0 110.394 -179.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.524 ' CZ ' HD13 ' A' ' 93' ' ' LEU . 2.9 m-85 -128.74 -39.3 1.63 Allowed 'General case' 0 C--O 1.241 0.629 0 N-CA-C 117.531 2.419 . . . . 10.0 117.531 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -50.24 137.91 17.32 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 115.665 1.728 . . . . 10.0 115.665 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -167.04 -97.33 0.11 Allowed Glycine 0 C--N 1.341 0.827 0 CA-C-O 125.011 2.451 . . . . 10.0 112.903 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.492 ' CB ' ' CG1' ' A' ' 133' ' ' VAL . 0.1 OUTLIER 178.4 178.28 0.4 Allowed 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 104.626 -2.361 . . . . 10.0 104.626 -179.833 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.566 ' CD2' ' HB2' ' A' ' 39' ' ' ASP 0.297 36.0 p-90 -147.4 -179.6 6.97 Favored 'General case' 0 C--N 1.317 -0.809 0 O-C-N 127.403 2.939 . . . . 10.0 113.846 -178.384 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.2 ptmm? 166.42 99.8 0.0 OUTLIER 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 111.756 -2.475 . . . . 10.0 108.564 178.678 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.48 148.54 48.36 Favored 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 125.139 1.525 . . . . 10.0 114.44 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.501 HD13 ' HB2' ' A' ' 131' ' ' LYS . 0.1 OUTLIER -113.25 -10.93 13.29 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.263 -0.881 . . . . 10.0 109.572 179.973 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 42.3 t -172.06 168.19 5.89 Favored 'General case' 0 CA--C 1.515 -0.377 0 N-CA-C 115.199 1.555 . . . . 10.0 115.199 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.4 t-20 -163.76 122.97 2.02 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 105.198 -2.149 . . . . 10.0 105.198 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -125.28 178.09 5.78 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 119.734 1.152 . . . . 10.0 111.278 -179.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 37.7 m-20 34.22 33.59 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.478 0 O-C-N 127.057 2.723 . . . . 10.0 112.298 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.645 ' HE2' ' HB1' ' A' ' 33' ' ' ALA . 6.0 t80 -68.42 -42.87 78.31 Favored 'General case' 0 CA--C 1.546 0.796 0 O-C-N 120.018 -1.676 . . . . 10.0 112.939 179.607 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 74.7 mt-10 -71.22 -34.48 70.87 Favored 'General case' 0 N--CA 1.464 0.238 0 O-C-N 120.317 -1.489 . . . . 10.0 112.55 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -74.58 -34.43 62.89 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 106.968 -1.493 . . . . 10.0 106.968 179.524 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -69.63 -27.9 65.46 Favored 'General case' 0 C--O 1.245 0.832 0 O-C-N 126.04 2.088 . . . . 10.0 109.079 179.587 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 44.5 mt -79.0 -25.59 43.33 Favored 'General case' 0 C--O 1.22 -0.479 0 N-CA-C 112.652 0.612 . . . . 10.0 112.652 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 17.3 tpt180 -79.11 -20.37 48.82 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 113.629 -1.623 . . . . 10.0 109.437 179.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.68 -44.42 96.3 Favored 'General case' 0 C--O 1.213 -0.847 0 C-N-CA 126.383 1.873 . . . . 10.0 113.228 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -84.88 -21.56 29.69 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 123.714 1.721 . . . . 10.0 109.712 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.9 t0 74.45 67.73 0.09 Allowed 'General case' 0 N--CA 1.48 1.027 0 CA-C-N 113.404 -1.725 . . . . 10.0 113.519 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 5.8 m -98.44 -176.89 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.469 0 N-CA-C 105.316 -2.105 . . . . 10.0 105.316 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.43 133.54 55.17 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-O 123.617 1.675 . . . . 10.0 113.411 -179.771 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 4.2 m -63.69 -31.77 54.34 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 N-CA-C 116.409 2.003 . . . . 10.0 116.409 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -74.14 -30.22 62.18 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-O 123.593 1.663 . . . . 10.0 108.829 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 60.8 tp -73.63 -22.06 60.11 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 113.325 -1.761 . . . . 10.0 112.686 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.5 ttp-105 -71.97 -31.02 65.87 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 114.931 -1.031 . . . . 10.0 111.917 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 14.8 tttm -74.2 -39.13 63.36 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-O 122.943 1.354 . . . . 10.0 113.872 -179.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.615 ' N ' HD13 ' A' ' 32' ' ' ILE . 1.2 mm -72.61 -33.21 44.1 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.747 0 O-C-N 119.619 -1.926 . . . . 10.0 112.074 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.645 ' HB1' ' HE2' ' A' ' 16' ' ' PHE . . . -69.77 -33.15 72.01 Favored 'General case' 0 C--O 1.217 -0.654 0 CA-C-O 118.348 -0.834 . . . . 10.0 111.659 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.405 ' C ' HD23 ' A' ' 35' ' ' LEU . 26.8 t-20 -60.21 -14.3 16.93 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 118.04 -1.464 . . . . 10.0 113.109 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.534 HD23 ' N ' ' A' ' 35' ' ' LEU . 5.9 mt -93.8 -18.6 21.87 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 118.517 -1.273 . . . . 10.0 111.86 -179.793 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -91.28 134.39 34.62 Favored 'General case' 0 N--CA 1.48 1.05 0 O-C-N 124.654 1.221 . . . . 10.0 109.033 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 16.8 mtpp -123.33 103.93 35.13 Favored Pre-proline 0 N--CA 1.475 0.783 0 N-CA-C 104.785 -2.302 . . . . 10.0 104.785 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -60.69 136.64 68.02 Favored 'Trans proline' 0 C--N 1.357 1.009 0 N-CA-C 117.796 2.191 . . . . 10.0 117.796 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.566 ' HB2' ' CD2' ' A' ' 8' ' ' TRP . 0.4 OUTLIER -100.05 174.66 6.06 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 104.876 -2.268 . . . . 10.0 104.876 179.455 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.408 ' C ' ' CD1' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -167.77 119.05 0.85 Allowed 'General case' 0 CA--C 1.497 -1.075 0 C-N-CA 116.82 -1.952 . . . . 10.0 112.681 179.839 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.413 ' HA ' ' HD1' ' A' ' 8' ' ' TRP . 9.0 tt0 -103.71 137.6 41.51 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 107.084 -1.45 . . . . 10.0 107.084 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 16.0 mt -112.64 153.23 14.28 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-O 117.427 -1.273 . . . . 10.0 107.709 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -147.75 126.32 3.79 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.734 0 N-CA-C 105.523 -2.029 . . . . 10.0 105.523 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 6.5 mm100 -131.86 113.44 13.47 Favored 'General case' 0 C--N 1.314 -0.977 0 O-C-N 125.605 1.816 . . . . 10.0 110.404 179.667 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -104.66 -11.77 16.73 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 105.089 -2.189 . . . . 10.0 105.089 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 166.47 -123.89 1.18 Allowed Glycine 0 CA--C 1.511 -0.171 0 N-CA-C 108.958 -1.657 . . . . 10.0 108.958 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -84.37 -8.13 59.08 Favored 'General case' 0 C--O 1.216 -0.701 0 CA-C-N 121.242 2.521 . . . . 10.0 108.308 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -96.02 118.03 31.82 Favored 'General case' 0 C--O 1.219 -0.524 0 N-CA-C 105.907 -1.886 . . . . 10.0 105.907 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 17.9 ttp -115.46 127.29 55.22 Favored 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 115.216 1.561 . . . . 10.0 115.216 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 15.0 mt -113.5 145.37 19.48 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.057 0 N-CA-C 105.175 -2.157 . . . . 10.0 105.175 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.6 mt -136.75 114.15 13.66 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-O 122.956 1.36 . . . . 10.0 107.807 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -95.92 84.32 3.84 Favored 'General case' 0 CA--C 1.503 -0.83 0 CA-C-N 112.911 -1.95 . . . . 10.0 111.555 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.415 ' HB ' ' HB3' ' A' ' 60' ' ' TYR . 98.5 m -89.35 115.91 27.16 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 100.203 -3.999 . . . . 10.0 100.203 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 43.9 mt -117.47 73.79 0.9 Allowed 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 119.174 3.028 . . . . 10.0 119.174 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 4.3 m -69.01 101.09 1.32 Allowed 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 102.572 -3.122 . . . . 10.0 102.572 179.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.8 t -60.16 96.35 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 119.991 1.269 . . . . 10.0 108.466 -179.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER 160.08 -42.6 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 126.713 2.005 . . . . 10.0 106.247 -179.865 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -144.11 105.16 4.21 Favored 'General case' 0 CA--C 1.511 -0.55 0 O-C-N 126.117 2.135 . . . . 10.0 112.517 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.92 125.38 23.78 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 120.079 -1.638 . . . . 10.0 108.637 179.848 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.415 ' HB3' ' HB ' ' A' ' 53' ' ' THR . 0.3 OUTLIER -109.01 125.92 52.57 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 102.403 -3.184 . . . . 10.0 102.403 -179.817 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 5.1 mt -132.81 129.55 58.25 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.722 0 N-CA-C 112.931 0.715 . . . . 10.0 112.931 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -134.0 164.32 27.58 Favored 'General case' 0 C--O 1.216 -0.7 0 N-CA-C 108.033 -1.099 . . . . 10.0 108.033 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -157.61 77.21 0.83 Allowed 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 101.041 -3.689 . . . . 10.0 101.041 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 1.8 m-30 -91.59 -178.07 4.97 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 117.212 2.301 . . . . 10.0 117.212 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -132.69 145.04 50.72 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 107.099 -1.445 . . . . 10.0 107.099 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 95.3 t -81.74 85.41 1.63 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.207 0 O-C-N 124.669 1.231 . . . . 10.0 113.335 -179.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 110.16 55.21 0.54 Allowed Glycine 0 C--O 1.221 -0.676 0 C-N-CA 120.547 -0.835 . . . . 10.0 113.367 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 34.4 ttmt -157.93 138.46 12.85 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-N 118.663 1.231 . . . . 10.0 112.6 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -78.2 123.15 26.58 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-O 123.197 1.475 . . . . 10.0 110.142 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -106.54 178.04 4.68 Favored 'General case' 0 C--O 1.244 0.79 0 CA-C-N 112.737 -2.028 . . . . 10.0 108.444 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -145.84 81.82 1.61 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 113.265 -1.789 . . . . 10.0 109.439 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -75.31 139.99 42.82 Favored 'General case' 0 C--O 1.219 -0.545 0 O-C-N 124.768 1.293 . . . . 10.0 112.068 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -112.32 70.88 0.72 Allowed 'General case' 0 N--CA 1.456 -0.154 0 CA-C-O 124.082 1.896 . . . . 10.0 106.007 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.434 HD22 ' HA ' ' A' ' 74' ' ' LEU . 0.2 OUTLIER -65.63 129.96 41.61 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 123.789 1.757 . . . . 10.0 111.625 179.778 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -135.19 65.75 1.55 Allowed 'General case' 0 CA--C 1.51 -0.589 0 N-CA-C 105.806 -1.924 . . . . 10.0 105.806 179.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -159.5 -178.89 33.91 Favored Glycine 0 N--CA 1.438 -1.207 0 CA-C-O 117.334 -1.814 . . . . 10.0 109.705 -179.621 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.631 HD13 ' N ' ' A' ' 77' ' ' ILE . 0.0 OUTLIER 37.7 -93.99 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.51 -0.589 0 O-C-N 127.179 2.34 . . . . 10.0 110.035 -179.848 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -87.94 -31.19 19.55 Favored 'General case' 0 CA--C 1.51 -0.578 0 N-CA-C 114.963 1.468 . . . . 10.0 114.963 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.4 t0 77.91 116.25 0.06 Allowed 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 127.451 2.3 . . . . 10.0 113.587 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 3.6 mtt180 169.15 161.96 0.05 Allowed 'General case' 0 C--N 1.315 -0.899 0 O-C-N 120.676 -1.265 . . . . 10.0 109.152 -179.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.04 165.78 11.22 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 108.802 -0.814 . . . . 10.0 108.802 -179.732 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -135.13 -174.8 3.71 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 122.522 1.153 . . . . 10.0 110.179 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -145.86 44.49 1.27 Allowed 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 101.44 -3.541 . . . . 10.0 101.44 179.868 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.41 ' HA ' ' HA ' ' A' ' 97' ' ' GLN . 0.9 OUTLIER -42.14 150.13 0.13 Allowed 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 118.931 2.937 . . . . 10.0 118.931 179.869 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 87.6 m -139.16 104.36 4.99 Favored 'General case' 0 CA--C 1.506 -0.746 0 N-CA-C 104.785 -2.302 . . . . 10.0 104.785 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -91.53 107.02 18.26 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.068 0 N-CA-C 102.795 -3.039 . . . . 10.0 102.795 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 15.6 p -139.97 135.41 32.73 Favored 'General case' 0 C--O 1.243 0.724 0 C-N-CA 119.001 -1.08 . . . . 10.0 111.562 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -65.94 110.74 3.01 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-O 123.072 1.415 . . . . 10.0 108.21 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -84.96 -24.12 28.47 Favored 'General case' 0 C--O 1.248 1.001 0 N-CA-C 102.76 -3.052 . . . . 10.0 102.76 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 146.05 70.74 0.02 OUTLIER Glycine 0 C--N 1.317 -0.525 0 N-CA-C 103.175 -3.97 . . . . 10.0 103.175 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 86.56 -57.23 0.06 Allowed 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 124.812 1.245 . . . . 10.0 108.113 -179.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.7 ttpp -55.86 105.29 0.17 Allowed 'General case' 0 C--O 1.236 0.36 0 N-CA-C 106.112 -1.81 . . . . 10.0 106.112 -179.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.524 HD13 ' CZ ' ' A' ' 4' ' ' PHE . 4.2 tp -67.97 99.48 0.86 Allowed 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 103.935 -2.617 . . . . 10.0 103.935 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -88.44 113.62 24.22 Favored 'General case' 0 C--O 1.218 -0.598 0 N-CA-C 114.858 1.429 . . . . 10.0 114.858 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 27.1 m -104.83 98.43 8.16 Favored 'General case' 0 N--CA 1.443 -0.787 0 O-C-N 126.044 2.09 . . . . 10.0 110.068 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -108.24 116.89 52.6 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 N-CA-C 105.061 -2.2 . . . . 10.0 105.061 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.41 ' HA ' ' HA ' ' A' ' 84' ' ' THR . 1.4 pt20 -110.45 118.4 36.16 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 126.727 2.517 . . . . 10.0 112.942 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 12.0 mtmt -74.61 119.53 18.92 Favored 'General case' 0 C--O 1.215 -0.754 0 O-C-N 124.276 0.985 . . . . 10.0 112.431 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -173.99 -160.69 22.72 Favored Glycine 0 C--N 1.338 0.669 0 N-CA-C 109.683 -1.367 . . . . 10.0 109.683 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -82.54 -172.15 3.88 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-O 116.204 -1.855 . . . . 10.0 111.568 179.86 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 81.05 -157.07 0.02 OUTLIER 'General case' 0 C--N 1.317 -0.84 0 O-C-N 127.087 2.742 . . . . 10.0 111.319 -179.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -136.29 -41.34 0.64 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.983 0.897 . . . . 10.0 113.087 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -97.61 1.39 60.02 Favored Glycine 0 CA--C 1.526 0.78 0 CA-C-O 116.108 -2.496 . . . . 10.0 117.041 -179.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 1.8 mtt180 -53.16 129.69 32.01 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 123.289 1.518 . . . . 10.0 109.692 -179.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 134.88 133.29 3.26 Favored Glycine 0 C--O 1.219 -0.829 0 CA-C-N 113.493 -1.685 . . . . 10.0 109.558 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -110.75 -169.47 1.46 Allowed 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 108.812 -0.81 . . . . 10.0 108.812 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -162.03 132.94 5.06 Favored 'General case' 0 C--O 1.211 -0.933 0 O-C-N 125.684 1.865 . . . . 10.0 108.713 -179.753 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -115.74 95.3 5.06 Favored 'General case' 0 C--N 1.316 -0.877 0 O-C-N 125.69 1.869 . . . . 10.0 109.846 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' TRP . . . . . 0.461 ' CD1' ' C ' ' A' ' 109' ' ' TRP . 1.3 t90 -109.73 114.18 27.56 Favored 'General case' 0 C--O 1.221 -0.414 0 CA-C-N 114.592 -1.185 . . . . 10.0 108.859 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.623 HG23 ' O ' ' A' ' 114' ' ' GLU . 88.3 mt -91.52 140.08 16.67 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 CA-C-N 113.412 -1.722 . . . . 10.0 114.041 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -116.67 64.45 0.71 Allowed 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 104.143 -2.54 . . . . 10.0 104.143 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 66.68 -119.24 11.93 Favored Glycine 0 N--CA 1.467 0.744 0 N-CA-C 108.294 -1.923 . . . . 10.0 108.294 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -63.15 -4.37 2.36 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 121.121 -1.223 . . . . 10.0 113.247 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.623 ' O ' HG23 ' A' ' 110' ' ' ILE . 10.3 mt-10 -118.14 156.66 28.32 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 119.388 0.994 . . . . 10.0 110.047 179.848 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.406 HD12 ' C ' ' A' ' 115' ' ' LEU . 0.2 OUTLIER -124.19 105.86 9.85 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 105.299 -2.111 . . . . 10.0 105.299 179.755 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 18.8 m80 -97.81 85.96 3.66 Favored 'General case' 0 CA--C 1.505 -0.788 0 O-C-N 119.55 -1.969 . . . . 10.0 109.049 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.82 115.15 24.05 Favored 'General case' 0 N--CA 1.447 -0.599 0 O-C-N 125.271 1.607 . . . . 10.0 110.869 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -117.16 90.68 3.39 Favored 'General case' 0 CA--C 1.498 -1.055 0 CA-C-O 118.47 -0.776 . . . . 10.0 111.264 -179.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 34.6 mtm -82.28 162.22 22.37 Favored 'General case' 0 CA--C 1.514 -0.414 0 C-N-CA 119.193 -1.003 . . . . 10.0 110.425 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 3.8 ttm180 -150.53 150.24 30.99 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 122.396 1.093 . . . . 10.0 112.38 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -166.62 124.75 1.39 Allowed 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 114.338 -1.301 . . . . 10.0 108.457 -179.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 53.58 34.74 19.25 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 117.952 2.575 . . . . 10.0 117.952 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 91.01 -6.97 81.69 Favored Glycine 0 C--N 1.336 0.546 0 N-CA-C 117.551 1.78 . . . . 10.0 117.551 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 15.1 t -108.72 117.97 55.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 CA-C-N 118.213 1.007 . . . . 10.0 112.469 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 22.7 m -92.37 119.28 31.76 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 126.009 2.068 . . . . 10.0 112.352 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -107.96 139.29 42.8 Favored 'General case' 0 C--N 1.322 -0.595 0 O-C-N 127.513 3.008 . . . . 10.0 106.175 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.42 149.58 34.98 Favored 'General case' 0 C--N 1.319 -0.745 0 C-N-CA 118.759 -1.176 . . . . 10.0 112.926 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -132.96 117.7 17.97 Favored 'General case' 0 C--N 1.318 -0.78 0 O-C-N 127.877 3.236 . . . . 10.0 109.509 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 38.9 t -78.39 87.42 1.1 Allowed 'Isoleucine or valine' 0 C--O 1.217 -0.636 0 C-N-CA 118.549 -1.26 . . . . 10.0 110.227 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -73.42 167.68 20.78 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 108.451 -0.944 . . . . 10.0 108.451 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.501 ' HB2' HD13 ' A' ' 11' ' ' LEU . 1.0 OUTLIER -139.04 88.25 2.27 Favored 'General case' 0 C--O 1.241 0.616 0 N-CA-C 106.343 -1.725 . . . . 10.0 106.343 -179.962 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 9.2 ttpt -61.67 98.82 0.1 Allowed 'General case' 0 C--N 1.32 -0.702 0 O-C-N 121.95 -0.469 . . . . 10.0 110.017 179.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . 0.492 ' CG1' ' CB ' ' A' ' 7' ' ' TYR . 9.5 p -43.96 -31.18 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 C-N-CA 124.76 1.224 . . . . 10.0 111.275 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 54.7 t-80 . . . . . 0 C--O 1.245 0.826 0 O-C-N 126.189 2.181 . . . . 10.0 110.981 -179.72 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.473 0.286 0 CA-C-O 122.366 0.902 . . . . 10.0 112.687 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 2.0 t -127.02 15.79 3.57 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-O 123.138 1.447 . . . . 10.0 111.371 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -70.92 112.65 7.26 Favored 'General case' 0 C--O 1.24 0.601 0 CA-C-N 113.927 -1.488 . . . . 10.0 110.715 -179.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.42 ' HB3' HG21 ' A' ' 42' ' ' ILE . 8.1 m-85 -74.08 -15.9 61.04 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 123.989 0.806 . . . . 10.0 112.652 179.747 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -58.01 115.38 2.84 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 122.493 1.14 . . . . 10.0 112.766 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -162.3 -101.33 0.16 Allowed Glycine 0 C--N 1.344 0.986 0 N-CA-C 118.87 2.308 . . . . 10.0 118.87 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.414 ' HA ' ' CE3' ' A' ' 8' ' ' TRP . 6.4 m-85 -167.9 163.28 13.85 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 102.535 -3.135 . . . . 10.0 102.535 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.566 ' CZ3' ' CG ' ' A' ' 41' ' ' GLU 0.285 29.6 p90 -144.41 -176.39 5.02 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 125.683 1.593 . . . . 10.0 113.51 -179.492 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 164.41 93.52 0.0 OUTLIER 'General case' 0 C--O 1.232 0.173 0 CA-C-N 111.984 -2.371 . . . . 10.0 107.999 179.3 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.402 ' HG3' ' HB3' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -41.68 153.36 0.06 Allowed 'General case' 0 C--N 1.311 -1.083 0 N-CA-C 115.164 1.542 . . . . 10.0 115.164 179.435 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.462 HD22 ' CG1' ' A' ' 129' ' ' VAL . 0.3 OUTLIER -118.61 -49.0 2.47 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 108.065 -1.087 . . . . 10.0 108.065 -179.976 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.8 t -161.76 164.36 29.01 Favored 'General case' 0 C--O 1.242 0.68 0 N-CA-C 115.079 1.511 . . . . 10.0 115.079 179.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -129.25 151.36 50.0 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 105.121 -2.177 . . . . 10.0 105.121 179.837 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -151.47 137.53 18.26 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 116.839 2.163 . . . . 10.0 116.839 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 74.1 m-20 55.56 19.97 3.54 Favored 'General case' 0 N--CA 1.444 -0.754 0 O-C-N 125.793 1.933 . . . . 10.0 112.657 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.421 ' CZ ' ' HA ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -69.01 -20.43 64.15 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 114.551 1.315 . . . . 10.0 114.551 179.723 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -78.58 -40.14 35.5 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 119.794 -1.816 . . . . 10.0 111.576 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -75.55 -20.89 58.35 Favored 'General case' 0 CA--C 1.51 -0.581 0 N-CA-C 108.256 -1.016 . . . . 10.0 108.256 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -72.93 -34.2 66.43 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 105.964 -1.865 . . . . 10.0 105.964 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 41.5 mt -78.81 -23.31 45.2 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 120.82 1.646 . . . . 10.0 108.858 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.5 ttm-85 -69.33 -30.39 68.43 Favored 'General case' 0 N--CA 1.447 -0.617 0 O-C-N 126.127 2.142 . . . . 10.0 108.652 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.86 -38.95 83.75 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 125.152 1.381 . . . . 10.0 110.923 -179.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 33.4 mt -75.9 -28.17 57.98 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 117.51 -1.233 . . . . 10.0 109.454 179.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.4 t70 78.51 45.96 0.06 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 126.762 2.539 . . . . 10.0 113.042 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 3.2 m -85.64 -162.65 0.08 OUTLIER 'Isoleucine or valine' 0 C--O 1.243 0.748 0 N-CA-C 106.998 -1.482 . . . . 10.0 106.998 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -93.4 170.83 9.32 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 116.599 2.074 . . . . 10.0 116.599 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.5 m -75.89 -35.46 29.99 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 CA-C-N 112.847 -1.979 . . . . 10.0 111.733 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.05 -34.19 74.79 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 122.884 1.326 . . . . 10.0 111.293 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.734 HD13 ' O ' ' A' ' 29' ' ' LEU . 1.7 tm? -76.9 -40.85 45.95 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.492 -1.231 . . . . 10.0 111.553 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.5 ttp85 -61.38 -29.08 69.69 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 125.432 1.493 . . . . 10.0 113.948 179.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.48 -41.47 39.37 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 106.495 -1.669 . . . . 10.0 106.495 179.75 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.452 HD13 ' HA ' ' A' ' 32' ' ' ILE . 2.1 mm -62.25 -40.57 88.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 O-C-N 120.204 -1.56 . . . . 10.0 112.196 -179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -73.79 -48.25 32.9 Favored 'General case' 0 N--CA 1.476 0.83 0 O-C-N 125.245 1.591 . . . . 10.0 110.943 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.421 ' HA ' ' CZ ' ' A' ' 16' ' ' PHE . 0.0 OUTLIER -67.79 175.24 3.09 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-O 115.381 -2.247 . . . . 10.0 107.976 179.085 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.412 ' N ' ' CG ' ' A' ' 34' ' ' ASN . 0.3 OUTLIER 84.0 -43.6 0.09 Allowed 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 114.957 1.466 . . . . 10.0 114.957 179.831 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.479 HD11 ' HB3' ' A' ' 57' ' ' PHE . 51.9 mt -83.79 152.13 24.81 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 126.626 2.454 . . . . 10.0 111.182 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.402 ' HB3' ' HG3' ' A' ' 10' ' ' MET . 6.9 mttt -125.52 96.22 39.06 Favored Pre-proline 0 C--N 1.318 -0.797 0 O-C-N 127.374 2.921 . . . . 10.0 107.132 -179.737 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -63.6 -170.35 0.11 Allowed 'Trans proline' 0 C--O 1.219 -0.447 0 O-C-N 124.806 1.95 . . . . 10.0 116.261 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.551 ' HB3' ' CD1' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -141.93 171.36 14.16 Favored 'General case' 0 C--O 1.235 0.33 0 O-C-N 126.665 2.478 . . . . 10.0 108.024 179.942 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.441 ' HB2' ' CZ ' ' A' ' 130' ' ' PHE . 0.8 OUTLIER -149.21 90.93 1.78 Allowed 'General case' 0 CA--C 1.498 -1.046 0 CA-C-O 123.63 1.681 . . . . 10.0 112.398 -179.698 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.566 ' CG ' ' CZ3' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -88.98 142.72 27.4 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 103.609 -2.737 . . . . 10.0 103.609 -179.793 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.42 HG21 ' HB3' ' A' ' 4' ' ' PHE . 7.7 mm -127.31 149.97 32.8 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.736 0 CA-C-N 119.403 1.001 . . . . 10.0 108.51 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.413 HG23 ' O ' ' A' ' 42' ' ' ILE . 16.9 t -153.82 132.43 2.95 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 N-CA-C 104.963 -2.236 . . . . 10.0 104.963 179.853 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -141.7 130.03 22.37 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 124.178 1.942 . . . . 10.0 107.397 179.625 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -88.8 -9.21 52.62 Favored 'General case' 0 C--N 1.313 -0.995 0 C-N-CA 126.399 1.88 . . . . 10.0 107.98 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 145.49 -96.1 0.18 Allowed Glycine 0 N--CA 1.468 0.786 0 O-C-N 127.333 2.896 . . . . 10.0 108.888 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -90.57 -23.67 20.8 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 118.555 1.177 . . . . 10.0 110.586 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.4 t-160 -85.51 116.8 24.03 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 104.447 -2.427 . . . . 10.0 104.447 179.866 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 58.3 ttp -101.81 147.11 26.88 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 113.637 -1.62 . . . . 10.0 114.179 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 31.9 mt -137.79 115.46 12.81 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.735 0 O-C-N 119.113 -2.242 . . . . 10.0 107.852 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.6 mp -105.89 127.63 60.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 105.415 -2.068 . . . . 10.0 105.415 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 83.4 mtt180 -116.33 138.48 51.29 Favored 'General case' 0 C--O 1.212 -0.88 0 O-C-N 126.687 2.492 . . . . 10.0 111.799 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.421 ' HB ' ' O ' ' A' ' 59' ' ' ASN . 5.8 m -131.19 134.28 46.33 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 100.547 -3.871 . . . . 10.0 100.547 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.2 mp -126.48 63.81 1.27 Allowed 'General case' 0 C--N 1.321 -0.636 1 N-CA-C 121.845 4.017 . . . . 10.0 121.845 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.3 m -84.57 153.05 23.47 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 105.376 -2.083 . . . . 10.0 105.376 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -63.54 -29.16 70.46 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 107.249 -1.389 . . . . 10.0 107.249 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.479 ' HB3' HD11 ' A' ' 36' ' ' LEU . 2.1 t80 -112.41 123.74 50.95 Favored 'General case' 0 C--O 1.243 0.76 0 O-C-N 125.831 1.957 . . . . 10.0 107.945 -179.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 53.53 91.67 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 113.813 1.042 . . . . 10.0 113.813 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.503 ' HB3' ' CD1' ' A' ' 61' ' ' ILE . 6.0 m-20 -58.32 -52.39 65.81 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 115.126 -0.943 . . . . 10.0 110.736 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER 76.42 84.95 0.09 Allowed 'General case' 0 C--N 1.311 -1.105 0 C-N-CA 126.325 1.85 . . . . 10.0 106.105 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.503 ' CD1' ' HB3' ' A' ' 59' ' ' ASN . 1.7 mp -105.75 135.54 43.55 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.81 0 O-C-N 120.834 -1.166 . . . . 10.0 110.33 -179.868 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 7.8 mtt -125.58 166.58 16.43 Favored 'General case' 0 C--O 1.214 -0.802 0 N-CA-C 107.692 -1.225 . . . . 10.0 107.692 179.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -146.02 89.61 1.9 Allowed 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 100.301 -3.963 . . . . 10.0 100.301 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.654 ' CD2' HG21 ' A' ' 86' ' ' VAL . 3.7 m-30 -100.63 157.43 16.68 Favored 'General case' 0 C--N 1.32 -0.714 0 O-C-N 126.168 2.168 . . . . 10.0 113.999 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -120.22 104.47 10.09 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 105.504 -2.035 . . . . 10.0 105.504 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.433 ' O ' HG12 ' A' ' 66' ' ' VAL . 1.7 t -59.48 113.12 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.921 0 CA-C-N 115.423 -0.808 . . . . 10.0 109.49 -179.678 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 103.2 22.01 9.56 Favored Glycine 0 C--O 1.224 -0.5 0 CA-C-O 117.613 -1.659 . . . . 10.0 114.98 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.1 tttm -140.95 159.36 42.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 121.055 2.428 . . . . 10.0 115.951 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.86 144.19 35.22 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 107.765 -1.198 . . . . 10.0 107.765 -179.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -144.02 98.69 3.26 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-O 123.543 1.639 . . . . 10.0 112.686 179.735 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -70.33 103.4 2.39 Favored 'General case' 0 C--O 1.22 -0.474 0 O-C-N 119.364 -2.085 . . . . 10.0 105.639 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.458 ' HB3' ' HG ' ' A' ' 74' ' ' LEU . 3.5 mt-10 -75.86 -34.39 60.04 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-O 117.214 -1.374 . . . . 10.0 114.342 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 41.53 73.65 0.12 Allowed 'General case' 0 C--N 1.317 -0.816 0 O-C-N 126.409 2.318 . . . . 10.0 109.702 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.458 ' HG ' ' HB3' ' A' ' 72' ' ' GLU . 1.2 mt -95.55 126.77 41.07 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 115.742 1.756 . . . . 10.0 115.742 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 35.6 p -123.84 41.56 3.45 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 103.845 -2.65 . . . . 10.0 103.845 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -155.0 165.99 32.36 Favored Glycine 0 N--CA 1.446 -0.668 0 N-CA-C 109.733 -1.347 . . . . 10.0 109.733 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.472 HD13 ' N ' ' A' ' 77' ' ' ILE . 3.0 mm 64.21 -73.81 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 O-C-N 126.089 1.699 . . . . 10.0 107.772 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 23.7 p30 -139.09 39.02 2.12 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 117.548 -1.215 . . . . 10.0 108.567 179.635 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 4.26 91.16 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.646 0 O-C-N 127.523 3.014 . . . . 10.0 117.528 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.46 112.59 8.59 Favored 'General case' 0 CA--C 1.506 -0.726 0 CA-C-O 121.645 0.736 . . . . 10.0 112.828 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 7.3 pttt -80.25 121.54 25.76 Favored 'General case' 0 N--CA 1.438 -1.074 0 N-CA-C 103.515 -2.772 . . . . 10.0 103.515 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 28.2 p -153.21 -178.59 7.06 Favored 'General case' 0 C--O 1.216 -0.705 0 CA-C-N 114.906 -1.043 . . . . 10.0 108.204 -179.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.1 ptt? -130.48 132.78 45.83 Favored 'General case' 0 CA--C 1.505 -0.773 1 N-CA-C 99.003 -4.443 . . . . 10.0 99.003 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 25.6 m -132.64 120.71 22.12 Favored 'General case' 0 CA--C 1.505 -0.769 0 N-CA-C 118.179 2.659 . . . . 10.0 118.179 -179.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.12 118.6 36.83 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 112.313 -2.221 . . . . 10.0 108.471 -179.811 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.654 HG21 ' CD2' ' A' ' 64' ' ' PHE . 96.5 t -104.66 120.3 54.89 Favored 'Isoleucine or valine' 0 C--O 1.24 0.561 0 N-CA-C 105.795 -1.928 . . . . 10.0 105.795 -179.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -127.15 -159.14 0.91 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 123.94 1.829 . . . . 10.0 109.821 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 7.4 p-90 -148.77 123.59 9.93 Favored 'General case' 0 CA--C 1.51 -0.573 0 O-C-N 120.569 -1.332 . . . . 10.0 107.9 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -80.0 -38.33 32.33 Favored 'General case' 0 N--CA 1.447 -0.62 1 N-CA-C 98.862 -4.495 . . . . 10.0 98.862 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 134.4 126.81 2.67 Favored Glycine 0 N--CA 1.44 -1.034 0 N-CA-C 103.857 -3.697 . . . . 10.0 103.857 -179.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 58.14 20.44 7.01 Favored 'General case' 0 N--CA 1.468 0.426 0 O-C-N 120.706 -1.467 . . . . 10.0 110.247 179.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 5.0 ttpt -156.7 143.47 18.55 Favored 'General case' 0 C--N 1.341 0.211 0 O-C-N 125.879 1.987 . . . . 10.0 108.501 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 2.9 tp -111.45 82.94 1.69 Allowed 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 106.137 -1.801 . . . . 10.0 106.137 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -86.79 145.31 26.67 Favored 'General case' 0 CA--C 1.505 -0.769 0 O-C-N 119.716 -1.865 . . . . 10.0 111.303 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -144.07 141.72 30.23 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-N 114.392 -1.277 . . . . 10.0 109.777 179.75 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 1.6 t -122.62 142.71 38.08 Favored 'Isoleucine or valine' 0 C--O 1.242 0.702 0 N-CA-C 105.217 -2.142 . . . . 10.0 105.217 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 31.3 mt-30 -125.15 100.01 6.36 Favored 'General case' 0 C--O 1.246 0.881 0 CA-C-N 114.074 -1.421 . . . . 10.0 112.247 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 28.8 mmtt -63.45 113.49 3.3 Favored 'General case' 0 CA--C 1.505 -0.77 0 N-CA-C 115.396 1.628 . . . . 10.0 115.396 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -145.99 -114.11 0.85 Allowed Glycine 0 C--O 1.217 -0.953 0 C-N-CA 118.584 -1.769 . . . . 10.0 113.357 -179.651 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 18.8 tp10 -126.8 -9.02 6.1 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 115.348 1.611 . . . . 10.0 115.348 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 21.5 mmtt -107.57 158.26 17.38 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 117.699 2.481 . . . . 10.0 117.699 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -51.55 -63.07 1.25 Allowed 'General case' 0 C--O 1.238 0.48 0 O-C-N 119.674 -1.891 . . . . 10.0 109.948 -179.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -78.09 -82.76 0.6 Allowed Glycine 0 CA--C 1.505 -0.558 0 C-N-CA 121.14 -0.552 . . . . 10.0 114.143 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 46.2 81.85 0.04 OUTLIER 'General case' 0 N--CA 1.44 -0.956 0 CA-C-O 124.524 2.107 . . . . 10.0 114.398 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 179.23 174.57 45.46 Favored Glycine 0 C--O 1.219 -0.841 0 CA-C-N 112.686 -2.052 . . . . 10.0 111.191 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' TRP . . . . . 0.673 ' CE3' HD11 ' A' ' 117' ' ' LEU . 15.5 m0 -123.02 144.47 49.24 Favored 'General case' 0 C--O 1.217 -0.613 0 N-CA-C 108.077 -1.083 . . . . 10.0 108.077 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -131.1 133.34 45.55 Favored 'General case' 0 C--O 1.21 -0.979 0 N-CA-C 106.252 -1.759 . . . . 10.0 106.252 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.484 ' NE2' HD13 ' A' ' 115' ' ' LEU . 9.5 tp60 -141.97 112.79 7.32 Favored 'General case' 0 C--N 1.323 -0.569 0 O-C-N 125.706 1.879 . . . . 10.0 113.462 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -126.46 104.11 7.98 Favored 'General case' 0 C--O 1.212 -0.89 0 CA-C-O 122.929 1.347 . . . . 10.0 112.102 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 14.6 mt -55.21 109.29 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 112.968 -1.924 . . . . 10.0 112.614 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -96.46 -175.96 3.49 Favored 'General case' 0 C--N 1.333 -0.123 0 O-C-N 126.685 2.491 . . . . 10.0 106.865 -179.745 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -52.5 94.31 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.638 0 O-C-N 126.103 2.127 . . . . 10.0 111.378 179.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 44.86 33.42 0.99 Allowed 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 123.555 1.645 . . . . 10.0 111.669 -179.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -139.39 124.17 18.56 Favored 'General case' 0 C--O 1.241 0.613 0 N-CA-C 115.539 1.681 . . . . 10.0 115.539 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.484 HD13 ' NE2' ' A' ' 108' ' ' GLN . 0.5 OUTLIER -84.96 125.51 32.74 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 103.643 -2.725 . . . . 10.0 103.643 179.797 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -129.13 91.62 3.23 Favored 'General case' 0 N--CA 1.445 -0.689 0 O-C-N 121.784 -0.573 . . . . 10.0 110.239 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.673 HD11 ' CE3' ' A' ' 106' ' ' TRP . 1.1 tp -95.79 122.17 38.29 Favored 'General case' 0 N--CA 1.442 -0.857 0 O-C-N 124.988 1.43 . . . . 10.0 110.722 179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -122.23 108.0 12.79 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 117.999 -1.0 . . . . 10.0 109.085 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -98.32 136.51 38.39 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 118.571 0.623 . . . . 10.0 112.124 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -113.65 146.63 39.48 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 113.022 0.749 . . . . 10.0 113.022 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -162.44 113.54 1.56 Allowed 'General case' 0 C--N 1.32 -0.699 0 O-C-N 125.527 1.767 . . . . 10.0 109.639 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 52.72 46.7 26.23 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 117.279 -1.343 . . . . 10.0 112.899 179.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 74.13 14.49 80.45 Favored Glycine 0 N--CA 1.469 0.888 0 O-C-N 125.72 1.888 . . . . 10.0 117.205 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 97.3 t -116.31 112.98 41.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 N-CA-C 106.974 -1.491 . . . . 10.0 106.974 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 37.0 m -90.97 87.65 6.7 Favored 'General case' 0 N--CA 1.444 -0.736 0 O-C-N 125.169 1.543 . . . . 10.0 114.508 179.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 8.6 t -76.31 136.28 39.58 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 105.148 -2.168 . . . . 10.0 105.148 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -127.46 157.46 40.0 Favored 'General case' 0 N--CA 1.474 0.773 0 O-C-N 125.284 1.615 . . . . 10.0 112.055 -179.61 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -140.38 97.1 3.15 Favored 'General case' 0 CA--C 1.503 -0.846 0 CA-C-O 122.478 1.132 . . . . 10.0 110.044 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.462 ' CG1' HD22 ' A' ' 11' ' ' LEU . 40.7 t -72.93 129.09 36.11 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 O-C-N 120.62 -1.3 . . . . 10.0 107.92 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . 0.441 ' CZ ' ' HB2' ' A' ' 40' ' ' LYS . 0.6 OUTLIER -128.21 160.13 33.05 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 113.614 -1.63 . . . . 10.0 110.218 179.776 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.448 ' CG ' HD11 ' A' ' 11' ' ' LEU . 4.4 mmtt -132.54 127.78 35.87 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 105.817 -1.92 . . . . 10.0 105.817 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 12.7 tttt -90.7 102.84 15.59 Favored 'General case' 0 C--O 1.219 -0.536 0 O-C-N 125.178 1.549 . . . . 10.0 108.904 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . 0.43 ' H ' HG23 ' A' ' 133' ' ' VAL . 16.5 t -41.83 -55.17 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 127.491 2.994 . . . . 10.0 114.257 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.445 -0.699 0 O-C-N 125.508 1.755 . . . . 10.0 111.463 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 99.9 Cg_exo . . . . . 0 C--O 1.239 0.54 0 CA-C-O 118.052 -0.895 . . . . 10.0 111.23 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.431 ' O ' HG13 ' A' ' 2' ' ' VAL . 4.7 p -86.0 124.11 40.01 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.784 0 CA-C-O 117.904 -1.046 . . . . 10.0 111.532 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -131.28 114.72 15.37 Favored 'General case' 0 C--O 1.241 0.615 0 O-C-N 124.776 1.297 . . . . 10.0 108.936 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.541 ' CD1' ' CD1' ' A' ' 110' ' ' ILE . 20.8 m-30 -59.0 -14.85 10.52 Favored 'General case' 0 C--O 1.22 -0.486 0 N-CA-C 112.828 0.677 . . . . 10.0 112.828 -179.751 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.49 124.9 21.55 Favored 'General case' 0 C--O 1.244 0.765 0 N-CA-C 114.347 1.24 . . . . 10.0 114.347 -179.704 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -155.91 -105.39 0.23 Allowed Glycine 0 CA--C 1.532 1.106 0 C-N-CA 118.447 -1.835 . . . . 10.0 116.198 -179.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -166.11 166.38 17.14 Favored 'General case' 0 C--O 1.241 0.619 0 N-CA-C 102.445 -3.169 . . . . 10.0 102.445 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.529 ' CZ3' ' HB2' ' A' ' 41' ' ' GLU 0.302 18.1 p90 -144.3 -173.71 4.1 Favored 'General case' 0 C--N 1.314 -0.942 0 C-N-CA 126.591 1.957 . . . . 10.0 113.458 179.964 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.59 ' HD2' HG22 ' A' ' 133' ' ' VAL . 0.0 OUTLIER 162.5 72.71 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.575 0 O-C-N 127.428 2.955 . . . . 10.0 106.271 177.757 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.414 ' CE ' ' HB2' ' A' ' 37' ' ' LYS . 0.0 OUTLIER 0.51 -58.46 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.924 0 O-C-N 127.697 3.123 . . . . 10.0 117.57 -179.459 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.449 ' N ' ' O ' ' A' ' 9' ' ' LYS . 0.2 OUTLIER 81.71 -58.17 0.24 Allowed 'General case' 0 C--O 1.246 0.92 0 C-N-CA 127.421 2.288 . . . . 10.0 107.671 179.83 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -163.71 159.3 21.34 Favored 'General case' 0 C--N 1.323 -0.574 0 O-C-N 125.178 1.549 . . . . 10.0 114.114 179.844 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 4.6 p-10 -157.57 164.16 37.59 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 112.429 -2.169 . . . . 10.0 108.291 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -144.31 -178.92 6.21 Favored 'General case' 0 C--O 1.219 -0.515 0 O-C-N 125.623 1.827 . . . . 10.0 111.88 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 28.09 44.13 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.555 0 O-C-N 126.458 2.349 . . . . 10.0 114.119 179.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -72.13 -45.79 59.16 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-O 117.88 -1.057 . . . . 10.0 110.608 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -78.4 -22.51 47.69 Favored 'General case' 0 C--O 1.218 -0.567 0 CA-C-O 123.488 1.613 . . . . 10.0 110.358 179.82 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -76.55 -27.06 55.77 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 123.499 1.619 . . . . 10.0 107.11 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -77.25 -33.65 55.98 Favored 'General case' 0 CA--C 1.55 0.947 0 CA-C-N 113.475 -1.693 . . . . 10.0 110.49 -179.856 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 83.5 mt -70.55 -31.28 68.27 Favored 'General case' 0 C--O 1.215 -0.712 0 O-C-N 124.501 1.126 . . . . 10.0 110.561 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.56 -22.77 58.83 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 114.972 -1.013 . . . . 10.0 110.383 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.93 -31.34 67.92 Favored 'General case' 0 C--O 1.214 -0.807 0 CA-C-N 119.154 0.888 . . . . 10.0 112.287 179.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.8 mt -92.26 -21.36 20.37 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 124.658 1.224 . . . . 10.0 109.175 179.568 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 34.9 t0 76.98 49.36 0.05 Allowed 'General case' 0 C--O 1.244 0.788 0 N-CA-C 115.849 1.796 . . . . 10.0 115.849 -179.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 33.1 m -80.12 -179.2 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.815 0 O-C-N 118.716 -2.49 . . . . 10.0 108.406 179.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -60.54 155.48 18.48 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 119.093 -1.043 . . . . 10.0 111.769 179.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.6 m -75.91 -26.09 17.51 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.921 0 N-CA-C 116.834 2.161 . . . . 10.0 116.834 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -77.52 -25.26 50.09 Favored 'General case' 0 C--O 1.243 0.755 0 O-C-N 121.047 -1.033 . . . . 10.0 109.866 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.38 -31.14 65.33 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 114.625 -1.171 . . . . 10.0 111.757 -179.693 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.4 ttm180 -68.39 -33.3 74.0 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 125.791 1.636 . . . . 10.0 110.223 179.667 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -74.39 -40.29 62.15 Favored 'General case' 0 CA--C 1.508 -0.65 0 CA-C-N 113.168 -1.833 . . . . 10.0 111.535 -179.746 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.468 HG21 ' CE1' ' A' ' 57' ' ' PHE . 0.4 OUTLIER -73.58 -52.57 20.74 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 CA-C-O 122.471 1.129 . . . . 10.0 112.975 179.968 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -56.06 -21.8 23.96 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 112.511 -2.131 . . . . 10.0 112.659 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -66.87 -47.67 71.16 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-O 118.231 -0.89 . . . . 10.0 112.656 -179.742 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.422 ' O ' HD12 ' A' ' 35' ' ' LEU . 1.2 pp -73.01 -2.53 21.48 Favored 'General case' 0 CA--C 1.517 -0.303 0 O-C-N 125.091 1.494 . . . . 10.0 114.088 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -103.66 156.04 18.1 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 122.928 1.347 . . . . 10.0 112.748 179.504 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.414 ' HB2' ' CE ' ' A' ' 10' ' ' MET . 17.4 mttt -140.32 126.94 12.08 Favored Pre-proline 0 N--CA 1.466 0.347 0 N-CA-C 105.689 -1.967 . . . . 10.0 105.689 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_exo -86.27 153.14 9.4 Favored 'Trans proline' 0 CA--C 1.538 0.715 0 C-N-CA 124.836 3.69 . . . . 10.0 116.632 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.48 ' HB2' ' NE1' ' A' ' 8' ' ' TRP . 0.5 OUTLIER -114.63 166.74 11.41 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 125.571 1.548 . . . . 10.0 106.974 179.872 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.4 ttmt -161.36 104.93 1.27 Allowed 'General case' 0 CA--C 1.496 -1.103 0 C-N-CA 116.697 -2.001 . . . . 10.0 112.148 -179.643 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.529 ' HB2' ' CZ3' ' A' ' 8' ' ' TRP . 27.6 tt0 -94.79 135.64 36.04 Favored 'General case' 0 C--O 1.24 0.556 0 N-CA-C 102.41 -3.182 . . . . 10.0 102.41 179.881 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.435 HG23 HD12 ' A' ' 51' ' ' ILE . 62.4 mt -120.62 150.78 23.42 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 CA-C-N 120.291 1.405 . . . . 10.0 109.319 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -141.84 127.19 17.87 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 N-CA-C 103.898 -2.63 . . . . 10.0 103.898 -179.882 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -132.62 103.52 6.18 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 125.203 1.564 . . . . 10.0 110.953 -179.757 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -69.45 -63.05 1.14 Allowed 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 106.262 -1.755 . . . . 10.0 106.262 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -163.67 -78.75 0.03 OUTLIER Glycine 0 CA--C 1.532 1.108 0 N-CA-C 109.614 -1.394 . . . . 10.0 109.614 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -107.24 53.71 0.69 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 123.351 1.548 . . . . 10.0 109.089 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -163.43 168.52 20.16 Favored 'General case' 0 C--O 1.215 -0.733 0 N-CA-C 105.041 -2.207 . . . . 10.0 105.041 -179.846 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.481 ' HE1' HD21 ' A' ' 93' ' ' LEU . 6.6 ttp -163.41 102.54 0.95 Allowed 'General case' 0 C--O 1.216 -0.659 0 O-C-N 126.112 2.132 . . . . 10.0 112.317 179.66 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.592 HD12 ' N ' ' A' ' 50' ' ' ILE . 2.3 mp -93.98 100.6 11.43 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.759 0 O-C-N 124.483 1.115 . . . . 10.0 108.177 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.466 ' N ' HD13 ' A' ' 51' ' ' ILE . 0.4 OUTLIER -95.59 114.82 33.12 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.805 0 CA-C-O 123.722 1.725 . . . . 10.0 106.745 -179.897 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -115.03 125.97 54.19 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 112.926 -1.943 . . . . 10.0 111.843 179.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 26.7 m -112.32 121.71 45.66 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 100.908 -3.738 . . . . 10.0 100.908 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.9 mt -94.64 12.82 26.3 Favored 'General case' 0 CA--C 1.513 -0.467 0 N-CA-C 121.597 3.925 . . . . 10.0 121.597 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.2 p -68.19 129.08 38.86 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 103.908 -2.627 . . . . 10.0 103.908 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -83.32 156.53 23.0 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 107.869 -1.16 . . . . 10.0 107.869 -179.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.468 ' CE1' HG21 ' A' ' 32' ' ' ILE . 3.9 t80 83.75 10.77 0.46 Allowed 'General case' 0 C--N 1.324 -0.506 0 O-C-N 126.468 2.355 . . . . 10.0 105.308 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.759 ' HG2' HD11 ' A' ' 77' ' ' ILE . 5.7 mtp85 -151.45 -69.01 0.17 Allowed 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 126.066 1.747 . . . . 10.0 111.235 -179.795 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 24.49 88.91 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.775 0 O-C-N 128.441 3.588 . . . . 10.0 112.139 179.66 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 46.3 p90 -121.78 148.85 44.14 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 106.86 -1.533 . . . . 10.0 106.86 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.417 HG22 ' N ' ' A' ' 62' ' ' MET . 3.2 mp -133.27 158.87 43.14 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.869 0 N-CA-C 112.475 0.546 . . . . 10.0 112.475 180.0 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.417 ' N ' HG22 ' A' ' 61' ' ' ILE . 0.7 OUTLIER -141.86 158.31 43.94 Favored 'General case' 0 C--O 1.215 -0.715 0 N-CA-C 107.031 -1.47 . . . . 10.0 107.031 -179.672 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 29.9 t0 -125.63 77.73 1.68 Allowed 'General case' 0 N--CA 1.441 -0.876 0 N-CA-C 104.279 -2.489 . . . . 10.0 104.279 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 8.4 m-30 -76.8 177.03 7.95 Favored 'General case' 0 C--O 1.242 0.686 0 N-CA-C 115.898 1.814 . . . . 10.0 115.898 -179.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 56.5 mt-30 -151.61 123.65 8.14 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 125.038 1.461 . . . . 10.0 108.089 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 53.2 t -58.16 137.79 19.96 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 C-N-CA 125.848 1.659 . . . . 10.0 109.156 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 65.74 9.89 47.59 Favored Glycine 0 N--CA 1.439 -1.108 0 CA-C-O 118.418 -1.212 . . . . 10.0 114.506 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.06 165.58 12.49 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 120.714 2.257 . . . . 10.0 112.442 179.668 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -122.34 149.11 44.22 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 108.09 -1.078 . . . . 10.0 108.09 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -152.38 -170.66 3.7 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 122.98 1.371 . . . . 10.0 110.528 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -143.73 110.38 5.56 Favored 'General case' 0 C--N 1.319 -0.73 0 C-N-CA 119.139 -1.024 . . . . 10.0 110.468 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -95.8 72.77 3.07 Favored 'General case' 0 N--CA 1.441 -0.877 0 O-C-N 120.385 -1.447 . . . . 10.0 111.172 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.419 ' HA ' ' CB ' ' A' ' 81' ' ' LYS . 6.0 p-10 -44.59 137.33 3.86 Favored 'General case' 0 C--N 1.315 -0.929 0 O-C-N 128.945 3.903 . . . . 10.0 105.815 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.71 HD13 ' O ' ' A' ' 74' ' ' LEU . 0.8 OUTLIER 63.85 119.72 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 116.748 2.129 . . . . 10.0 116.748 -179.717 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.533 ' N ' HD22 ' A' ' 74' ' ' LEU . 1.7 m -104.6 102.42 12.03 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 106.794 -1.558 . . . . 10.0 106.794 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -57.9 101.35 0.18 Allowed Glycine 0 CA--C 1.531 1.054 0 CA-C-O 115.945 -2.586 . . . . 10.0 110.216 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.759 HD11 ' HG2' ' A' ' 58' ' ' ARG . 7.0 mt 134.32 -68.53 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.954 0 O-C-N 127.748 2.675 . . . . 10.0 109.81 179.522 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -103.41 8.29 38.03 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 112.908 0.707 . . . . 10.0 112.908 -179.526 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.404 ' N ' ' O ' ' A' ' 75' ' ' THR . 0.0 OUTLIER 44.02 -166.71 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 127.136 2.174 . . . . 10.0 116.472 -179.694 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.402 ' HG3' ' N ' ' A' ' 81' ' ' LYS . 0.0 OUTLIER 78.08 156.52 0.17 Allowed 'General case' 0 CA--C 1.505 -0.766 0 CA-C-O 122.35 1.072 . . . . 10.0 110.998 179.761 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.419 ' CB ' ' HA ' ' A' ' 73' ' ' ASP . 1.4 pttm -96.11 136.61 36.34 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 105.32 -2.104 . . . . 10.0 105.32 179.804 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -120.45 137.71 54.19 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 125.651 1.58 . . . . 10.0 107.481 179.701 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.3 mtp -100.95 91.48 4.6 Favored 'General case' 0 N--CA 1.441 -0.897 0 N-CA-C 102.926 -2.99 . . . . 10.0 102.926 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 68.7 m -91.83 129.13 37.85 Favored 'General case' 0 C--O 1.215 -0.761 0 N-CA-C 114.121 1.156 . . . . 10.0 114.121 179.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 40.9 m -127.2 118.02 23.48 Favored 'General case' 0 N--CA 1.44 -0.94 0 O-C-N 126.564 2.415 . . . . 10.0 104.594 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 22.9 m -91.42 -175.75 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 N-CA-C 104.084 -2.561 . . . . 10.0 104.084 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 172.2 132.76 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.86 0 O-C-N 124.256 0.973 . . . . 10.0 111.268 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . 0.627 ' CD1' ' HA ' ' A' ' 91' ' ' ASP . 0.7 OUTLIER -78.74 80.83 5.08 Favored 'General case' 0 C--O 1.22 -0.469 0 N-CA-C 105.209 -2.145 . . . . 10.0 105.209 179.873 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -95.22 105.47 17.41 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 103.986 -2.598 . . . . 10.0 103.986 179.777 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 67.13 31.62 78.13 Favored Glycine 0 CA--C 1.504 -0.608 0 N-CA-C 108.552 -1.819 . . . . 10.0 108.552 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.627 ' HA ' ' CD1' ' A' ' 88' ' ' TRP . 0.5 OUTLIER 73.81 -11.59 0.94 Allowed 'General case' 0 C--O 1.236 0.394 0 CA-C-N 119.694 1.747 . . . . 10.0 114.768 179.911 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.502 ' HD3' ' CZ3' ' A' ' 109' ' ' TRP . 11.0 pttm -90.45 151.76 21.25 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 106.797 -1.557 . . . . 10.0 106.797 -179.863 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.481 HD21 ' HE1' ' A' ' 49' ' ' MET . 0.2 OUTLIER -82.41 92.73 7.07 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 106.104 -1.813 . . . . 10.0 106.104 179.962 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -98.41 95.88 7.63 Favored 'General case' 0 C--O 1.214 -0.789 0 O-C-N 120.515 -1.366 . . . . 10.0 110.003 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 30.8 p -106.25 143.87 33.76 Favored 'General case' 0 CA--C 1.507 -0.693 0 CA-C-O 124.382 2.039 . . . . 10.0 114.102 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -123.02 138.91 51.44 Favored 'Isoleucine or valine' 0 C--O 1.245 0.827 0 N-CA-C 104.551 -2.389 . . . . 10.0 104.551 179.801 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -123.41 76.23 1.38 Allowed 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.33 1.019 . . . . 10.0 112.642 -179.802 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 3.5 mmmt -46.39 124.92 6.24 Favored 'General case' 0 CA--C 1.512 -0.492 0 N-CA-C 113.753 1.02 . . . . 10.0 113.753 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 172.34 62.48 0.04 OUTLIER Glycine 0 CA--C 1.501 -0.82 0 O-C-N 126.081 2.113 . . . . 10.0 112.337 179.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 75.88 -172.44 0.1 Allowed 'General case' 0 C--N 1.316 -0.864 0 O-C-N 126.433 1.902 . . . . 10.0 114.574 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 13.0 mmtt 65.34 -177.25 0.18 Allowed 'General case' 0 N--CA 1.442 -0.873 0 CA-C-O 123.689 1.709 . . . . 10.0 113.184 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -124.3 49.6 1.77 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 113.519 -1.673 . . . . 10.0 114.231 179.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 153.21 36.59 0.03 OUTLIER Glycine 0 C--O 1.218 -0.885 0 N-CA-C 118.814 2.285 . . . . 10.0 118.814 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 43.3 mtp180 -75.95 163.64 26.97 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 116.951 0.375 . . . . 10.0 110.11 179.592 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 119.29 144.54 7.38 Favored Glycine 0 N--CA 1.437 -1.27 0 C-N-CA 118.956 -1.592 . . . . 10.0 110.225 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 19.1 m0 -111.27 173.89 6.12 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-O 117.123 -1.418 . . . . 10.0 109.267 179.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 2.7 m -147.96 135.73 20.94 Favored 'General case' 0 C--O 1.209 -1.07 0 O-C-N 124.908 1.38 . . . . 10.0 108.384 179.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -120.56 131.25 54.57 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 125.758 1.911 . . . . 10.0 107.974 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' TRP . . . . . 0.502 ' CZ3' ' HD3' ' A' ' 92' ' ' LYS . 2.6 t-105 -146.37 124.87 12.4 Favored 'General case' 0 CA--C 1.5 -0.959 0 CA-C-O 122.453 1.121 . . . . 10.0 110.134 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.541 ' CD1' ' CD1' ' A' ' 4' ' ' PHE . 43.2 mt -99.16 124.6 52.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 116.281 1.956 . . . . 10.0 116.281 179.63 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -129.78 110.25 11.6 Favored 'General case' 0 CA--C 1.509 -0.611 0 O-C-N 126.318 2.261 . . . . 10.0 105.514 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 53.97 -104.4 0.23 Allowed Glycine 0 N--CA 1.459 0.227 0 N-CA-C 108.682 -1.767 . . . . 10.0 108.682 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -114.86 4.0 14.75 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 125.331 1.253 . . . . 10.0 110.683 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 73.5 tt0 -102.96 101.52 11.54 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 115.176 1.547 . . . . 10.0 115.176 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.648 HD12 ' C ' ' A' ' 115' ' ' LEU . 0.2 OUTLIER -67.48 107.65 2.54 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 103.574 -2.75 . . . . 10.0 103.574 179.764 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . 0.405 ' N ' HD12 ' A' ' 115' ' ' LEU . 0.3 OUTLIER -99.34 103.63 15.46 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 119.671 -1.893 . . . . 10.0 110.372 -179.902 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.856 HD21 ' CE ' ' A' ' 119' ' ' MET . 0.0 OUTLIER -103.73 143.06 33.3 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 124.228 1.966 . . . . 10.0 111.534 179.814 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -141.01 120.14 12.88 Favored 'General case' 0 CA--C 1.5 -0.98 0 O-C-N 120.507 -1.37 . . . . 10.0 108.758 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.856 ' CE ' HD21 ' A' ' 117' ' ' LEU . 3.5 mtm -95.53 -174.85 3.29 Favored 'General case' 0 N--CA 1.439 -1.007 0 N-CA-C 113.779 1.029 . . . . 10.0 113.779 179.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 9.2 tpt180 -167.84 129.8 1.51 Allowed 'General case' 0 N--CA 1.445 -0.695 0 O-C-N 124.238 0.961 . . . . 10.0 112.912 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . 0.614 ' O ' HG22 ' A' ' 124' ' ' VAL . . . -156.91 121.16 4.36 Favored 'General case' 0 CA--C 1.503 -0.832 0 CA-C-O 122.936 1.35 . . . . 10.0 110.037 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 59.99 14.52 4.39 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 124.022 1.868 . . . . 10.0 115.338 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 105.9 9.55 32.22 Favored Glycine 0 C--O 1.241 0.591 0 O-C-N 120.818 -1.176 . . . . 10.0 115.775 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.614 HG22 ' O ' ' A' ' 121' ' ' ALA . 20.1 m -101.69 164.32 3.05 Favored 'Isoleucine or valine' 0 C--O 1.239 0.539 0 CA-C-N 118.77 1.285 . . . . 10.0 110.061 179.776 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 1.3 m -131.41 108.67 9.78 Favored 'General case' 0 N--CA 1.447 -0.599 0 O-C-N 125.3 1.625 . . . . 10.0 114.558 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -111.47 137.45 49.26 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 104.753 -2.314 . . . . 10.0 104.753 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.88 166.98 23.15 Favored 'General case' 0 CA--C 1.509 -0.618 0 O-C-N 125.362 1.664 . . . . 10.0 114.913 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -139.99 163.76 31.83 Favored 'General case' 0 C--O 1.242 0.7 0 O-C-N 125.902 2.001 . . . . 10.0 108.665 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 6.9 m -125.98 66.95 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 N-CA-C 105.713 -1.958 . . . . 10.0 105.713 179.735 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . 0.528 ' HB3' ' HB3' ' A' ' 115' ' ' LEU . 0.1 OUTLIER -56.22 132.34 50.33 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 125.576 1.55 . . . . 10.0 109.309 -179.927 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 37.4 tptt -111.48 104.78 13.22 Favored 'General case' 0 C--O 1.242 0.68 0 N-CA-C 106.387 -1.708 . . . . 10.0 106.387 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 1.4 ttpt -73.72 97.62 2.74 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 105.467 -2.049 . . . . 10.0 105.467 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . 0.59 HG22 ' HD2' ' A' ' 9' ' ' LYS . 2.6 t -42.97 -31.9 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 124.546 1.154 . . . . 10.0 112.947 -179.865 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 10.1 t60 . . . . . 0 C--N 1.317 -0.837 0 O-C-N 127.372 2.92 . . . . 10.0 110.924 179.677 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo . . . . . 0 N--CA 1.482 0.848 0 CA-C-O 119.758 -0.184 . . . . 10.0 111.871 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 9.8 p -98.12 -30.37 3.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 O-C-N 126.617 2.448 . . . . 10.0 112.826 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.0 t0 71.67 147.87 0.08 Allowed 'General case' 0 C--N 1.328 -0.339 0 O-C-N 124.686 1.241 . . . . 10.0 111.268 179.723 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.524 ' HE2' HD13 ' A' ' 93' ' ' LEU . 2.2 m-85 -175.45 -49.38 0.01 OUTLIER 'General case' 0 C--O 1.244 0.776 0 N-CA-C 116.356 1.984 . . . . 10.0 116.356 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 35.0 t-20 -35.91 104.5 0.03 OUTLIER 'General case' 0 C--O 1.241 0.655 0 N-CA-C 115.659 1.726 . . . . 10.0 115.659 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -148.06 -137.04 2.83 Favored Glycine 0 C--O 1.217 -0.906 0 N-CA-C 117.61 1.804 . . . . 10.0 117.61 179.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 15.4 t80 -156.26 101.08 2.04 Favored 'General case' 0 C--O 1.242 0.691 0 N-CA-C 102.964 -2.976 . . . . 10.0 102.964 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.668 ' CE3' ' CE2' ' A' ' 130' ' ' PHE . 0.0 OUTLIER -90.59 121.93 32.95 Favored 'General case' 0 C--N 1.312 -1.04 0 N-CA-C 114.657 1.354 . . . . 10.0 114.657 -179.972 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.69 132.25 42.54 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 103.033 -2.951 . . . . 10.0 103.033 178.825 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.98 150.52 31.97 Favored 'General case' 0 C--N 1.312 -1.049 0 N-CA-C 116.386 1.995 . . . . 10.0 116.386 -179.419 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.9 tp -124.02 -59.21 1.51 Allowed 'General case' 0 CA--C 1.505 -0.778 0 CA-C-N 113.265 -1.789 . . . . 10.0 111.535 -179.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -131.73 172.38 12.34 Favored 'General case' 0 C--O 1.221 -0.413 0 N-CA-C 115.958 1.836 . . . . 10.0 115.958 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -161.57 135.32 6.62 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 111.375 -2.648 . . . . 10.0 109.037 179.814 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -107.05 -77.13 0.6 Allowed 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 115.818 1.784 . . . . 10.0 115.818 -179.828 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 36.1 m120 -96.4 58.51 1.77 Allowed 'General case' 0 C--N 1.32 -0.683 0 O-C-N 126.525 2.391 . . . . 10.0 111.389 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -70.06 -58.56 3.68 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 113.651 0.982 . . . . 10.0 113.651 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.614 ' HA ' HD12 ' A' ' 20' ' ' LEU . 64.3 mt-10 -67.86 -29.06 68.1 Favored 'General case' 0 C--O 1.243 0.719 0 C-N-CA 123.758 0.823 . . . . 10.0 112.74 -179.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -76.39 -23.33 54.08 Favored 'General case' 0 C--O 1.218 -0.561 0 C-N-CA 119.118 -1.033 . . . . 10.0 109.652 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -73.98 -41.91 61.24 Favored 'General case' 0 CA--C 1.557 1.235 0 C-N-CA 124.455 1.102 . . . . 10.0 109.146 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.614 HD12 ' HA ' ' A' ' 17' ' ' GLU . 1.8 mt -70.7 -28.27 64.62 Favored 'General case' 0 C--O 1.217 -0.645 0 O-C-N 126.35 2.281 . . . . 10.0 112.891 -179.839 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.8 ttm-85 -73.61 -29.3 62.28 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 113.464 -1.698 . . . . 10.0 108.517 -179.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.3 -29.89 67.85 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 120.625 -1.297 . . . . 10.0 113.678 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.4 HD21 ' HB1' ' A' ' 121' ' ' ALA . 20.4 mt -105.45 1.2 27.49 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 125.35 1.656 . . . . 10.0 114.529 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 43.64 82.83 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.01 0 O-C-N 126.158 2.161 . . . . 10.0 110.164 -179.757 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 15.5 m -113.79 46.02 0.31 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.54 0 CA-C-N 113.344 -1.753 . . . . 10.0 111.167 -179.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 65.44 138.47 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 114.676 1.361 . . . . 10.0 114.676 179.781 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 31.1 m -64.12 -31.26 52.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 117.181 2.289 . . . . 10.0 117.181 -179.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -73.64 -41.48 62.69 Favored 'General case' 0 C--O 1.245 0.85 0 CA-C-N 114.373 -1.285 . . . . 10.0 111.748 -179.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.406 HD11 HH12 ' A' ' 58' ' ' ARG . 0.5 OUTLIER -64.54 -34.73 78.92 Favored 'General case' 0 C--O 1.223 -0.333 0 C-N-CA 123.628 0.771 . . . . 10.0 112.646 -179.604 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.93 -33.41 51.73 Favored 'General case' 0 CA--C 1.542 0.636 0 O-C-N 125.074 1.484 . . . . 10.0 111.488 179.718 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 33.1 ttmt -77.67 -33.71 53.28 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 123.064 1.411 . . . . 10.0 108.502 179.347 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -78.28 -38.93 23.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 N-CA-C 108.446 -0.946 . . . . 10.0 108.446 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -73.15 -20.1 60.98 Favored 'General case' 0 C--N 1.317 -0.814 0 O-C-N 124.386 1.054 . . . . 10.0 110.314 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -77.35 -33.11 55.41 Favored 'General case' 0 C--N 1.32 -0.689 0 O-C-N 121.46 -0.775 . . . . 10.0 111.677 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 73.3 mt -95.0 31.79 1.8 Allowed 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 122.24 1.019 . . . . 10.0 108.611 179.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 10.3 tp -153.83 140.59 19.06 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.495 1.118 . . . . 10.0 109.35 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -122.02 119.43 28.8 Favored Pre-proline 0 N--CA 1.47 0.57 0 N-CA-C 105.348 -2.093 . . . . 10.0 105.348 179.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -76.43 111.49 3.27 Favored 'Trans proline' 0 N--CA 1.446 -1.313 1 C-N-CA 126.365 4.71 . . . . 10.0 118.925 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -83.41 122.01 27.93 Favored 'General case' 0 C--O 1.219 -0.518 0 N-CA-C 104.329 -2.471 . . . . 10.0 104.329 179.12 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.598 ' HE3' ' CH2' ' A' ' 8' ' ' TRP . 2.5 ttpt -104.62 131.84 51.56 Favored 'General case' 0 C--O 1.209 -1.067 0 CA-C-O 123.293 1.521 . . . . 10.0 112.905 -179.511 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -115.88 129.34 56.37 Favored 'General case' 0 C--O 1.239 0.522 0 N-CA-C 104.841 -2.281 . . . . 10.0 104.841 179.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.5 mt -102.76 144.62 13.42 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 C-N-CA 119.012 -1.075 . . . . 10.0 113.331 179.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 92.8 t -140.73 124.2 16.83 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.938 0 N-CA-C 104.427 -2.434 . . . . 10.0 104.427 179.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -111.04 154.19 24.56 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 108.718 -0.845 . . . . 10.0 108.718 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -131.75 53.71 1.98 Allowed 'General case' 0 C--O 1.236 0.359 0 CA-C-O 123.163 1.459 . . . . 10.0 107.352 179.834 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 77.03 -92.45 1.04 Allowed Glycine 0 C--N 1.339 0.708 0 N-CA-C 105.602 -2.999 . . . . 10.0 105.602 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -92.48 -49.2 6.25 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 108.138 -1.06 . . . . 10.0 108.138 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 43.4 m170 -60.52 141.73 56.18 Favored 'General case' 0 C--O 1.218 -0.581 0 CA-C-O 122.482 1.134 . . . . 10.0 108.556 179.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 33.1 ttp -135.1 141.95 46.15 Favored 'General case' 0 N--CA 1.437 -1.101 0 CA-C-N 113.635 -1.62 . . . . 10.0 111.493 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 3.2 mt -130.19 136.73 58.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 106.701 -1.592 . . . . 10.0 106.701 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.7 mm -119.93 105.36 17.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 122.998 1.38 . . . . 10.0 108.759 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.514 ' HB3' HD23 ' A' ' 54' ' ' LEU . 21.5 mtp85 -89.98 113.36 25.01 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 113.7 -1.591 . . . . 10.0 109.423 179.859 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.447 HG23 ' HE2' ' A' ' 40' ' ' LYS . 4.3 m -108.83 95.52 5.71 Favored 'General case' 0 C--O 1.239 0.543 0 N-CA-C 100.286 -3.968 . . . . 10.0 100.286 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.514 HD23 ' HB3' ' A' ' 52' ' ' ARG . 2.8 mm? -95.33 146.09 24.63 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 117.531 2.419 . . . . 10.0 117.531 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -159.19 174.49 14.77 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 113.008 -1.905 . . . . 10.0 106.898 179.817 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 19.9 p -95.47 -8.71 34.61 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 121.647 -0.658 . . . . 10.0 110.82 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 6.4 t80 -92.6 -50.33 5.66 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 124.996 1.319 . . . . 10.0 109.461 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.406 HH12 HD11 ' A' ' 29' ' ' LEU . 0.0 OUTLIER -162.89 -177.1 5.29 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 125.332 1.645 . . . . 10.0 111.052 179.714 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -138.68 156.83 47.08 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-O 124.276 1.989 . . . . 10.0 113.883 179.631 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -123.87 112.79 17.67 Favored 'General case' 0 C--O 1.211 -0.928 0 N-CA-C 104.904 -2.258 . . . . 10.0 104.904 179.827 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 19.9 mm -114.19 129.86 69.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 O-C-N 124.184 0.928 . . . . 10.0 110.65 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 3.0 mtt -130.19 156.3 44.82 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 107.134 -1.432 . . . . 10.0 107.134 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -141.43 75.13 1.48 Allowed 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 103.797 -2.668 . . . . 10.0 103.797 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.525 ' CD2' HG21 ' A' ' 86' ' ' VAL . 2.6 m-30 -76.66 162.87 27.38 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 114.378 1.251 . . . . 10.0 114.378 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -131.32 107.1 8.72 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 113.322 -1.763 . . . . 10.0 108.34 -179.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -64.29 135.19 28.31 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 N-CA-C 108.255 -1.017 . . . . 10.0 108.255 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 56.39 36.25 69.08 Favored Glycine 0 N--CA 1.437 -1.257 0 O-C-N 126.016 2.073 . . . . 10.0 117.254 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -156.42 139.23 15.21 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 115.256 1.576 . . . . 10.0 115.256 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -52.7 138.83 27.88 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-O 119.16 -0.448 . . . . 10.0 111.786 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -140.75 96.22 2.98 Favored 'General case' 0 C--O 1.243 0.753 0 CA-C-O 123.209 1.48 . . . . 10.0 113.02 179.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -74.86 137.82 42.06 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 105.003 -2.221 . . . . 10.0 105.003 -179.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -138.58 130.53 28.16 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 124.228 1.011 . . . . 10.0 113.288 -179.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 20.9 p-10 -104.6 118.42 36.53 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-O 125.233 2.444 . . . . 10.0 111.684 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -124.66 126.62 46.04 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 116.658 2.096 . . . . 10.0 116.658 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -144.04 104.68 4.17 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 107.955 -1.128 . . . . 10.0 107.955 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 140.66 -80.42 0.26 Allowed Glycine 0 N--CA 1.442 -0.951 0 C-N-CA 119.766 -1.207 . . . . 10.0 111.047 -179.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -84.74 96.18 4.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 N-CA-C 106.302 -1.74 . . . . 10.0 106.302 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.48 -19.33 0.4 Allowed 'General case' 0 C--O 1.243 0.741 0 N-CA-C 115.16 1.541 . . . . 10.0 115.16 -179.919 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.0 p30 49.75 -164.25 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 125.756 1.622 . . . . 10.0 114.733 -179.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 8.6 ttm-85 83.82 143.74 0.07 Allowed 'General case' 0 C--N 1.32 -0.7 0 O-C-N 125.303 1.627 . . . . 10.0 110.906 179.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 5.5 pttt -93.98 165.34 12.7 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 102.412 -3.181 . . . . 10.0 102.412 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -155.1 144.42 21.12 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 120.89 -1.131 . . . . 10.0 108.695 179.848 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 31.2 mtt -114.34 52.05 0.85 Allowed 'General case' 0 N--CA 1.439 -1.001 0 N-CA-C 102.865 -3.013 . . . . 10.0 102.865 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 50.2 m -52.23 126.09 17.84 Favored 'General case' 0 N--CA 1.442 -0.862 0 N-CA-C 117.44 2.385 . . . . 10.0 117.44 -179.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 9.3 m -125.46 112.74 16.61 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 103.668 -2.716 . . . . 10.0 103.668 179.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.525 HG21 ' CD2' ' A' ' 64' ' ' PHE . 31.6 t -85.06 159.55 3.34 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.594 0 N-CA-C 101.095 -3.669 . . . . 10.0 101.095 -179.805 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -156.0 165.75 35.53 Favored 'General case' 0 C--N 1.318 -0.789 0 O-C-N 125.022 1.451 . . . . 10.0 113.296 179.857 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . 0.465 ' CD1' ' C ' ' A' ' 88' ' ' TRP . 0.0 OUTLIER -115.41 125.37 53.06 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 105.308 -2.108 . . . . 10.0 105.308 179.922 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -142.77 103.75 4.25 Favored 'General case' 0 CA--C 1.506 -0.726 0 N-CA-C 101.559 -3.497 . . . . 10.0 101.559 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 74.63 -146.94 36.27 Favored Glycine 0 CA--C 1.501 -0.796 0 N-CA-C 109.271 -1.531 . . . . 10.0 109.271 179.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -97.32 20.32 11.73 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-O 122.446 1.117 . . . . 10.0 109.681 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 6.6 mtmm -104.58 -174.67 2.59 Favored 'General case' 0 CA--C 1.508 -0.647 0 O-C-N 120.741 -1.225 . . . . 10.0 109.633 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.524 HD13 ' HE2' ' A' ' 4' ' ' PHE . 8.1 tp -131.36 128.6 39.99 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 103.125 -2.917 . . . . 10.0 103.125 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 6.6 mp0 -128.07 125.66 39.71 Favored 'General case' 0 C--N 1.316 -0.873 0 O-C-N 124.941 1.401 . . . . 10.0 112.515 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -124.7 125.62 44.38 Favored 'General case' 0 C--N 1.321 -0.667 0 O-C-N 121.9 -0.5 . . . . 10.0 109.845 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 71.1 t -120.8 142.95 34.57 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 N-CA-C 107.326 -1.361 . . . . 10.0 107.326 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 11.2 mt-30 -126.47 146.31 50.15 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 117.702 -1.142 . . . . 10.0 110.983 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 25.6 mmtt -86.24 -96.95 0.08 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 117.426 -1.273 . . . . 10.0 110.183 -179.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 51.4 -166.52 0.75 Allowed Glycine 0 CA--C 1.503 -0.674 0 O-C-N 124.126 0.891 . . . . 10.0 111.307 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -82.13 -170.11 2.73 Favored 'General case' 0 N--CA 1.447 -0.603 0 N-CA-C 112.788 0.662 . . . . 10.0 112.788 179.747 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 4.3 mttm 71.18 -158.75 0.13 Allowed 'General case' 0 N--CA 1.442 -0.867 0 CA-C-O 122.878 1.323 . . . . 10.0 113.178 179.78 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -146.75 18.2 1.29 Allowed 'General case' 0 CA--C 1.506 -0.736 0 O-C-N 119.861 -1.775 . . . . 10.0 115.272 -179.845 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -156.55 27.12 0.53 Allowed Glycine 0 C--O 1.226 -0.386 0 N-CA-C 118.226 2.05 . . . . 10.0 118.226 -179.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 8.6 mtm180 -86.07 117.78 25.12 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 121.492 -1.005 . . . . 10.0 109.641 179.621 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 163.24 151.58 6.48 Favored Glycine 0 N--CA 1.437 -1.242 0 O-C-N 125.66 1.85 . . . . 10.0 110.57 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 1.8 m0 -114.1 161.27 17.97 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 108.035 -1.098 . . . . 10.0 108.035 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.9 m -142.31 131.23 23.0 Favored 'General case' 0 C--O 1.212 -0.92 0 O-C-N 124.628 1.205 . . . . 10.0 110.984 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.463 ' NE2' HD21 ' A' ' 115' ' ' LEU . 3.0 mt-30 -119.3 131.57 55.77 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.602 1.161 . . . . 10.0 109.603 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' TRP . . . . . 0.492 ' CD1' ' C ' ' A' ' 109' ' ' TRP . 0.0 OUTLIER -137.47 113.71 10.04 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 106.871 -1.529 . . . . 10.0 106.871 179.977 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -86.27 146.41 6.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 N-CA-C 116.38 1.992 . . . . 10.0 116.38 179.76 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -149.94 127.49 11.57 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-O 116.072 -1.918 . . . . 10.0 107.575 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 46.61 -129.23 11.37 Favored Glycine 0 CA--C 1.534 1.233 0 N-CA-C 106.24 -2.744 . . . . 10.0 106.24 179.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -95.51 29.11 2.68 Favored 'General case' 0 C--N 1.321 -0.659 0 O-C-N 124.829 0.958 . . . . 10.0 113.304 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -140.71 151.8 44.8 Favored 'General case' 0 C--O 1.24 0.595 0 CA-C-N 119.801 1.182 . . . . 10.0 111.634 179.855 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.655 ' HG ' ' CE2' ' A' ' 130' ' ' PHE . 0.7 OUTLIER -108.99 130.8 55.48 Favored 'General case' 0 C--N 1.316 -0.869 0 O-C-N 125.949 2.03 . . . . 10.0 108.992 179.882 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . 0.644 ' N ' HD12 ' A' ' 115' ' ' LEU . 13.0 m80 -111.59 98.77 7.67 Favored 'General case' 0 CA--C 1.503 -0.83 0 N-CA-C 108.369 -0.974 . . . . 10.0 108.369 -179.809 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 15.7 tp -80.49 121.9 26.34 Favored 'General case' 0 CA--C 1.51 -0.567 0 C-N-CA 118.141 -1.424 . . . . 10.0 113.606 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -113.34 88.13 2.76 Favored 'General case' 0 C--O 1.214 -0.79 0 N-CA-C 104.239 -2.504 . . . . 10.0 104.239 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.47 149.96 26.31 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-N 114.387 -1.278 . . . . 10.0 111.447 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 24.4 mtt180 -144.56 137.52 26.84 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 120.466 1.485 . . . . 10.0 114.237 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . 0.4 ' HB1' HD21 ' A' ' 23' ' ' LEU . . . -150.18 133.61 16.49 Favored 'General case' 0 CA--C 1.507 -0.701 0 N-CA-C 107.073 -1.454 . . . . 10.0 107.073 -179.84 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 40.74 44.73 1.93 Allowed 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 116.943 2.201 . . . . 10.0 116.943 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 91.95 -11.96 70.76 Favored Glycine 0 CA--C 1.533 1.201 0 O-C-N 120.711 -1.243 . . . . 10.0 115.935 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 92.7 t -90.28 154.74 3.13 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 N-CA-C 107.385 -1.339 . . . . 10.0 107.385 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 34.5 m -144.57 92.35 2.29 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-O 124.728 2.204 . . . . 10.0 111.062 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -79.93 144.18 33.58 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-N 112.847 -1.978 . . . . 10.0 106.615 -179.839 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.18 101.01 5.4 Favored 'General case' 0 CA--C 1.504 -0.818 0 O-C-N 125.127 1.517 . . . . 10.0 110.948 -179.806 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.79 156.47 18.02 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 122.715 1.245 . . . . 10.0 108.625 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 11.0 p -143.73 137.29 24.67 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-O 117.296 -1.335 . . . . 10.0 107.756 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . 0.668 ' CE2' ' CE3' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -138.61 -169.98 2.73 Favored 'General case' 0 C--N 1.315 -0.894 0 O-C-N 125.138 1.524 . . . . 10.0 108.751 -179.858 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . 0.287 16.3 tptp -142.97 129.43 20.08 Favored 'General case' 0 C--N 1.32 -0.714 0 O-C-N 119.362 -2.086 . . . . 10.0 105.962 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 11.5 mtpt -81.47 110.55 16.98 Favored 'General case' 0 CA--C 1.503 -0.84 0 CA-C-O 123.464 1.602 . . . . 10.0 111.856 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 2.5 t -92.53 -0.45 10.02 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 114.773 -1.103 . . . . 10.0 109.091 179.679 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 12.1 m80 . . . . . 0 N--CA 1.434 -1.271 0 CA-C-N 113.938 -1.483 . . . . 10.0 111.572 179.79 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.564 ' C ' HG23 ' A' ' 2' ' ' VAL . 10.3 Cg_endo . . . . . 0 N--CA 1.48 0.726 0 N-CA-C 115.044 1.132 . . . . 10.0 115.044 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.637 HG22 ' HA ' ' A' ' 91' ' ' ASP . 1.8 t 72.18 104.31 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.244 0.775 0 O-C-N 125.864 1.978 . . . . 10.0 109.0 179.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -150.55 81.03 1.35 Allowed 'General case' 0 CA--C 1.54 0.587 0 O-C-N 125.218 1.574 . . . . 10.0 108.934 179.671 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -70.73 -33.71 71.12 Favored 'General case' 0 C--O 1.224 -0.26 0 C-N-CA 125.653 1.581 . . . . 10.0 112.363 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 30.1 t-20 -46.38 94.49 0.01 OUTLIER 'General case' 0 C--O 1.243 0.711 0 O-C-N 124.613 1.196 . . . . 10.0 111.305 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -148.96 -114.23 0.73 Allowed Glycine 0 N--CA 1.443 -0.859 0 N-CA-C 119.2 2.44 . . . . 10.0 119.2 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -155.64 -166.37 2.21 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 104.912 -2.255 . . . . 10.0 104.912 -179.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.464 ' NE1' ' CB ' ' A' ' 39' ' ' ASP 0.359 41.9 p90 -157.93 -170.44 3.16 Favored 'General case' 0 C--N 1.311 -1.077 0 C-N-CA 125.228 1.411 . . . . 10.0 113.966 -178.104 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.501 ' HE3' ' CG1' ' A' ' 133' ' ' VAL . 5.7 ttmt 166.19 98.95 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 111.733 -2.485 . . . . 10.0 109.07 176.676 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.49 ' HA ' ' CD1' ' A' ' 130' ' ' PHE . 0.0 OUTLIER -53.85 137.49 38.43 Favored 'General case' 0 N--CA 1.442 -0.836 0 N-CA-C 115.72 1.748 . . . . 10.0 115.72 -179.746 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -108.65 -55.53 2.38 Favored 'General case' 0 C--O 1.246 0.878 0 N-CA-C 108.394 -0.965 . . . . 10.0 108.394 -179.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -169.24 145.62 3.39 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 123.646 1.688 . . . . 10.0 115.337 -179.985 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -119.17 157.31 28.2 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 111.407 -2.633 . . . . 10.0 104.094 179.735 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -152.58 170.86 19.16 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 117.353 -1.308 . . . . 10.0 111.711 179.867 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 47.87 38.19 8.58 Favored 'General case' 0 C--O 1.243 0.738 0 O-C-N 125.063 1.477 . . . . 10.0 111.699 -179.855 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -76.0 -33.67 59.7 Favored 'General case' 0 C--N 1.34 0.178 0 CA-C-N 114.342 -1.299 . . . . 10.0 114.328 -179.546 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -77.08 -34.88 56.93 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 122.344 1.069 . . . . 10.0 112.557 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -76.89 -25.37 52.96 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 113.754 -1.566 . . . . 10.0 109.124 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.408 ' HA ' HG11 ' A' ' 124' ' ' VAL . 2.6 t80 -65.91 -44.29 85.63 Favored 'General case' 0 CA--C 1.55 0.948 0 O-C-N 126.122 2.139 . . . . 10.0 110.01 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.803 HD12 ' HG2' ' A' ' 30' ' ' ARG . 19.6 mt -76.37 -23.58 54.14 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 119.578 1.081 . . . . 10.0 112.825 -179.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.43 -25.56 67.58 Favored 'General case' 0 C--O 1.244 0.807 0 O-C-N 125.479 1.737 . . . . 10.0 109.001 -179.752 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.7 -45.06 72.62 Favored 'General case' 0 N--CA 1.466 0.341 0 O-C-N 124.829 1.331 . . . . 10.0 111.47 -179.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.9 mt -85.07 -15.85 42.62 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 120.018 -1.676 . . . . 10.0 112.115 -179.669 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 19.3 t0 65.79 70.93 0.43 Allowed 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 114.642 1.349 . . . . 10.0 114.642 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.628 HG21 HD23 ' A' ' 29' ' ' LEU . 0.9 OUTLIER -103.65 167.34 2.64 Favored 'Isoleucine or valine' 0 C--N 1.344 0.367 0 N-CA-C 108.996 -0.742 . . . . 10.0 108.996 -179.825 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -51.57 160.02 0.68 Allowed 'General case' 0 C--O 1.244 0.77 0 O-C-N 125.148 1.53 . . . . 10.0 114.331 -179.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 39.3 t -76.18 -25.54 16.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 115.038 1.495 . . . . 10.0 115.038 -179.762 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -74.81 -33.62 62.24 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 114.482 -1.235 . . . . 10.0 112.629 179.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.628 HD23 HG21 ' A' ' 25' ' ' VAL . 13.1 tp -68.75 -26.25 65.14 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 122.003 0.906 . . . . 10.0 112.737 179.782 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.803 ' HG2' HD12 ' A' ' 20' ' ' LEU . 0.0 OUTLIER -77.54 -22.21 51.43 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 113.395 -1.729 . . . . 10.0 113.682 179.869 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.9 tptm -73.13 -46.72 49.49 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 124.621 1.168 . . . . 10.0 110.195 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.449 HG21 ' CE2' ' A' ' 57' ' ' PHE . 5.8 mm -61.69 -57.29 12.77 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 O-C-N 125.531 1.769 . . . . 10.0 111.498 -179.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -48.87 -66.23 0.43 Allowed 'General case' 0 C--N 1.319 -0.725 0 O-C-N 126.524 2.39 . . . . 10.0 113.255 179.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -59.74 83.3 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.453 0 O-C-N 119.481 -2.012 . . . . 10.0 115.194 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.511 HD12 HD23 ' A' ' 36' ' ' LEU . 0.8 OUTLIER 159.69 -29.87 0.0 OUTLIER 'General case' 0 N--CA 1.445 -0.696 0 O-C-N 125.407 1.692 . . . . 10.0 109.61 179.95 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.511 HD23 HD12 ' A' ' 35' ' ' LEU . 35.0 mt -79.39 145.21 33.5 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 119.581 -0.848 . . . . 10.0 112.964 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.2 mttt -129.89 103.11 17.36 Favored Pre-proline 0 N--CA 1.466 0.346 0 N-CA-C 107.129 -1.434 . . . . 10.0 107.129 -179.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 0.2 OUTLIER -82.66 155.5 15.85 Favored 'Trans proline' 0 N--CA 1.448 -1.198 1 C-N-CA 126.599 4.866 . . . . 10.0 117.384 179.999 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.464 ' CB ' ' NE1' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -107.86 159.4 16.55 Favored 'General case' 0 C--N 1.313 -0.984 0 O-C-N 128.661 3.725 . . . . 10.0 106.538 179.752 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.418 ' HG3' ' CZ ' ' A' ' 130' ' ' PHE . 2.4 mtpm? -144.82 109.98 5.15 Favored 'General case' 0 N--CA 1.435 -1.197 0 C-N-CA 117.837 -1.545 . . . . 10.0 113.54 -179.543 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.429 ' OE1' HG23 ' A' ' 43' ' ' VAL . 1.0 OUTLIER -96.19 146.71 24.46 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 102.602 -3.11 . . . . 10.0 102.602 179.086 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 13.0 mt -132.26 139.44 50.11 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 O-C-N 124.902 1.376 . . . . 10.0 111.007 179.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.429 HG23 ' OE1' ' A' ' 41' ' ' GLU . 49.5 t -132.18 114.04 22.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 113.03 -1.896 . . . . 10.0 106.248 179.742 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.448 ' HG2' ' CG ' ' A' ' 49' ' ' MET . 0.0 OUTLIER -115.86 135.17 54.25 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 108.043 -1.095 . . . . 10.0 108.043 179.603 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -142.52 101.29 3.85 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 107.148 -1.426 . . . . 10.0 107.148 -179.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 61.14 -121.33 26.09 Favored Glycine 0 C--O 1.243 0.717 0 CA-C-O 123.154 1.419 . . . . 10.0 110.228 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -103.01 37.49 1.95 Allowed 'General case' 0 N--CA 1.472 0.668 0 O-C-N 121.907 -0.761 . . . . 10.0 109.259 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 20.5 m80 -147.39 129.35 15.38 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 106.955 -1.498 . . . . 10.0 106.955 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.561 ' HE1' HD11 ' A' ' 93' ' ' LEU . 2.6 ttm -133.89 158.11 44.27 Favored 'General case' 0 C--O 1.215 -0.728 0 N-CA-C 114.279 1.215 . . . . 10.0 114.279 179.802 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.401 ' N ' ' HG2' ' A' ' 49' ' ' MET . 35.1 mt -134.19 136.48 53.25 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.98 0 N-CA-C 105.191 -2.152 . . . . 10.0 105.191 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.2 mp -122.18 143.86 33.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 N-CA-C 104.528 -2.397 . . . . 10.0 104.528 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 5.1 mtt180 -133.37 109.96 9.71 Favored 'General case' 0 C--O 1.212 -0.913 0 O-C-N 125.79 1.932 . . . . 10.0 115.295 -179.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.9 m -90.23 125.14 35.38 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 100.554 -3.869 . . . . 10.0 100.554 -179.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -120.2 33.56 5.55 Favored 'General case' 0 C--N 1.319 -0.723 1 N-CA-C 122.555 4.28 . . . . 10.0 122.555 -179.631 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 43.0 t -69.45 177.86 2.7 Favored 'General case' 0 C--N 1.323 -0.572 0 O-C-N 120.143 -1.598 . . . . 10.0 107.046 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.5 m -108.61 64.36 0.61 Allowed 'General case' 0 C--N 1.328 -0.356 0 O-C-N 125.819 1.949 . . . . 10.0 112.05 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.449 ' CE2' HG21 ' A' ' 32' ' ' ILE . 0.8 OUTLIER -173.47 -62.23 0.02 OUTLIER 'General case' 0 C--N 1.347 0.475 0 CA-C-N 113.758 -1.565 . . . . 10.0 107.504 -179.891 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 5.6 mtp180 -118.81 110.4 17.17 Favored 'General case' 0 C--N 1.328 -0.345 0 O-C-N 124.569 1.168 . . . . 10.0 112.412 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -114.71 91.44 3.62 Favored 'General case' 0 C--N 1.327 -0.381 0 O-C-N 124.807 1.317 . . . . 10.0 112.258 -179.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.563 ' C ' HD12 ' A' ' 61' ' ' ILE . 54.4 p90 -110.82 134.22 52.7 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 103.07 -2.937 . . . . 10.0 103.07 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.563 HD12 ' C ' ' A' ' 60' ' ' TYR . 1.4 mp -112.11 158.18 12.63 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.362 0 O-C-N 123.98 0.8 . . . . 10.0 111.912 179.801 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 1.2 mmm -134.93 152.0 51.35 Favored 'General case' 0 C--N 1.322 -0.614 0 O-C-N 125.056 1.472 . . . . 10.0 107.517 179.774 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -134.38 90.44 2.67 Favored 'General case' 0 C--N 1.309 -1.156 0 N-CA-C 102.182 -3.266 . . . . 10.0 102.182 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -81.88 171.06 14.92 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 117.106 2.262 . . . . 10.0 117.106 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.98 93.09 2.21 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 103.812 -2.662 . . . . 10.0 103.812 -179.78 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.437 ' CG1' ' HB2' ' A' ' 88' ' ' TRP . 22.6 t -49.47 145.53 1.22 Allowed 'Isoleucine or valine' 0 C--O 1.246 0.901 0 CA-C-N 114.439 -1.255 . . . . 10.0 109.407 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 69.78 -3.17 9.84 Favored Glycine 0 C--O 1.213 -1.205 0 N-CA-C 116.571 1.389 . . . . 10.0 116.571 179.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.5 tttt -109.9 146.94 34.3 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 119.212 1.506 . . . . 10.0 111.846 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.36 164.98 3.87 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 107.479 -1.304 . . . . 10.0 107.479 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -166.96 117.32 0.89 Allowed 'General case' 0 N--CA 1.439 -1.006 0 O-C-N 124.629 1.206 . . . . 10.0 113.473 -179.79 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -76.89 154.1 34.06 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 117.454 -1.698 . . . . 10.0 106.722 -179.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -140.92 72.37 1.39 Allowed 'General case' 0 C--O 1.22 -0.494 0 N-CA-C 115.537 1.68 . . . . 10.0 115.537 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -78.22 121.51 24.47 Favored 'General case' 0 N--CA 1.439 -0.977 0 N-CA-C 106.552 -1.647 . . . . 10.0 106.552 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 5.7 mt -110.96 67.79 0.65 Allowed 'General case' 0 C--N 1.318 -0.777 0 O-C-N 126.628 2.455 . . . . 10.0 114.692 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 1.4 p -88.44 66.39 8.26 Favored 'General case' 0 C--O 1.241 0.635 0 N-CA-C 105.527 -2.027 . . . . 10.0 105.527 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -156.25 -43.46 0.02 OUTLIER Glycine 0 C--O 1.241 0.583 0 C-N-CA 117.608 -2.234 . . . . 10.0 112.318 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 55.4 mt -113.5 -29.66 2.25 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.912 0 CA-C-N 119.257 1.529 . . . . 10.0 110.96 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -145.67 15.09 1.41 Allowed 'General case' 0 C--O 1.239 0.506 0 N-CA-C 114.053 1.131 . . . . 10.0 114.053 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 38.27 83.34 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 115.253 1.575 . . . . 10.0 115.253 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -141.49 -176.08 4.6 Favored 'General case' 0 C--N 1.316 -0.876 0 O-C-N 127.344 2.903 . . . . 10.0 111.965 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.14 156.82 27.34 Favored 'General case' 0 N--CA 1.445 -0.707 0 N-CA-C 103.656 -2.72 . . . . 10.0 103.656 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 1.5 p -166.84 -176.8 3.58 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 106.08 -1.822 . . . . 10.0 106.08 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 33.0 mtp -127.66 95.63 4.29 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 100.243 -3.984 . . . . 10.0 100.243 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 59.6 m -95.87 139.3 32.28 Favored 'General case' 0 CA--C 1.513 -0.471 0 N-CA-C 117.149 2.277 . . . . 10.0 117.149 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 19.8 m -133.21 97.47 3.99 Favored 'General case' 0 N--CA 1.437 -1.122 0 N-CA-C 106.89 -1.522 . . . . 10.0 106.89 179.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 2.5 t -76.64 97.87 1.71 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.466 0 N-CA-C 104.657 -2.349 . . . . 10.0 104.657 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.0 t -89.7 170.39 10.49 Favored 'General case' 0 C--N 1.316 -0.857 0 O-C-N 124.946 1.404 . . . . 10.0 108.959 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . 0.469 ' HE1' HG11 ' A' ' 2' ' ' VAL . 5.8 t90 -123.88 96.7 5.05 Favored 'General case' 0 C--O 1.24 0.579 0 N-CA-C 107.203 -1.406 . . . . 10.0 107.203 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -57.3 -64.51 0.86 Allowed 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 103.433 -2.803 . . . . 10.0 103.433 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 141.88 115.1 1.11 Allowed Glycine 0 CA--C 1.499 -0.914 0 N-CA-C 103.973 -3.651 . . . . 10.0 103.973 179.79 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.637 ' HA ' HG22 ' A' ' 2' ' ' VAL . 20.1 t0 87.9 -30.83 0.04 OUTLIER 'General case' 0 N--CA 1.448 -0.55 0 O-C-N 125.894 1.585 . . . . 10.0 109.834 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 8.5 mtmt -125.06 139.82 53.46 Favored 'General case' 0 C--N 1.32 -0.682 0 O-C-N 121.215 -0.928 . . . . 10.0 110.239 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.561 HD11 ' HE1' ' A' ' 49' ' ' MET . 0.4 OUTLIER -91.04 108.38 19.83 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 103.107 -2.923 . . . . 10.0 103.107 -179.899 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -121.29 138.64 54.15 Favored 'General case' 0 C--O 1.216 -0.706 0 O-C-N 125.136 1.522 . . . . 10.0 114.077 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 19.3 p -138.42 152.75 48.64 Favored 'General case' 0 C--N 1.321 -0.667 0 O-C-N 125.022 1.451 . . . . 10.0 108.396 -179.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 2.9 t -109.66 -54.83 5.3 Favored 'Isoleucine or valine' 0 C--O 1.247 0.922 0 N-CA-C 107.143 -1.429 . . . . 10.0 107.143 179.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.406 ' CG ' ' HB3' ' A' ' 104' ' ' ARG . 0.0 OUTLIER 71.08 111.99 0.06 Allowed 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 123.802 1.763 . . . . 10.0 109.263 179.926 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.33 67.2 7.18 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-O 123.578 1.656 . . . . 10.0 115.012 179.711 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -92.04 147.91 18.95 Favored Glycine 0 C--O 1.218 -0.86 0 N-CA-C 107.754 -2.138 . . . . 10.0 107.754 179.759 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -48.38 -25.99 1.86 Allowed 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 116.993 2.22 . . . . 10.0 116.993 179.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.55 -158.56 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.804 0 CA-C-N 119.788 1.176 . . . . 10.0 113.688 179.799 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -117.01 -24.93 7.38 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 126.186 1.795 . . . . 10.0 114.0 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -117.0 10.58 15.26 Favored Glycine 0 C--N 1.342 0.865 0 N-CA-C 116.757 1.463 . . . . 10.0 116.757 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.406 ' HB3' ' CG ' ' A' ' 97' ' ' GLN . 24.2 mmm-85 -55.34 143.16 29.4 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 119.031 1.416 . . . . 10.0 113.404 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 120.07 146.02 7.59 Favored Glycine 0 C--O 1.217 -0.922 0 O-C-N 124.576 1.173 . . . . 10.0 111.376 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -124.96 176.34 6.72 Favored 'General case' 0 CA--C 1.509 -0.623 0 O-C-N 120.854 -1.38 . . . . 10.0 109.961 179.871 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 76.7 m -145.74 132.74 20.27 Favored 'General case' 0 CA--C 1.509 -0.63 0 CA-C-O 118.799 -0.62 . . . . 10.0 109.593 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -123.92 126.58 46.61 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 123.929 0.891 . . . . 10.0 111.741 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 8.5 p90 -145.4 149.34 34.56 Favored 'General case' 0 C--O 1.213 -0.848 0 C-N-CA 124.301 1.04 . . . . 10.0 110.919 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 44.1 mt -89.82 147.18 5.38 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 O-C-N 125.541 1.776 . . . . 10.0 114.81 -179.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -131.74 75.05 1.62 Allowed 'General case' 0 C--O 1.24 0.589 0 N-CA-C 107.047 -1.464 . . . . 10.0 107.047 179.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 43.53 81.73 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.544 0 CA-C-O 118.176 -1.346 . . . . 10.0 110.71 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 71.15 23.78 4.04 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 118.277 -0.868 . . . . 10.0 110.947 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -143.0 103.1 4.12 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 114.774 1.398 . . . . 10.0 114.774 -179.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.437 ' CB ' ' HB2' ' A' ' 130' ' ' PHE . 0.8 OUTLIER -63.18 123.89 19.78 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 103.86 -2.644 . . . . 10.0 103.86 -179.97 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . 0.466 ' CE1' HG22 ' A' ' 129' ' ' VAL . 3.4 t-160 -134.32 99.43 4.38 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 106.906 -1.516 . . . . 10.0 106.906 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 13.8 tp -89.23 149.22 23.2 Favored 'General case' 0 C--N 1.314 -0.935 0 O-C-N 125.665 1.853 . . . . 10.0 113.43 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -133.96 124.09 25.74 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 104.999 -2.223 . . . . 10.0 104.999 -179.856 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.01 131.77 53.36 Favored 'General case' 0 C--N 1.319 -0.757 0 O-C-N 120.834 -1.166 . . . . 10.0 108.423 -179.693 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 77.2 mtm-85 -125.88 145.66 50.16 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 122.568 1.175 . . . . 10.0 110.49 179.712 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -153.62 115.04 4.18 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 106.465 -1.68 . . . . 10.0 106.465 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 45.95 57.08 5.43 Favored 'General case' 0 C--O 1.245 0.843 0 O-C-N 126.154 2.159 . . . . 10.0 116.697 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 87.69 -22.18 18.64 Favored Glycine 0 CA--C 1.534 1.278 0 N-CA-C 116.543 1.377 . . . . 10.0 116.543 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.408 HG11 ' HA ' ' A' ' 19' ' ' TYR . 2.6 t -75.64 151.73 6.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 CA-C-N 119.478 1.639 . . . . 10.0 109.556 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' THR . . . . . 0.479 ' O ' HG22 ' A' ' 125' ' ' THR . 12.8 m -136.56 86.12 2.19 Favored 'General case' 0 C--N 1.318 -0.782 0 O-C-N 124.473 1.108 . . . . 10.0 110.811 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 30.6 p -98.66 154.48 17.92 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 112.337 -2.21 . . . . 10.0 105.062 -179.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.01 146.38 27.75 Favored 'General case' 0 C--O 1.221 -0.445 0 CA-C-O 123.374 1.559 . . . . 10.0 114.397 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -113.11 124.58 52.9 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 114.035 -1.439 . . . . 10.0 111.133 179.902 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.466 HG22 ' CE1' ' A' ' 116' ' ' HIS . 55.2 t -105.57 138.4 30.86 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.82 0 CA-C-N 113.41 -1.723 . . . . 10.0 107.203 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . 0.49 ' CD1' ' HA ' ' A' ' 10' ' ' MET . 15.3 m-85 -128.93 -177.68 4.31 Favored 'General case' 0 C--O 1.215 -0.72 0 C-N-CA 124.996 1.319 . . . . 10.0 110.452 -179.619 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.416 ' CB ' ' HD2' ' A' ' 9' ' ' LYS . 0.0 OUTLIER -134.1 99.37 4.39 Favored 'General case' 0 C--O 1.24 0.597 0 CA-C-N 113.972 -1.467 . . . . 10.0 107.454 179.852 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -68.07 98.3 0.76 Allowed 'General case' 0 CA--C 1.508 -0.659 0 C-N-CA 117.345 -1.742 . . . . 10.0 107.623 179.888 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . 0.501 ' CG1' ' HE3' ' A' ' 9' ' ' LYS . 20.2 m -76.15 -4.26 5.95 Favored 'Isoleucine or valine' 0 C--O 1.241 0.62 0 C-N-CA 118.689 -1.204 . . . . 10.0 112.574 -179.696 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 66.5 t-80 . . . . . 0 C--N 1.325 -0.493 0 O-C-N 125.623 1.827 . . . . 10.0 111.751 179.766 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.466 ' C ' HG23 ' A' ' 2' ' ' VAL . 5.5 Cg_endo . . . . . 0 N--CA 1.478 0.576 0 N-CA-C 109.031 -1.18 . . . . 10.0 109.031 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.466 HG23 ' C ' ' A' ' 1' ' ' PRO . 1.6 t 69.19 98.12 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 N-CA-C 108.672 -0.862 . . . . 10.0 108.672 -179.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.4 ' O ' ' N ' ' A' ' 5' ' ' ASN . 0.4 OUTLIER -86.05 -9.24 57.1 Favored 'General case' 0 C--O 1.216 -0.661 0 C-N-CA 119.4 -0.92 . . . . 10.0 110.859 -179.987 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.468 ' CE1' HD12 ' A' ' 93' ' ' LEU . 43.1 m-85 62.72 -67.11 0.08 Allowed 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 115.968 1.84 . . . . 10.0 115.968 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.4 ' N ' ' O ' ' A' ' 3' ' ' ASP . 0.1 OUTLIER -49.64 149.05 2.58 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.1 0.96 . . . . 10.0 111.854 179.981 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 170.15 -61.9 0.18 Allowed Glycine 0 N--CA 1.438 -1.203 0 O-C-N 125.082 1.489 . . . . 10.0 116.386 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -177.18 -166.65 0.14 Allowed 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 102.805 -3.035 . . . . 10.0 102.805 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.622 ' CZ3' ' HB3' ' A' ' 39' ' ' ASP 0.257 0.5 OUTLIER -153.36 -44.57 0.09 Allowed 'General case' 0 N--CA 1.442 -0.857 0 CA-C-O 116.663 -1.637 . . . . 10.0 115.108 -178.036 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.465 ' HA ' ' CE3' ' A' ' 8' ' ' TRP . 1.3 pttt 12.46 98.94 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.001 1 O-C-N 129.45 4.218 . . . . 10.0 111.859 -177.201 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.72 157.58 17.5 Favored 'General case' 0 N--CA 1.441 -0.878 0 O-C-N 118.087 -2.883 . . . . 10.0 116.058 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.421 ' HA ' HD22 ' A' ' 11' ' ' LEU . 0.2 OUTLIER -111.89 -51.01 2.88 Favored 'General case' 0 C--O 1.245 0.859 0 CA-C-N 112.703 -2.044 . . . . 10.0 107.311 -179.692 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.1 p -146.45 -172.9 4.06 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 115.51 1.67 . . . . 10.0 115.51 179.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -169.16 133.84 1.48 Allowed 'General case' 0 C--O 1.22 -0.497 0 O-C-N 126.92 2.638 . . . . 10.0 106.961 -179.621 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -155.39 159.4 39.86 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-O 122.38 1.086 . . . . 10.0 111.497 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.453 ' HB3' ' HA ' ' A' ' 126' ' ' CYS . 0.9 OUTLIER 72.16 5.7 5.37 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 116.103 1.89 . . . . 10.0 116.103 179.983 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -57.58 -23.75 52.48 Favored 'General case' 0 CA--C 1.551 0.991 0 N-CA-C 115.054 1.501 . . . . 10.0 115.054 179.577 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -79.54 -41.54 27.07 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-O 123.979 1.847 . . . . 10.0 110.762 -179.757 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.99 -27.2 63.53 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 122.486 1.136 . . . . 10.0 110.343 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -67.84 -58.11 5.14 Favored 'General case' 0 C--O 1.242 0.706 0 C-N-CA 124.521 1.128 . . . . 10.0 108.951 -179.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.444 HD13 ' HB2' ' A' ' 30' ' ' ARG . 0.3 OUTLIER -67.59 -22.49 65.37 Favored 'General case' 0 C--O 1.211 -0.93 0 O-C-N 120.034 -1.666 . . . . 10.0 111.491 179.573 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.7 ttm-85 -75.4 -35.0 61.11 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 106.866 -1.531 . . . . 10.0 106.866 -179.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.14 -44.67 91.45 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 127.123 2.764 . . . . 10.0 112.435 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 26.5 mt -78.33 -34.15 48.75 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 125.493 1.517 . . . . 10.0 112.02 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 80.64 48.33 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.108 0 O-C-N 127.011 2.694 . . . . 10.0 113.529 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 27.9 m -82.85 164.46 2.77 Favored 'Isoleucine or valine' 0 C--O 1.242 0.71 0 O-C-N 124.996 1.435 . . . . 10.0 107.141 -179.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 9.0 m-20 -36.71 148.37 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.436 0 O-C-N 125.778 1.923 . . . . 10.0 115.213 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -70.63 -35.68 62.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 116.412 2.005 . . . . 10.0 116.412 -179.67 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -72.53 -21.06 61.23 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 123.517 1.627 . . . . 10.0 110.851 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.89 -41.96 77.59 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 119.31 -2.119 . . . . 10.0 111.733 179.632 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.444 ' HB2' HD13 ' A' ' 20' ' ' LEU . 15.8 ttp180 -56.5 -36.41 69.12 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 127.016 2.126 . . . . 10.0 113.51 179.695 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.8 tmtp? -68.53 -38.79 81.14 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 112.855 -1.975 . . . . 10.0 111.234 179.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 66.8 mt -75.36 -58.84 3.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 114.035 -1.439 . . . . 10.0 109.94 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -48.98 -31.97 8.35 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 116.335 1.976 . . . . 10.0 116.335 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -65.68 -18.24 65.18 Favored 'General case' 0 CA--C 1.516 -0.332 0 O-C-N 125.084 1.49 . . . . 10.0 110.888 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 53.1 mt -105.96 -7.38 18.17 Favored 'General case' 0 N--CA 1.448 -0.552 0 O-C-N 125.358 1.661 . . . . 10.0 113.44 -179.544 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -96.26 154.69 17.12 Favored 'General case' 0 C--O 1.219 -0.525 0 N-CA-C 114.203 1.186 . . . . 10.0 114.203 179.754 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 3.6 mtmt -139.93 100.32 7.29 Favored Pre-proline 0 C--N 1.327 -0.413 0 N-CA-C 104.717 -2.327 . . . . 10.0 104.717 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_exo -70.02 167.47 24.7 Favored 'Trans proline' 0 C--O 1.24 0.6 1 C-N-CA 125.74 4.293 . . . . 10.0 116.322 -179.711 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.622 ' HB3' ' CZ3' ' A' ' 8' ' ' TRP . 2.9 p30 -124.71 166.72 15.66 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 106.207 -1.775 . . . . 10.0 106.207 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.94 90.04 1.43 Allowed 'General case' 0 N--CA 1.434 -1.254 0 CA-C-O 122.93 1.348 . . . . 10.0 112.848 179.903 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.405 ' HA ' ' CD1' ' A' ' 8' ' ' TRP . 15.4 tt0 -85.72 103.94 14.97 Favored 'General case' 0 N--CA 1.442 -0.859 0 N-CA-C 105.232 -2.136 . . . . 10.0 105.232 179.825 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 10.2 mt -91.28 146.56 6.08 Favored 'Isoleucine or valine' 0 C--O 1.248 0.979 0 CA-C-N 113.691 -1.595 . . . . 10.0 109.384 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -151.44 121.53 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.817 0 CA-C-O 123.875 1.798 . . . . 10.0 109.466 -179.849 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.11 147.42 40.24 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 119.31 -2.119 . . . . 10.0 110.969 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -131.74 73.74 1.55 Allowed 'General case' 0 C--O 1.225 -0.217 0 CA-C-O 124.387 2.041 . . . . 10.0 106.375 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 88.81 -117.1 4.79 Favored Glycine 0 CA--C 1.533 1.189 0 N-CA-C 107.381 -2.288 . . . . 10.0 107.381 179.596 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -91.83 -13.83 30.77 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 118.142 -1.423 . . . . 10.0 108.062 -179.898 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 45.4 t-80 -81.01 138.38 36.04 Favored 'General case' 0 CA--C 1.518 -0.272 0 O-C-N 120.831 -1.168 . . . . 10.0 108.262 179.641 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 3.1 ttt -134.78 142.1 46.61 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.45 1.094 . . . . 10.0 110.923 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 8.8 mt -127.02 124.48 64.61 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.682 0 N-CA-C 106.573 -1.64 . . . . 10.0 106.573 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.438 ' CD1' ' N ' ' A' ' 51' ' ' ILE . 0.3 OUTLIER -106.84 100.17 10.11 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.901 0 N-CA-C 106.939 -1.504 . . . . 10.0 106.939 179.686 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.693 ' HG2' HD12 ' A' ' 61' ' ' ILE . 0.0 OUTLIER -93.58 127.55 39.3 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-O 122.136 0.969 . . . . 10.0 111.107 -179.868 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 57.5 m -106.69 121.43 44.33 Favored 'General case' 0 C--O 1.219 -0.507 0 N-CA-C 102.789 -3.041 . . . . 10.0 102.789 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.42 ' HB2' ' CG ' ' A' ' 39' ' ' ASP . 5.2 mp -104.1 58.05 0.72 Allowed 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 119.57 3.174 . . . . 10.0 119.57 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.8 t -83.36 172.53 12.41 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 104.475 -2.417 . . . . 10.0 104.475 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 9.6 t -106.09 -39.4 5.98 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.874 0.845 . . . . 10.0 109.648 179.873 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 48.1 m-85 -72.38 -21.8 61.23 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 116.949 -1.501 . . . . 10.0 108.12 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.448 ' NE ' HD11 ' A' ' 77' ' ' ILE . 18.7 ptt-85 -151.7 -170.84 3.76 Favored 'General case' 0 C--N 1.328 -0.361 0 O-C-N 126.678 2.486 . . . . 10.0 111.698 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -179.51 82.21 0.01 OUTLIER 'General case' 0 C--O 1.243 0.733 0 CA-C-N 114.479 -1.237 . . . . 10.0 111.257 -179.624 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.413 ' CD1' ' O ' ' A' ' 60' ' ' TYR . 0.1 OUTLIER -93.22 127.84 38.95 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 124.991 2.329 . . . . 10.0 106.797 -179.702 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.693 HD12 ' HG2' ' A' ' 52' ' ' ARG . 17.9 mm -108.67 137.69 39.29 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.818 0 O-C-N 118.201 -2.812 . . . . 10.0 111.001 -179.746 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 20.4 mtm -110.66 162.83 14.36 Favored 'General case' 0 CA--C 1.515 -0.37 0 O-C-N 126.411 2.32 . . . . 10.0 108.983 179.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -144.48 78.3 1.57 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 102.126 -3.287 . . . . 10.0 102.126 179.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 1.9 m-30 -85.53 125.11 32.82 Favored 'General case' 0 N--CA 1.445 -0.699 0 O-C-N 126.045 2.091 . . . . 10.0 114.657 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 25.8 tt0 -105.72 139.55 40.14 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 111.94 -2.391 . . . . 10.0 105.703 -179.821 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.574 HG21 ' CD1' ' A' ' 88' ' ' TRP . 0.3 OUTLIER -93.85 121.25 44.34 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-O 123.726 1.727 . . . . 10.0 108.67 -179.79 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 97.56 -12.74 64.62 Favored Glycine 0 C--O 1.213 -1.212 0 O-C-N 120.422 -1.423 . . . . 10.0 113.993 179.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.77 138.98 41.06 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 115.948 1.832 . . . . 10.0 115.948 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -80.16 135.95 36.4 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-O 122.317 1.056 . . . . 10.0 110.579 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -116.12 167.63 10.82 Favored 'General case' 0 C--O 1.248 1.0 0 CA-C-O 118.256 -0.878 . . . . 10.0 110.263 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 19.8 tt0 -137.44 82.63 1.94 Allowed 'General case' 0 C--N 1.317 -0.828 0 O-C-N 125.89 1.994 . . . . 10.0 108.443 -179.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -73.18 133.59 44.1 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 116.677 2.103 . . . . 10.0 116.677 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -104.46 -13.8 15.93 Favored 'General case' 0 C--O 1.221 -0.414 0 N-CA-C 106.372 -1.714 . . . . 10.0 106.372 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.43 HD12 ' HA ' ' A' ' 74' ' ' LEU . 0.9 OUTLIER 61.09 -84.36 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 118.812 -0.613 . . . . 10.0 112.066 -179.984 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 29.4 m 55.05 60.8 3.24 Favored 'General case' 0 C--N 1.32 -0.704 0 O-C-N 126.169 2.168 . . . . 10.0 108.682 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 172.26 137.47 2.35 Favored Glycine 0 N--CA 1.44 -1.056 0 O-C-N 126.886 2.616 . . . . 10.0 108.123 -179.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.448 HD11 ' NE ' ' A' ' 58' ' ' ARG . 11.3 mt 72.46 -64.91 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 N-CA-C 104.21 -2.515 . . . . 10.0 104.21 179.902 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -107.52 -80.05 0.57 Allowed 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 117.017 -1.468 . . . . 10.0 112.186 -179.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 21.1 p-10 122.39 28.83 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.699 0 O-C-N 128.203 3.439 . . . . 10.0 117.779 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.95 164.48 13.63 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 123.081 1.419 . . . . 10.0 111.096 179.614 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 38.3 mttt -114.74 179.16 4.03 Favored 'General case' 0 CA--C 1.509 -0.606 0 O-C-N 119.72 -1.862 . . . . 10.0 107.805 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 5.6 p 175.79 170.67 0.37 Allowed 'General case' 0 CA--C 1.503 -0.848 0 CA-C-O 123.288 1.518 . . . . 10.0 110.475 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -117.55 108.72 15.83 Favored 'General case' 0 N--CA 1.443 -0.824 0 N-CA-C 100.692 -3.818 . . . . 10.0 100.692 179.629 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 3.0 m -115.1 150.25 36.26 Favored 'General case' 0 CA--C 1.499 -1.019 0 N-CA-C 118.608 2.818 . . . . 10.0 118.608 -179.348 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 2.8 m -142.5 114.4 8.12 Favored 'General case' 0 CA--C 1.5 -0.967 0 CA-C-N 114.249 -1.341 . . . . 10.0 108.613 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 5.6 t -89.22 136.08 24.37 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 N-CA-C 101.591 -3.485 . . . . 10.0 101.591 -179.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 46.9 t -134.48 176.24 8.8 Favored 'General case' 0 N--CA 1.444 -0.728 0 O-C-N 124.989 1.43 . . . . 10.0 109.358 -179.772 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . 0.574 ' CD1' HG21 ' A' ' 66' ' ' VAL . 0.0 OUTLIER -125.96 92.13 3.53 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 104.495 -2.409 . . . . 10.0 104.495 -179.995 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -87.52 83.56 7.25 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 100.885 -3.746 . . . . 10.0 100.885 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 62.9 -105.62 1.06 Allowed Glycine 0 C--O 1.237 0.3 0 N-CA-C 106.456 -2.658 . . . . 10.0 106.456 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.415 ' HB3' HG21 ' A' ' 2' ' ' VAL . 17.1 m-20 -114.33 60.62 0.67 Allowed 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 114.123 -1.038 . . . . 10.0 112.133 -179.762 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 7.3 mtmt -158.83 139.08 12.27 Favored 'General case' 0 C--O 1.24 0.595 0 O-C-N 120.441 -1.412 . . . . 10.0 110.191 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.468 HD12 ' CE1' ' A' ' 4' ' ' PHE . 0.2 OUTLIER -95.47 94.58 7.88 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 105.931 -1.877 . . . . 10.0 105.931 179.91 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -104.03 137.81 41.46 Favored 'General case' 0 CA--C 1.506 -0.741 0 O-C-N 126.215 2.197 . . . . 10.0 110.519 179.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 19.1 m -142.89 129.16 19.89 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 126.655 2.472 . . . . 10.0 113.678 -179.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 96.2 t -116.28 122.98 70.91 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 N-CA-C 105.583 -2.006 . . . . 10.0 105.583 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -105.6 107.72 18.87 Favored 'General case' 0 C--O 1.238 0.452 0 O-C-N 125.783 1.927 . . . . 10.0 107.994 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 40.3 tttt -87.22 120.74 28.82 Favored 'General case' 0 C--O 1.221 -0.419 0 C-N-CA 120.088 -0.645 . . . . 10.0 112.453 179.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -143.22 -151.28 5.45 Favored Glycine 0 N--CA 1.447 -0.577 0 CA-C-O 123.252 1.473 . . . . 10.0 110.302 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -81.22 -1.49 45.02 Favored 'General case' 0 C--O 1.243 0.723 0 O-C-N 119.917 -1.931 . . . . 10.0 114.576 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.415 ' HB2' ' HG2' ' A' ' 104' ' ' ARG . 14.2 mttp -93.37 -166.72 1.57 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 124.599 2.142 . . . . 10.0 113.486 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -132.96 30.97 3.94 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 114.015 -1.448 . . . . 10.0 112.074 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 177.51 33.63 0.05 OUTLIER Glycine 0 N--CA 1.443 -0.861 0 CA-C-O 116.835 -2.092 . . . . 10.0 118.118 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.415 ' HG2' ' HB2' ' A' ' 101' ' ' LYS . 0.0 OUTLIER -95.37 135.86 36.46 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 119.168 1.484 . . . . 10.0 109.304 179.732 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 148.17 148.16 4.69 Favored Glycine 0 N--CA 1.446 -0.686 0 N-CA-C 109.25 -1.54 . . . . 10.0 109.25 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -116.03 -178.67 3.46 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 117.538 0.669 . . . . 10.0 110.057 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.1 m -158.49 126.92 5.35 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 105.068 -2.197 . . . . 10.0 105.068 179.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.658 ' CD ' HD21 ' A' ' 115' ' ' LEU . 0.8 OUTLIER -110.35 127.97 55.33 Favored 'General case' 0 C--O 1.219 -0.503 0 O-C-N 125.908 2.005 . . . . 10.0 110.306 -179.839 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 1.6 t-105 -135.54 146.39 48.0 Favored 'General case' 0 C--O 1.214 -0.801 0 N-CA-C 107.465 -1.309 . . . . 10.0 107.465 -179.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 17.7 mt -113.81 116.89 53.92 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 N-CA-C 117.662 2.468 . . . . 10.0 117.662 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -81.72 179.17 7.94 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 112.595 -2.093 . . . . 10.0 106.321 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -52.51 99.57 0.04 OUTLIER Glycine 0 C--O 1.221 -0.715 0 N-CA-C 108.375 -1.89 . . . . 10.0 108.375 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 53.75 30.64 11.52 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 123.62 1.676 . . . . 10.0 112.848 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -146.77 109.96 4.76 Favored 'General case' 0 CA--C 1.502 -0.894 0 CA-C-O 124.925 2.297 . . . . 10.0 113.409 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.658 HD21 ' CD ' ' A' ' 108' ' ' GLN . 2.6 tm? -74.92 131.19 40.51 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 104.315 -2.476 . . . . 10.0 104.315 -179.849 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 9.3 t-160 -128.41 91.11 3.18 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 107.725 -1.213 . . . . 10.0 107.725 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.612 ' C ' HD23 ' A' ' 117' ' ' LEU . 6.5 tt -95.19 142.77 27.24 Favored 'General case' 0 N--CA 1.44 -0.953 0 O-C-N 124.759 1.287 . . . . 10.0 111.498 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.574 ' N ' HD23 ' A' ' 117' ' ' LEU . 16.2 pm0 -128.56 133.91 48.5 Favored 'General case' 0 C--O 1.216 -0.708 0 N-CA-C 108.011 -1.107 . . . . 10.0 108.011 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 48.1 mtt -112.62 162.02 16.16 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-O 123.366 1.555 . . . . 10.0 108.164 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 2.7 mtm180 -158.65 148.5 19.47 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 113.952 -1.476 . . . . 10.0 109.49 179.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . 0.635 ' O ' HG22 ' A' ' 124' ' ' VAL . . . -171.17 122.34 0.56 Allowed 'General case' 0 CA--C 1.504 -0.801 0 O-C-N 123.588 0.555 . . . . 10.0 109.766 179.595 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 61.34 31.6 19.25 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 126.306 1.843 . . . . 10.0 114.486 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 97.9 -15.38 61.77 Favored Glycine 0 CA--C 1.536 1.404 0 CA-C-O 117.032 -1.982 . . . . 10.0 116.792 -179.702 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.635 HG22 ' O ' ' A' ' 121' ' ' ALA . 19.8 m -94.73 -179.78 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 CA-C-N 119.171 1.485 . . . . 10.0 111.003 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 1.1 m -149.93 133.89 16.99 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 122.19 0.995 . . . . 10.0 113.213 179.819 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . 0.453 ' HA ' ' HB3' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -123.12 142.39 50.93 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 105.126 -2.176 . . . . 10.0 105.126 179.911 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.26 145.86 36.09 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 114.176 1.176 . . . . 10.0 114.176 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.09 109.19 10.29 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 113.951 -1.477 . . . . 10.0 111.984 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 84.8 t -72.27 123.06 26.04 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 N-CA-C 105.142 -2.17 . . . . 10.0 105.142 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . 0.441 ' HB2' HD12 ' A' ' 115' ' ' LEU . 2.7 m-85 -103.25 161.97 13.37 Favored 'General case' 0 C--N 1.316 -0.866 0 C-N-CA 124.685 1.194 . . . . 10.0 108.73 -179.656 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -137.61 102.71 4.83 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 122.449 1.118 . . . . 10.0 108.217 -179.734 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.27 128.22 35.47 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-O 122.155 0.979 . . . . 10.0 110.253 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 1.3 t -101.38 -21.65 5.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 C-N-CA 124.641 1.176 . . . . 10.0 109.486 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 54.7 t60 . . . . . 0 C--O 1.251 1.164 0 O-C-N 124.746 1.279 . . . . 10.0 114.11 -179.985 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . 0.272 72.8 Cg_exo . . . . . 0 C--O 1.237 0.442 0 CA-C-O 123.665 1.444 . . . . 10.0 111.137 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -138.31 41.43 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 114.364 -1.289 . . . . 10.0 110.862 179.702 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -44.12 130.6 6.11 Favored 'General case' 0 C--O 1.24 0.571 0 C-N-CA 124.715 1.206 . . . . 10.0 111.033 -179.785 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -98.19 -20.77 17.09 Favored 'General case' 0 C--O 1.24 0.602 0 N-CA-C 115.687 1.736 . . . . 10.0 115.687 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -56.3 116.77 3.25 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 117.061 -1.447 . . . . 10.0 112.03 -179.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -132.22 -158.78 9.09 Favored Glycine 0 CA--C 1.534 1.227 0 CA-C-O 123.193 1.441 . . . . 10.0 115.681 -179.842 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.692 ' O ' HG12 ' A' ' 133' ' ' VAL . 0.3 OUTLIER -160.57 82.76 0.68 Allowed 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 100.377 -3.934 . . . . 10.0 100.377 179.97 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.649 ' CG ' ' N ' ' A' ' 9' ' ' LYS 0.284 0.2 OUTLIER -61.32 -160.09 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 127.106 2.163 . . . . 10.0 111.941 -179.706 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.649 ' N ' ' CG ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER 153.09 74.4 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.611 0 O-C-N 126.295 2.247 . . . . 10.0 106.174 176.539 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 27.9 ttm -36.26 139.89 0.15 Allowed 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 112.179 -2.282 . . . . 10.0 115.379 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.3 tp -95.09 -38.66 10.52 Favored 'General case' 0 C--N 1.317 -0.832 0 O-C-N 126.708 2.505 . . . . 10.0 106.424 -179.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -178.22 162.0 1.51 Allowed 'General case' 0 C--N 1.345 0.412 0 CA-C-O 123.528 1.632 . . . . 10.0 112.977 179.776 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -121.04 165.79 14.79 Favored 'General case' 0 CA--C 1.51 -0.569 0 CA-C-N 112.651 -2.068 . . . . 10.0 106.326 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -157.91 129.89 6.97 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.823 -0.626 . . . . 10.0 111.046 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 69.73 44.1 0.9 Allowed 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 125.443 1.497 . . . . 10.0 113.469 -179.813 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -76.92 -39.92 49.09 Favored 'General case' 0 CA--C 1.55 0.96 0 O-C-N 125.453 1.721 . . . . 10.0 109.231 179.771 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -71.14 -36.89 72.25 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 114.306 -1.315 . . . . 10.0 112.118 179.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.602 ' HB3' HG11 ' A' ' 124' ' ' VAL . 3.2 mt-10 -70.29 -33.18 71.26 Favored 'General case' 0 N--CA 1.442 -0.865 0 O-C-N 125.588 1.805 . . . . 10.0 108.948 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.424 ' O ' ' HB3' ' A' ' 22' ' ' ALA . 1.1 t80 -71.97 -38.22 69.77 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 113.758 -1.565 . . . . 10.0 110.439 179.851 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 80.4 mt -71.59 -25.8 62.34 Favored 'General case' 0 C--O 1.213 -0.832 0 O-C-N 121.645 -0.659 . . . . 10.0 110.583 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.26 -29.29 60.12 Favored 'General case' 0 C--O 1.243 0.714 0 CA-C-O 123.143 1.449 . . . . 10.0 107.775 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.424 ' HB3' ' O ' ' A' ' 19' ' ' TYR . . . -62.36 -28.41 69.74 Favored 'General case' 0 C--O 1.212 -0.872 0 C-N-CA 125.463 1.505 . . . . 10.0 112.722 179.725 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 22.3 mt -104.92 -6.19 20.36 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.631 1.172 . . . . 10.0 111.124 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 42.9 m-20 48.71 58.97 4.72 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 125.897 1.679 . . . . 10.0 114.177 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 26.2 m -93.39 161.29 2.58 Favored 'Isoleucine or valine' 0 C--O 1.243 0.754 0 N-CA-C 106.555 -1.646 . . . . 10.0 106.555 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -41.59 142.15 0.66 Allowed 'General case' 0 CA--C 1.544 0.745 0 CA-C-O 123.817 1.77 . . . . 10.0 113.452 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 52.9 t -67.07 -26.26 36.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 N-CA-C 115.875 1.805 . . . . 10.0 115.875 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.546 ' O ' HD13 ' A' ' 32' ' ' ILE . . . -73.89 -26.9 60.79 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 119.673 -0.811 . . . . 10.0 111.697 179.881 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.8 -44.3 73.86 Favored 'General case' 0 C--N 1.317 -0.813 0 O-C-N 125.774 1.921 . . . . 10.0 114.646 179.743 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.07 -31.28 69.92 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-O 123.864 1.792 . . . . 10.0 112.065 -179.49 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 14.8 mttt -77.3 -33.64 55.65 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 113.465 -1.698 . . . . 10.0 110.86 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.546 HD13 ' O ' ' A' ' 28' ' ' ALA . 1.4 mp -77.26 -39.77 28.78 Favored 'Isoleucine or valine' 0 C--O 1.243 0.759 0 CA-C-N 114.922 -1.036 . . . . 10.0 111.032 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -81.5 -19.35 42.44 Favored 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 116.069 1.877 . . . . 10.0 116.069 -179.711 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -76.37 -14.86 60.06 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 122.551 1.167 . . . . 10.0 110.63 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.413 ' HA ' HD23 ' A' ' 35' ' ' LEU . 14.6 mt -83.21 -9.67 59.02 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 123.793 0.837 . . . . 10.0 113.066 -179.64 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 21.0 mt -116.52 165.38 13.3 Favored 'General case' 0 CA--C 1.507 -0.675 0 CA-C-O 122.588 1.185 . . . . 10.0 109.066 -179.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.53 99.17 8.71 Favored Pre-proline 0 N--CA 1.481 1.099 0 N-CA-C 103.163 -2.902 . . . . 10.0 103.163 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_exo -51.16 -174.95 0.01 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.382 0 C-N-CA 124.693 3.596 . . . . 10.0 115.521 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.5 ' HB2' ' CZ2' ' A' ' 8' ' ' TRP . 0.5 OUTLIER -139.54 -174.77 3.98 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-N 113.096 -1.866 . . . . 10.0 108.222 -179.929 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.7 mttm -173.63 122.79 0.35 Allowed 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 119.109 0.868 . . . . 10.0 111.01 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -121.19 121.0 36.82 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 119.82 1.191 . . . . 10.0 108.424 179.388 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 2.4 mt -97.07 142.01 14.78 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.923 0 O-C-N 124.861 1.351 . . . . 10.0 111.223 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 56.1 t -147.28 138.14 17.73 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.998 0 N-CA-C 104.964 -2.235 . . . . 10.0 104.964 -179.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -143.29 126.08 16.1 Favored 'General case' 0 C--O 1.211 -0.93 0 N-CA-C 106.058 -1.83 . . . . 10.0 106.058 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -104.24 23.87 12.4 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-O 122.965 1.364 . . . . 10.0 107.568 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 87.83 106.27 0.94 Allowed Glycine 0 C--N 1.336 0.539 0 N-CA-C 110.138 -1.185 . . . . 10.0 110.138 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 57.27 31.58 20.33 Favored 'General case' 0 C--N 1.321 -0.654 0 O-C-N 124.829 0.958 . . . . 10.0 110.088 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -162.36 92.99 0.84 Allowed 'General case' 0 C--O 1.213 -0.818 0 N-CA-C 103.189 -2.893 . . . . 10.0 103.189 179.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.496 ' SD ' HD11 ' A' ' 51' ' ' ILE . 4.9 ttm -105.34 142.64 34.74 Favored 'General case' 0 C--N 1.316 -0.875 0 O-C-N 126.389 2.306 . . . . 10.0 116.588 -179.592 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 6.0 mm -128.28 130.91 69.5 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.732 0 N-CA-C 106.273 -1.751 . . . . 10.0 106.273 -179.751 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.496 HD11 ' SD ' ' A' ' 49' ' ' MET . 1.3 mp -121.58 113.61 39.89 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.07 0 O-C-N 126.87 2.607 . . . . 10.0 106.059 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.8 mtp180 -111.61 98.75 7.65 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 113.924 1.083 . . . . 10.0 113.924 -179.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 32.4 m -96.25 89.3 5.06 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 104.736 -2.32 . . . . 10.0 104.736 -179.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.73 44.43 0.01 OUTLIER 'General case' 0 C--N 1.315 -0.905 1 N-CA-C 122.824 4.379 . . . . 10.0 122.824 -179.709 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 36.1 t -64.95 138.56 58.44 Favored 'General case' 0 C--O 1.242 0.695 0 N-CA-C 103.622 -2.733 . . . . 10.0 103.622 -179.735 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 15.9 p -87.39 -37.27 17.21 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 121.389 1.904 . . . . 10.0 108.401 179.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 22.0 t80 -53.46 -35.81 60.92 Favored 'General case' 0 C--O 1.242 0.688 0 O-C-N 125.979 2.049 . . . . 10.0 110.076 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -174.82 90.04 0.06 Allowed 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 115.577 -0.738 . . . . 10.0 112.243 -179.845 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -46.16 144.58 1.91 Allowed 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.61 1.194 . . . . 10.0 113.554 179.775 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -122.72 89.19 3.07 Favored 'General case' 0 CA--C 1.503 -0.859 0 N-CA-C 103.236 -2.876 . . . . 10.0 103.236 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 19.7 mm -90.13 128.38 42.1 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 O-C-N 120.217 -1.552 . . . . 10.0 110.943 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 1.7 mtm -125.65 142.6 51.43 Favored 'General case' 0 C--N 1.341 0.226 0 N-CA-C 105.303 -2.11 . . . . 10.0 105.303 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -140.95 96.56 3.02 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 100.73 -3.804 . . . . 10.0 100.73 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 1.5 m-30 -110.86 167.27 10.36 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 117.623 2.453 . . . . 10.0 117.623 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -126.68 99.9 5.98 Favored 'General case' 0 C--O 1.241 0.624 0 CA-C-N 111.389 -2.642 . . . . 10.0 104.223 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 33.3 t -43.8 112.4 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 CA-C-N 114.225 -1.352 . . . . 10.0 112.424 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.99 30.9 60.55 Favored Glycine 0 CA--C 1.528 0.901 0 O-C-N 126.63 2.456 . . . . 10.0 115.758 -179.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.6 tmmm? -107.79 2.38 23.56 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 115.783 1.772 . . . . 10.0 115.783 -179.693 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 59.6 tt0 61.84 138.04 0.01 OUTLIER 'General case' 0 C--N 1.311 -1.074 0 O-C-N 128.354 3.534 . . . . 10.0 113.526 179.505 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 56.4 m-85 -141.26 143.89 34.37 Favored 'General case' 0 C--N 1.319 -0.721 0 O-C-N 121.046 -1.034 . . . . 10.0 110.47 -179.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -109.93 90.33 3.28 Favored 'General case' 0 C--N 1.321 -0.638 0 O-C-N 126.057 2.098 . . . . 10.0 110.23 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -78.89 134.98 36.87 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 113.982 -1.463 . . . . 10.0 114.672 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -129.82 95.23 3.91 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 106.205 -1.776 . . . . 10.0 106.205 179.779 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.406 ' HB3' ' HA ' ' A' ' 79' ' ' ASP . 1.0 OUTLIER -68.56 -167.23 0.09 Allowed 'General case' 0 C--N 1.322 -0.607 0 O-C-N 125.0 1.438 . . . . 10.0 112.718 -179.98 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -158.61 -70.55 0.09 Allowed 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 107.809 -1.182 . . . . 10.0 107.809 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -92.28 -173.41 41.88 Favored Glycine 0 N--CA 1.434 -1.448 0 O-C-N 126.965 2.666 . . . . 10.0 111.579 -179.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 78.5 mt 75.03 -92.03 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 O-C-N 126.225 1.779 . . . . 10.0 107.704 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -115.7 -48.58 2.76 Favored 'General case' 0 C--N 1.318 -0.775 0 C-N-CA 124.287 1.035 . . . . 10.0 109.967 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.406 ' HA ' ' HB3' ' A' ' 74' ' ' LEU . 0.0 OUTLIER 75.9 128.25 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 118.171 2.656 . . . . 10.0 118.171 179.785 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 6.4 ttm105 -177.81 144.49 0.36 Allowed 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 114.544 -1.207 . . . . 10.0 110.742 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 1.8 mtpp -96.18 148.78 22.35 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 104.327 -2.472 . . . . 10.0 104.327 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 1.8 p -168.23 168.72 11.39 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 107.224 -1.399 . . . . 10.0 107.224 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 7.0 mtt -115.29 92.12 3.82 Favored 'General case' 0 C--O 1.245 0.818 0 N-CA-C 102.051 -3.314 . . . . 10.0 102.051 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.2 m -88.37 115.57 25.96 Favored 'General case' 0 CA--C 1.504 -0.814 0 O-C-N 119.498 -2.001 . . . . 10.0 113.38 179.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 11.2 m -119.8 111.35 17.88 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-N 114.594 -1.184 . . . . 10.0 108.857 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 1.3 t -84.79 119.86 34.36 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 N-CA-C 101.296 -3.594 . . . . 10.0 101.296 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.4 p -145.03 141.93 29.32 Favored 'General case' 0 C--O 1.217 -0.621 0 CA-C-O 124.407 2.051 . . . . 10.0 114.82 -179.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -72.39 137.96 46.89 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 113.368 -1.742 . . . . 10.0 109.488 179.339 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -97.94 8.94 43.93 Favored 'General case' 0 CA--C 1.506 -0.716 0 N-CA-C 103.401 -2.815 . . . . 10.0 103.401 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 129.66 -29.8 3.72 Favored Glycine 0 CA--C 1.497 -1.062 0 N-CA-C 103.392 -3.883 . . . . 10.0 103.392 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -157.6 -51.28 0.07 Allowed 'General case' 0 C--O 1.24 0.563 0 CA-C-N 118.011 0.906 . . . . 10.0 109.857 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -61.39 160.92 10.04 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-O 117.396 -1.288 . . . . 10.0 110.442 -179.915 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 49.0 tp -104.26 116.06 31.51 Favored 'General case' 0 N--CA 1.442 -0.851 0 N-CA-C 104.757 -2.312 . . . . 10.0 104.757 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . 0.443 ' N ' HE21 ' A' ' 94' ' ' GLN . 0.0 OUTLIER -124.45 142.52 51.25 Favored 'General case' 0 CA--C 1.501 -0.942 0 N-CA-C 115.799 1.777 . . . . 10.0 115.799 -179.753 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -134.81 157.69 46.12 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 116.851 -1.547 . . . . 10.0 107.653 179.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 8.3 t -130.56 -67.1 0.58 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.755 0 C-N-CA 118.329 -1.348 . . . . 10.0 110.924 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 72.86 116.18 0.05 Allowed 'General case' 0 C--O 1.245 0.849 0 N-CA-C 105.506 -2.035 . . . . 10.0 105.506 -179.504 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 5.2 ptpp? -107.47 170.74 7.79 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 114.88 1.437 . . . . 10.0 114.88 -179.527 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 176.86 -124.14 0.94 Allowed Glycine 0 N--CA 1.447 -0.568 0 O-C-N 124.723 1.264 . . . . 10.0 110.653 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -130.31 22.07 5.21 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 114.977 1.473 . . . . 10.0 114.977 179.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -110.7 177.2 4.75 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 116.084 1.883 . . . . 10.0 116.084 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -90.9 120.6 32.05 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 128.625 2.77 . . . . 10.0 108.959 179.651 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 86.49 -97.49 2.24 Favored Glycine 0 C--O 1.22 -0.72 0 O-C-N 119.808 -1.807 . . . . 10.0 115.214 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 21.3 mtm-85 59.82 165.76 0.06 Allowed 'General case' 0 N--CA 1.441 -0.876 0 N-CA-C 114.896 1.443 . . . . 10.0 114.896 -179.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 74.43 166.52 15.59 Favored Glycine 0 N--CA 1.444 -0.792 0 CA-C-N 112.036 -2.347 . . . . 10.0 112.903 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -112.46 -173.81 2.33 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 124.565 1.146 . . . . 10.0 109.757 -179.793 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 55.9 m -162.35 123.34 2.57 Favored 'General case' 0 C--O 1.214 -0.814 0 CA-C-O 118.304 -0.855 . . . . 10.0 110.259 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 10.0 mt-30 -120.17 124.9 46.87 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 118.258 -0.877 . . . . 10.0 112.462 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -134.15 164.64 26.9 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 106.519 -1.66 . . . . 10.0 106.519 179.704 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 37.5 mt -129.28 136.21 59.99 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 N-CA-C 116.282 1.956 . . . . 10.0 116.282 -179.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -109.24 -162.17 0.8 Allowed 'General case' 0 CA--C 1.522 -0.117 0 C-N-CA 125.869 1.668 . . . . 10.0 107.356 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -77.48 103.11 1.8 Allowed Glycine 0 CA--C 1.528 0.868 0 O-C-N 125.741 1.901 . . . . 10.0 108.833 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 9.6 t70 50.07 17.41 0.3 Allowed 'General case' 0 C--N 1.324 -0.504 0 O-C-N 127.151 2.324 . . . . 10.0 111.812 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -137.28 88.8 2.38 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 120.5 1.5 . . . . 10.0 110.716 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.795 HD12 ' N ' ' A' ' 116' ' ' HIS . 0.9 OUTLIER -60.48 134.06 56.7 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 105.198 -2.149 . . . . 10.0 105.198 -179.946 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . 0.795 ' N ' HD12 ' A' ' 115' ' ' LEU . 3.6 t60 -119.2 99.05 6.47 Favored 'General case' 0 C--O 1.213 -0.859 0 O-C-N 118.96 -2.337 . . . . 10.0 109.156 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.29 149.15 21.99 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 114.449 -1.25 . . . . 10.0 111.197 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -146.01 128.56 16.05 Favored 'General case' 0 CA--C 1.505 -0.757 0 O-C-N 125.205 1.566 . . . . 10.0 108.621 179.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -113.51 125.73 54.53 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 114.117 -1.402 . . . . 10.0 108.026 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.416 ' HD3' ' N ' ' A' ' 120' ' ' ARG . 0.0 OUTLIER -121.43 160.8 23.38 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-O 125.584 2.611 . . . . 10.0 115.534 -179.943 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -179.03 137.49 0.14 Allowed 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 112.698 -2.046 . . . . 10.0 110.579 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 46.85 31.54 1.5 Allowed 'General case' 0 C--O 1.246 0.896 0 CA-C-N 113.596 -1.638 . . . . 10.0 114.5 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 93.61 -15.38 63.17 Favored Glycine 0 N--CA 1.444 -0.78 0 C-N-CA 124.36 0.981 . . . . 10.0 115.533 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.602 HG11 ' HB3' ' A' ' 18' ' ' GLU . 3.0 t -94.04 131.32 41.27 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 CA-C-N 119.589 1.695 . . . . 10.0 109.983 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 36.4 m -115.43 118.84 34.34 Favored 'General case' 0 N--CA 1.445 -0.709 0 O-C-N 125.991 2.057 . . . . 10.0 113.21 179.457 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -99.58 155.02 17.81 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 105.195 -2.15 . . . . 10.0 105.195 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 25.0 mtmt -145.54 159.29 43.32 Favored 'General case' 0 CA--C 1.507 -0.677 0 O-C-N 120.999 -1.063 . . . . 10.0 110.88 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -140.19 125.36 18.68 Favored 'General case' 0 C--N 1.321 -0.636 0 O-C-N 125.45 1.719 . . . . 10.0 108.235 -179.67 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 2.5 t -85.66 108.31 17.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 N-CA-C 105.873 -1.899 . . . . 10.0 105.873 179.561 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . 0.422 ' HB2' ' HB3' ' A' ' 115' ' ' LEU . 3.9 m-85 -86.06 151.98 23.26 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 115.631 -0.713 . . . . 10.0 110.781 -179.741 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 17.6 tptt -130.31 85.72 2.32 Favored 'General case' 0 C--N 1.321 -0.651 0 O-C-N 126.854 2.596 . . . . 10.0 108.991 -179.768 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.47 104.54 0.13 Allowed 'General case' 0 C--O 1.235 0.341 0 O-C-N 125.723 1.889 . . . . 10.0 109.837 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . 0.692 HG12 ' O ' ' A' ' 7' ' ' TYR . 1.4 p -73.88 -24.67 19.76 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.492 0 C-N-CA 118.593 -1.243 . . . . 10.0 110.662 179.599 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 35.1 t-80 . . . . . 0 N--CA 1.441 -0.913 0 CA-C-O 115.871 -2.014 . . . . 10.0 110.814 -179.853 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo . . . . . 0 N--CA 1.485 0.986 0 CA-C-O 122.851 1.105 . . . . 10.0 113.769 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -137.26 169.49 19.41 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 O-C-N 119.46 -2.025 . . . . 10.0 109.773 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.06 -73.01 0.15 Allowed 'General case' 0 N--CA 1.443 -0.793 0 N-CA-C 112.742 0.645 . . . . 10.0 112.742 -179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 62.8 -73.2 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 O-C-N 125.469 1.73 . . . . 10.0 111.99 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -35.32 111.17 0.12 Allowed 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.457 1.503 . . . . 10.0 113.04 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -157.23 -140.7 3.0 Favored Glycine 0 N--CA 1.445 -0.7 0 C-N-CA 118.861 -1.638 . . . . 10.0 114.069 179.56 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 93.1 m-85 -160.36 65.8 0.33 Allowed 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 104.499 -2.408 . . . . 10.0 104.499 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.589 ' CD2' ' CD1' ' A' ' 115' ' ' LEU . 8.5 m0 -68.03 105.95 2.2 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 118.34 -1.344 . . . . 10.0 108.464 179.715 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.403 ' HG2' ' HB ' ' A' ' 133' ' ' VAL . 4.5 pttp -81.93 12.27 4.25 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 117.196 -1.383 . . . . 10.0 110.666 -179.763 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.477 ' HG2' ' N ' ' A' ' 11' ' ' LEU . 0.0 OUTLIER 62.94 140.26 0.02 OUTLIER 'General case' 0 C--N 1.311 -1.084 0 CA-C-O 124.199 1.952 . . . . 10.0 116.15 179.58 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.574 HD12 ' HB2' ' A' ' 131' ' ' LYS . 4.1 tt -108.83 -50.15 3.05 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 120.306 -1.496 . . . . 10.0 108.967 -179.847 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -174.15 157.6 2.87 Favored 'General case' 0 C--O 1.241 0.632 0 C-N-CA 119.544 -0.863 . . . . 10.0 112.773 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -116.2 161.0 19.61 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 127.205 2.202 . . . . 10.0 107.402 -179.711 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 -123.39 -89.39 0.59 Allowed 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 114.218 1.192 . . . . 10.0 114.218 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -80.61 46.82 0.89 Allowed 'General case' 0 N--CA 1.469 0.512 0 O-C-N 124.572 1.17 . . . . 10.0 113.271 -179.701 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -66.36 -36.76 83.69 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 113.85 1.056 . . . . 10.0 113.85 179.555 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -76.55 -32.93 58.5 Favored 'General case' 0 CA--C 1.515 -0.397 0 O-C-N 118.783 -2.448 . . . . 10.0 111.423 179.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -79.61 -24.74 41.76 Favored 'General case' 0 C--O 1.219 -0.502 0 N-CA-C 107.165 -1.421 . . . . 10.0 107.165 179.796 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.575 ' HA ' HG11 ' A' ' 124' ' ' VAL . 42.4 t80 -68.16 -41.12 82.0 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-O 117.44 -1.267 . . . . 10.0 110.848 -179.82 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.421 HD12 ' HG2' ' A' ' 30' ' ' ARG . 84.5 mt -78.35 -21.89 48.8 Favored 'General case' 0 C--O 1.214 -0.769 0 CA-C-O 123.69 1.71 . . . . 10.0 112.747 -179.909 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.411 ' CZ ' ' HA ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -66.25 -42.61 88.31 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 113.66 -1.609 . . . . 10.0 108.415 -179.774 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.57 -21.54 65.43 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 126.17 1.788 . . . . 10.0 110.795 -179.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.512 HD21 ' NH2' ' A' ' 104' ' ' ARG . 35.3 mt -95.78 -9.55 31.39 Favored 'General case' 0 C--O 1.241 0.622 0 C-N-CA 124.746 1.218 . . . . 10.0 108.981 179.79 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 62.59 38.57 12.21 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-O 116.697 -1.62 . . . . 10.0 112.086 179.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.935 HG11 HD22 ' A' ' 29' ' ' LEU . 2.1 t -91.18 154.33 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.82 0 N-CA-C 107.421 -1.326 . . . . 10.0 107.421 179.547 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.26 0.0 OUTLIER -58.08 163.17 2.96 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 127.071 2.732 . . . . 10.0 116.948 -179.687 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 68.9 t -71.97 -26.32 25.21 Favored 'Isoleucine or valine' 0 C--O 1.236 0.372 0 N-CA-C 113.964 1.098 . . . . 10.0 113.964 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.88 -38.16 76.29 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 123.615 0.766 . . . . 10.0 111.105 179.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.935 HD22 HG11 ' A' ' 25' ' ' VAL . 8.1 tt -79.32 -24.17 42.98 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 122.373 1.082 . . . . 10.0 108.562 179.448 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.421 ' HG2' HD12 ' A' ' 20' ' ' LEU . 0.2 OUTLIER -78.78 -41.92 29.27 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 114.837 -1.074 . . . . 10.0 108.881 179.787 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.4 tttt -63.76 -48.31 77.49 Favored 'General case' 0 N--CA 1.442 -0.865 0 C-N-CA 125.135 1.374 . . . . 10.0 113.504 -179.524 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 11.8 mm -72.37 -38.06 59.85 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.575 0 O-C-N 119.707 -1.871 . . . . 10.0 113.783 -179.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -68.15 -37.52 81.14 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 115.835 1.791 . . . . 10.0 115.835 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -57.98 -31.38 66.86 Favored 'General case' 0 C--O 1.216 -0.71 0 N-CA-C 115.075 1.509 . . . . 10.0 115.075 -179.806 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 40.4 mt -81.31 -25.32 36.56 Favored 'General case' 0 C--O 1.217 -0.647 0 CA-C-O 122.172 0.987 . . . . 10.0 113.553 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 11.6 mt -96.58 157.79 15.74 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.572 -0.74 . . . . 10.0 112.866 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 30.1 mttm -145.74 146.02 27.58 Favored Pre-proline 0 N--CA 1.48 1.039 0 N-CA-C 102.422 -3.177 . . . . 10.0 102.422 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 0.1 OUTLIER -100.46 -172.24 0.11 Allowed 'Trans proline' 0 CA--C 1.543 0.952 0 C-N-CA 122.636 2.224 . . . . 10.0 117.427 -179.785 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -142.96 136.69 28.78 Favored 'General case' 0 C--N 1.315 -0.921 0 O-C-N 127.54 3.025 . . . . 10.0 104.329 179.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.518 ' HB2' ' CE2' ' A' ' 130' ' ' PHE . 0.1 OUTLIER -119.58 112.13 18.95 Favored 'General case' 0 N--CA 1.438 -1.051 0 C-N-CA 119.417 -0.913 . . . . 10.0 112.503 -179.933 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -105.4 132.04 52.08 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 102.162 -3.273 . . . . 10.0 102.162 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.527 HG13 ' CH2' ' A' ' 8' ' ' TRP . 0.9 OUTLIER -115.01 161.97 13.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 118.554 0.616 . . . . 10.0 110.274 -179.918 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.607 HG12 HD12 ' A' ' 50' ' ' ILE . 2.6 t -144.5 123.17 6.33 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.854 0 N-CA-C 105.412 -2.07 . . . . 10.0 105.412 179.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -119.9 104.2 9.98 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 122.739 1.257 . . . . 10.0 111.584 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -99.69 86.16 3.27 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 104.498 -2.408 . . . . 10.0 104.498 -179.85 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 70.03 -112.41 4.37 Favored Glycine 0 C--N 1.34 0.803 0 N-CA-C 106.684 -2.566 . . . . 10.0 106.684 -179.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -107.17 -12.35 15.41 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 119.811 -0.756 . . . . 10.0 110.154 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 13.2 m170 -74.42 109.48 7.93 Favored 'General case' 0 N--CA 1.445 -0.723 0 O-C-N 120.88 -1.137 . . . . 10.0 109.043 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.539 ' HG2' HD13 ' A' ' 51' ' ' ILE . 2.8 ttt -87.84 140.02 29.93 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 114.395 1.257 . . . . 10.0 114.395 -179.876 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.607 HD12 HG12 ' A' ' 43' ' ' VAL . 6.9 mt -134.99 110.8 12.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 N-CA-C 102.913 -2.995 . . . . 10.0 102.913 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.539 HD13 ' HG2' ' A' ' 49' ' ' MET . 0.3 OUTLIER -100.69 132.96 45.37 Favored 'Isoleucine or valine' 0 C--O 1.241 0.612 0 N-CA-C 106.472 -1.677 . . . . 10.0 106.472 179.98 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.427 ' CZ ' ' HB3' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -135.16 88.44 2.42 Favored 'General case' 0 N--CA 1.438 -1.025 0 O-C-N 125.377 1.673 . . . . 10.0 110.426 179.695 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 24.3 m -80.2 112.75 17.82 Favored 'General case' 0 C--N 1.318 -0.78 1 N-CA-C 99.913 -4.106 . . . . 10.0 99.913 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.1 mt -78.85 61.91 3.2 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 117.317 2.34 . . . . 10.0 117.317 -179.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.7 m -90.61 84.6 5.93 Favored 'General case' 0 C--O 1.242 0.698 0 CA-C-N 112.143 -2.299 . . . . 10.0 106.044 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -66.36 111.03 3.31 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 106.248 -1.76 . . . . 10.0 106.248 179.814 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 68.8 t80 153.89 -62.34 0.0 OUTLIER 'General case' 0 C--O 1.241 0.646 0 O-C-N 128.06 3.35 . . . . 10.0 105.14 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 10.2 tpp180 -152.52 75.52 1.11 Allowed 'General case' 0 N--CA 1.444 -0.727 0 O-C-N 125.195 1.559 . . . . 10.0 110.072 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -63.13 177.84 0.56 Allowed 'General case' 0 CA--C 1.541 0.606 0 O-C-N 126.162 2.163 . . . . 10.0 114.053 -179.759 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 49.6 m-85 -102.25 -132.76 0.29 Allowed 'General case' 0 C--N 1.308 -1.196 0 O-C-N 128.613 3.696 . . . . 10.0 101.24 179.349 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 6.7 mt 108.56 122.33 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.3 -1.561 0 O-C-N 128.48 3.612 . . . . 10.0 111.306 179.548 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.409 ' CE ' ' HG2' ' A' ' 72' ' ' GLU . 4.6 mmt -150.69 170.07 20.09 Favored 'General case' 0 CA--C 1.532 0.275 0 O-C-N 127.555 3.034 . . . . 10.0 104.376 -179.567 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -134.62 63.85 1.61 Allowed 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 101.459 -3.534 . . . . 10.0 101.459 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.403 ' O ' ' N ' ' A' ' 49' ' ' MET . 1.5 m-30 -65.11 165.68 10.82 Favored 'General case' 0 C--N 1.342 0.256 0 N-CA-C 116.908 2.188 . . . . 10.0 116.908 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 63.3 mt-30 -136.06 125.01 24.18 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 106.208 -1.775 . . . . 10.0 106.208 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.458 ' HA ' ' CG1' ' A' ' 86' ' ' VAL . 0.9 OUTLIER -69.41 134.9 29.38 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 CA-C-O 123.092 1.425 . . . . 10.0 112.291 -179.644 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.58 -16.33 41.16 Favored Glycine 0 N--CA 1.439 -1.135 0 O-C-N 120.002 -1.686 . . . . 10.0 114.307 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 4.1 mttp -91.42 132.33 36.29 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 122.433 1.111 . . . . 10.0 111.815 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -74.55 125.26 28.24 Favored 'General case' 0 CA--C 1.53 0.179 0 O-C-N 120.977 -1.077 . . . . 10.0 109.689 -179.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -121.0 -167.11 1.43 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.187 -0.46 . . . . 10.0 110.83 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -156.75 116.41 3.49 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-O 121.877 0.846 . . . . 10.0 109.408 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.409 ' HG2' ' CE ' ' A' ' 62' ' ' MET . 32.8 mt-10 -79.01 108.37 12.45 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 118.146 -1.421 . . . . 10.0 114.446 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -61.37 -29.7 70.07 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 124.889 1.368 . . . . 10.0 111.404 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 68.43 -78.38 0.04 OUTLIER 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 116.022 1.86 . . . . 10.0 116.022 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 1.7 m 15.68 82.65 0.01 OUTLIER 'General case' 0 C--N 1.313 -0.993 1 O-C-N 129.704 4.377 . . . . 10.0 111.601 -179.649 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 179.78 -57.38 0.08 OUTLIER Glycine 0 N--CA 1.438 -1.204 0 CA-C-O 117.122 -1.932 . . . . 10.0 110.37 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.1 mt -118.34 106.4 19.61 Favored 'Isoleucine or valine' 0 C--O 1.242 0.683 0 N-CA-C 104.135 -2.543 . . . . 10.0 104.135 -179.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.47 ' HB2' HG23 ' A' ' 25' ' ' VAL . 0.0 OUTLIER 82.33 -51.08 0.21 Allowed 'General case' 0 CA--C 1.54 0.573 0 O-C-N 125.734 1.896 . . . . 10.0 112.293 179.881 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 74.55 102.43 0.07 Allowed 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 116.09 1.885 . . . . 10.0 116.09 179.857 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 18.0 ttp85 -163.64 121.93 1.92 Allowed 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 122.159 0.98 . . . . 10.0 109.818 179.739 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.16 152.39 30.75 Favored 'General case' 0 CA--C 1.508 -0.665 0 N-CA-C 103.424 -2.806 . . . . 10.0 103.424 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 2.8 m -143.17 -168.55 2.83 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 124.145 0.978 . . . . 10.0 108.593 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 9.1 mmm -133.14 97.56 4.03 Favored 'General case' 0 C--N 1.315 -0.9 1 N-CA-C 98.333 -4.691 . . . . 10.0 98.333 179.674 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.2 m -108.93 131.71 54.77 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 116.937 2.199 . . . . 10.0 116.937 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 3.2 m -123.85 131.49 53.59 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 104.76 -2.311 . . . . 10.0 104.76 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.507 HG22 HD11 ' A' ' 93' ' ' LEU . 0.3 OUTLIER -98.86 150.35 5.03 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.999 0 N-CA-C 101.379 -3.563 . . . . 10.0 101.379 179.778 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.411 ' O ' HD22 ' A' ' 93' ' ' LEU . 3.3 m -157.4 160.23 38.18 Favored 'General case' 0 C--N 1.319 -0.75 0 O-C-N 125.564 1.79 . . . . 10.0 114.798 -179.82 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 7.6 p90 -118.3 136.23 53.82 Favored 'General case' 0 N--CA 1.465 0.311 0 O-C-N 124.083 0.864 . . . . 10.0 109.097 -179.69 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -101.33 -57.9 1.99 Allowed 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 103.075 -2.935 . . . . 10.0 103.075 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -155.3 -120.84 0.72 Allowed Glycine 0 N--CA 1.434 -1.441 0 N-CA-C 105.18 -3.168 . . . . 10.0 105.18 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -70.42 -18.37 63.01 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 118.971 1.386 . . . . 10.0 110.565 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.404 ' HB2' ' HE3' ' A' ' 92' ' ' LYS . 9.0 mtmt -88.41 -174.36 4.57 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 106.796 -1.557 . . . . 10.0 106.796 -179.802 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.507 HD11 HG22 ' A' ' 86' ' ' VAL . 1.2 tm? -151.18 124.83 9.03 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 104.698 -2.334 . . . . 10.0 104.698 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . 0.427 ' N ' HD13 ' A' ' 93' ' ' LEU . 8.9 mm-40 -111.52 160.68 16.93 Favored 'General case' 0 CA--C 1.502 -0.872 0 CA-C-N 113.51 -1.677 . . . . 10.0 113.914 -179.797 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 4.2 t -140.78 135.45 31.5 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 118.29 -0.862 . . . . 10.0 109.453 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 44.3 t -119.92 91.34 1.8 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.74 0 O-C-N 126.941 2.651 . . . . 10.0 106.919 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -91.94 72.24 5.61 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 123.901 1.81 . . . . 10.0 112.306 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 31.1 tttp -71.82 90.96 1.12 Allowed 'General case' 0 C--O 1.225 -0.23 0 O-C-N 120.194 -1.566 . . . . 10.0 109.409 179.588 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -139.83 82.17 0.25 Allowed Glycine 0 C--O 1.226 -0.396 0 N-CA-C 108.258 -1.937 . . . . 10.0 108.258 -179.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 59.12 178.36 0.08 Allowed 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 114.791 1.404 . . . . 10.0 114.791 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 37.5 mttt 55.26 175.24 0.03 OUTLIER 'General case' 0 C--O 1.24 0.563 0 N-CA-C 116.241 1.941 . . . . 10.0 116.241 179.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -107.12 116.65 32.29 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 126.383 1.873 . . . . 10.0 108.493 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 90.32 66.48 1.2 Allowed Glycine 0 C--O 1.224 -0.495 0 N-CA-C 116.22 1.248 . . . . 10.0 116.22 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.512 ' NH2' HD21 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -130.78 136.43 48.71 Favored 'General case' 0 N--CA 1.444 -0.749 0 O-C-N 124.356 0.68 . . . . 10.0 111.489 -179.895 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 143.66 163.31 9.8 Favored Glycine 0 N--CA 1.441 -0.972 0 O-C-N 126.411 2.32 . . . . 10.0 108.636 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 32.0 m0 -119.81 174.37 6.48 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 119.053 1.426 . . . . 10.0 112.43 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . 0.498 ' O ' HD12 ' A' ' 117' ' ' LEU . 16.0 m -151.64 128.33 10.84 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 109.561 -0.533 . . . . 10.0 109.561 179.894 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.551 ' NE2' HD13 ' A' ' 117' ' ' LEU . 59.8 mm-40 -106.44 156.6 18.37 Favored 'General case' 0 C--N 1.319 -0.729 0 O-C-N 125.95 2.031 . . . . 10.0 111.346 -179.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 1.5 t90 -171.98 119.3 0.42 Allowed 'General case' 0 N--CA 1.478 0.953 0 CA-C-O 123.297 1.523 . . . . 10.0 106.978 -179.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 60.6 mt -98.7 152.06 4.43 Favored 'Isoleucine or valine' 0 C--O 1.241 0.647 0 N-CA-C 117.367 2.358 . . . . 10.0 117.367 -179.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -130.15 -168.67 2.0 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 103.391 -2.818 . . . . 10.0 103.391 -179.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -68.0 -59.15 6.67 Favored Glycine 0 N--CA 1.469 0.856 0 O-C-N 120.678 -1.264 . . . . 10.0 110.035 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.429 ' HA ' ' HG2' ' A' ' 132' ' ' LYS . 0.1 OUTLIER -117.8 9.63 13.01 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 119.655 1.727 . . . . 10.0 113.292 179.719 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -128.53 -159.75 0.97 Allowed 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 115.618 1.71 . . . . 10.0 115.618 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.589 ' CD1' ' CD2' ' A' ' 8' ' ' TRP . 0.4 OUTLIER -171.86 134.53 0.79 Allowed 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 106.451 -1.685 . . . . 10.0 106.451 179.904 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -117.38 86.64 2.55 Favored 'General case' 0 C--O 1.236 0.372 0 O-C-N 125.044 1.465 . . . . 10.0 109.41 -179.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.551 HD13 ' NE2' ' A' ' 108' ' ' GLN . 1.5 tp -95.26 148.0 22.87 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.059 -1.089 . . . . 10.0 108.059 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -127.12 157.22 40.27 Favored 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 106.924 -1.51 . . . . 10.0 106.924 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 18.9 mtm -142.68 114.42 8.07 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 123.715 1.721 . . . . 10.0 108.694 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 5.9 ttp180 -104.64 129.8 52.74 Favored 'General case' 0 CA--C 1.506 -0.734 0 CA-C-O 122.37 1.081 . . . . 10.0 112.9 179.405 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -148.39 118.87 7.4 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 114.423 -1.262 . . . . 10.0 107.799 -179.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 37.68 47.45 0.82 Allowed 'General case' 0 C--O 1.243 0.76 0 O-C-N 126.626 2.454 . . . . 10.0 117.344 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 91.06 -4.26 81.15 Favored Glycine 0 C--N 1.337 0.585 0 C-N-CA 119.022 -1.561 . . . . 10.0 114.011 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.575 HG11 ' HA ' ' A' ' 19' ' ' TYR . 0.3 OUTLIER -96.95 151.62 4.11 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.514 0 N-CA-C 107.624 -1.25 . . . . 10.0 107.624 179.695 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 2.9 m -134.66 102.54 5.32 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 113.954 -1.475 . . . . 10.0 111.875 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -115.1 134.41 55.19 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 105.844 -1.91 . . . . 10.0 105.844 179.892 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 14.0 mtmm -127.3 125.13 40.31 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 115.444 1.646 . . . . 10.0 115.444 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 1.2 mm100 -99.21 113.52 25.83 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-N 114.389 -1.278 . . . . 10.0 109.697 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 8.0 t -96.74 127.25 49.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 N-CA-C 104.666 -2.346 . . . . 10.0 104.666 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . 0.518 ' CE2' ' HB2' ' A' ' 40' ' ' LYS . 8.1 m-30 -110.25 144.67 38.59 Favored 'General case' 0 N--CA 1.441 -0.891 0 C-N-CA 124.188 0.995 . . . . 10.0 112.678 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.574 ' HB2' HD12 ' A' ' 11' ' ' LEU . 6.3 tptm -127.72 92.4 3.48 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 105.765 -1.939 . . . . 10.0 105.765 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . 0.429 ' HG2' ' HA ' ' A' ' 113' ' ' ASP . 11.0 ptpt -53.38 129.85 33.33 Favored 'General case' 0 CA--C 1.503 -0.83 0 CA-C-O 125.736 2.684 . . . . 10.0 111.259 -179.714 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . 0.413 ' O ' HG13 ' A' ' 133' ' ' VAL . 0.3 OUTLIER -83.7 -3.0 7.27 Favored 'Isoleucine or valine' 0 C--O 1.236 0.342 0 O-C-N 120.041 -1.662 . . . . 10.0 111.69 -179.92 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . 0.407 ' CD2' ' C ' ' A' ' 134' ' ' HIS . 4.5 t60 . . . . . 0 C--N 1.314 -0.937 0 O-C-N 125.47 1.731 . . . . 10.0 110.684 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo . . . . . 0 N--CA 1.482 0.81 0 CA-C-O 117.03 -1.321 . . . . 10.0 112.307 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.534 HG22 ' O ' ' A' ' 2' ' ' VAL . 5.2 p 23.97 59.64 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 O-C-N 127.828 3.205 . . . . 10.0 113.503 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 43.1 p-10 -117.85 55.66 0.87 Allowed 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 124.26 1.981 . . . . 10.0 109.286 -179.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 41.9 m-85 -54.05 -13.51 0.82 Allowed 'General case' 0 C--O 1.242 0.662 0 CA-C-O 116.616 -1.659 . . . . 10.0 114.568 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -53.92 131.32 39.92 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-O 124.34 2.019 . . . . 10.0 113.793 179.623 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 155.14 165.0 13.58 Favored Glycine 0 CA--C 1.528 0.902 0 O-C-N 119.778 -1.826 . . . . 10.0 114.002 179.809 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.505 ' HA ' ' HA ' ' A' ' 41' ' ' GLU . 1.9 m-30 -104.73 121.78 44.31 Favored 'General case' 0 C--O 1.243 0.755 0 CA-C-O 116.565 -1.683 . . . . 10.0 106.756 179.61 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.769 ' CE2' ' HB2' ' A' ' 40' ' ' LYS . 1.1 p-90 -113.59 145.88 40.58 Favored 'General case' 0 N--CA 1.44 -0.955 0 CA-C-O 123.37 1.557 . . . . 10.0 115.042 179.601 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.5 ptpp? -121.85 120.0 33.24 Favored 'General case' 0 N--CA 1.437 -1.097 0 N-CA-C 105.16 -2.163 . . . . 10.0 105.16 -179.422 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.517 ' HB3' ' CZ3' ' A' ' 8' ' ' TRP . 6.7 ptm -68.66 142.14 55.16 Favored 'General case' 0 CA--C 1.506 -0.727 0 O-C-N 118.834 -2.416 . . . . 10.0 115.697 -179.596 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 12.1 tp -97.75 -33.88 11.11 Favored 'General case' 0 CA--C 1.508 -0.652 0 O-C-N 120.303 -1.498 . . . . 10.0 109.609 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -152.57 152.08 31.42 Favored 'General case' 0 CA--C 1.515 -0.399 0 N-CA-C 115.388 1.625 . . . . 10.0 115.388 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -134.9 132.6 38.7 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 106.807 -1.553 . . . . 10.0 106.807 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -132.29 162.59 30.63 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 119.249 0.931 . . . . 10.0 113.023 179.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 2.7 m120 37.65 25.81 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.472 0 O-C-N 126.918 2.636 . . . . 10.0 116.851 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -65.35 -31.99 73.4 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 118.862 -2.399 . . . . 10.0 114.218 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -65.77 -41.82 91.59 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 115.437 1.643 . . . . 10.0 115.437 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -79.82 -22.08 43.46 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 107.007 -1.479 . . . . 10.0 107.007 179.666 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.561 ' CZ ' HD11 ' A' ' 23' ' ' LEU . 2.9 t80 -66.84 -36.94 83.49 Favored 'General case' 0 CA--C 1.55 0.958 0 O-C-N 121.023 -1.048 . . . . 10.0 111.137 -179.582 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 20.5 mt -71.69 -39.18 70.38 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 125.356 1.462 . . . . 10.0 111.015 179.82 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 22.4 ttp180 -71.84 -28.18 63.38 Favored 'General case' 0 C--O 1.244 0.806 0 O-C-N 124.859 1.349 . . . . 10.0 110.704 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.36 -42.97 95.94 Favored 'General case' 0 C--O 1.212 -0.873 0 C-N-CA 124.266 1.026 . . . . 10.0 113.652 -179.814 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.561 HD11 ' CZ ' ' A' ' 19' ' ' TYR . 0.3 OUTLIER -91.84 -22.97 19.83 Favored 'General case' 0 C--N 1.345 0.374 0 CA-C-O 122.216 1.008 . . . . 10.0 113.461 -179.966 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.6 t0 66.29 70.55 0.41 Allowed 'General case' 0 N--CA 1.481 1.078 0 O-C-N 119.644 -1.91 . . . . 10.0 112.173 179.423 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.502 HG21 HD22 ' A' ' 29' ' ' LEU . 0.2 OUTLIER -93.34 -51.35 11.31 Favored 'Isoleucine or valine' 0 C--O 1.242 0.675 0 N-CA-C 106.337 -1.727 . . . . 10.0 106.337 -179.822 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 177.92 152.26 0.27 Allowed 'General case' 0 C--O 1.243 0.749 0 N-CA-C 116.788 2.144 . . . . 10.0 116.788 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.41 ' CG1' ' N ' ' A' ' 28' ' ' ALA . 0.3 OUTLIER -74.53 -37.76 44.62 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 C-N-CA 125.464 1.505 . . . . 10.0 113.75 -179.601 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.41 ' N ' ' CG1' ' A' ' 27' ' ' VAL . . . -76.4 -31.79 58.16 Favored 'General case' 0 C--N 1.319 -0.729 0 O-C-N 126.147 2.154 . . . . 10.0 112.959 179.896 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.502 HD22 HG21 ' A' ' 25' ' ' VAL . 2.1 tp -68.28 -29.57 68.39 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.9 0.704 . . . . 10.0 112.9 179.794 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.41 -30.5 70.28 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 113.307 0.855 . . . . 10.0 113.307 -179.803 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.62 -37.89 41.12 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 113.242 -1.799 . . . . 10.0 110.289 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.543 HD13 ' CZ ' ' A' ' 57' ' ' PHE . 48.1 mt -77.37 -48.38 24.63 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 O-C-N 119.746 -1.846 . . . . 10.0 112.821 -179.387 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -55.8 -33.91 64.84 Favored 'General case' 0 C--O 1.216 -0.692 0 CA-C-O 117.699 -1.143 . . . . 10.0 113.799 179.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -69.39 -9.57 54.11 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 115.078 1.51 . . . . 10.0 115.078 179.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.5 mt -104.57 14.17 30.39 Favored 'General case' 0 C--N 1.315 -0.907 0 O-C-N 124.973 1.421 . . . . 10.0 111.188 179.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -128.85 147.76 50.84 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.095 0.958 . . . . 10.0 110.572 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 4.6 mttt -129.88 73.35 81.51 Favored Pre-proline 0 C--O 1.218 -0.562 0 N-CA-C 106.27 -1.752 . . . . 10.0 106.27 -179.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 9.0 Cg_endo -52.93 128.52 29.15 Favored 'Trans proline' 0 N--CA 1.451 -1.004 0 O-C-N 125.418 2.272 . . . . 10.0 116.104 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -106.48 142.53 35.99 Favored 'General case' 0 C--N 1.316 -0.854 0 O-C-N 128.458 3.599 . . . . 10.0 104.724 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.769 ' HB2' ' CE2' ' A' ' 8' ' ' TRP . 1.4 ttmt -112.6 177.79 4.51 Favored 'General case' 0 C--O 1.21 -0.991 0 O-C-N 124.796 1.31 . . . . 10.0 112.262 -179.601 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.505 ' HA ' ' HA ' ' A' ' 7' ' ' TYR . 2.2 tt0 -158.26 120.7 3.71 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 104.887 -2.264 . . . . 10.0 104.887 -179.479 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 19.0 mm -103.14 152.6 5.89 Favored 'Isoleucine or valine' 0 C--O 1.242 0.69 0 O-C-N 125.555 1.785 . . . . 10.0 112.622 179.648 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 62.4 t -154.25 98.72 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 CA-C-N 113.369 -1.741 . . . . 10.0 108.538 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -98.61 118.61 35.7 Favored 'General case' 0 C--N 1.311 -1.068 0 C-N-CA 125.056 1.342 . . . . 10.0 107.532 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -93.58 18.76 9.46 Favored 'General case' 0 C--O 1.24 0.587 0 CA-C-O 117.429 -1.272 . . . . 10.0 108.032 -179.82 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 113.77 -100.28 1.04 Allowed Glycine 0 CA--C 1.523 0.536 0 N-CA-C 107.634 -2.187 . . . . 10.0 107.634 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.423 ' HA ' HG12 ' A' ' 66' ' ' VAL . 0.0 OUTLIER -86.1 -29.04 23.65 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 121.493 -1.004 . . . . 10.0 109.322 179.854 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -95.78 121.79 37.88 Favored 'General case' 0 CA--C 1.509 -0.609 0 N-CA-C 107.777 -1.194 . . . . 10.0 107.777 179.834 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 9.0 ttt -114.64 124.2 51.22 Favored 'General case' 0 CA--C 1.504 -0.827 0 CA-C-O 123.102 1.43 . . . . 10.0 112.285 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.484 ' C ' HD13 ' A' ' 51' ' ' ILE . 30.7 mm -108.81 122.05 62.83 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.29 0 N-CA-C 107.393 -1.336 . . . . 10.0 107.393 -179.764 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.53 ' N ' HD13 ' A' ' 51' ' ' ILE . 1.5 mm -107.87 135.97 44.78 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 N-CA-C 105.253 -2.129 . . . . 10.0 105.253 179.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 12.7 mtm-85 -133.7 122.58 23.6 Favored 'General case' 0 CA--C 1.51 -0.582 0 C-N-CA 119.978 -0.689 . . . . 10.0 112.361 -179.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 58.3 m -98.42 129.38 45.05 Favored 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 102.492 -3.151 . . . . 10.0 102.492 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 8.8 mt -117.71 54.24 0.91 Allowed 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 119.398 3.111 . . . . 10.0 119.398 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 60.6 p -73.54 -172.75 1.27 Allowed 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 103.864 -2.643 . . . . 10.0 103.864 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 8.0 p -120.56 -13.42 8.78 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-O 118.667 -0.682 . . . . 10.0 111.973 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.543 ' CZ ' HD13 ' A' ' 32' ' ' ILE . 19.5 t80 -81.16 -46.38 14.97 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.36 -0.978 . . . . 10.0 108.36 -179.928 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.37 143.21 16.25 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-O 123.906 1.813 . . . . 10.0 112.879 -179.856 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -87.82 142.84 27.49 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 114.067 -1.424 . . . . 10.0 107.964 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.404 ' C ' HD13 ' A' ' 61' ' ' ILE . 1.9 t80 -149.87 118.48 6.54 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 126.689 2.493 . . . . 10.0 105.206 -179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.445 HG22 ' H ' ' A' ' 62' ' ' MET . 0.0 OUTLIER -109.44 -175.13 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.313 -1.006 0 O-C-N 124.943 1.402 . . . . 10.0 112.598 179.92 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.445 ' H ' HG22 ' A' ' 61' ' ' ILE . 2.3 mtm -143.21 -179.58 6.48 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 106.931 -1.507 . . . . 10.0 106.931 -179.772 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 64.7 t0 -162.12 80.92 0.55 Allowed 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 102.889 -3.004 . . . . 10.0 102.889 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 2.0 m-30 -88.67 166.15 14.29 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 125.2 1.562 . . . . 10.0 112.207 179.865 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.409 ' O ' HG13 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -144.25 126.0 15.17 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 103.8 -2.667 . . . . 10.0 103.8 179.988 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.423 HG12 ' HA ' ' A' ' 47' ' ' ASP . 2.0 p -89.88 133.8 30.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 O-C-N 124.658 1.224 . . . . 10.0 108.453 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 91.1 -12.3 69.56 Favored Glycine 0 C--O 1.219 -0.811 0 C-N-CA 120.168 -1.015 . . . . 10.0 115.251 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.2 mttm -109.3 -173.19 2.21 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 117.44 0.62 . . . . 10.0 112.359 179.844 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -131.32 139.93 49.65 Favored 'General case' 0 C--N 1.314 -0.94 0 O-C-N 125.223 1.577 . . . . 10.0 107.533 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 10.5 p90 -154.5 135.33 13.68 Favored 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 118.597 -1.241 . . . . 10.0 110.173 179.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.13 155.86 22.4 Favored 'General case' 0 C--O 1.222 -0.393 0 N-CA-C 106.316 -1.735 . . . . 10.0 106.316 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -156.24 116.76 3.71 Favored 'General case' 0 N--CA 1.438 -1.071 0 N-CA-C 117.614 2.45 . . . . 10.0 117.614 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 -83.29 91.65 7.34 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 105.236 -2.135 . . . . 10.0 105.236 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 13.0 mt -62.15 3.43 0.17 Allowed 'General case' 0 N--CA 1.438 -1.068 0 N-CA-C 117.88 2.548 . . . . 10.0 117.88 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.408 HG23 ' H ' ' A' ' 75' ' ' THR . 50.8 p -41.97 109.65 0.14 Allowed 'General case' 0 C--O 1.24 0.575 0 O-C-N 125.76 1.913 . . . . 10.0 108.98 179.699 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . 0.728 ' C ' HD13 ' A' ' 77' ' ' ILE . . . 134.9 -30.25 2.86 Favored Glycine 0 CA--C 1.525 0.706 0 CA-C-N 113.21 -1.813 . . . . 10.0 109.8 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.728 HD13 ' C ' ' A' ' 76' ' ' GLY . 2.5 mm -128.3 -17.1 2.36 Favored 'Isoleucine or valine' 0 C--O 1.247 0.938 0 CA-C-N 117.774 0.787 . . . . 10.0 111.43 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -144.44 -40.49 0.27 Allowed 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 117.641 -1.171 . . . . 10.0 113.195 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 93.53 -23.22 0.06 Allowed 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 126.987 2.115 . . . . 10.0 113.651 -179.824 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -94.7 166.71 11.87 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 117.367 -1.301 . . . . 10.0 112.932 -179.758 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.86 168.57 12.59 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 103.143 -2.91 . . . . 10.0 103.143 -179.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -153.06 -170.83 3.74 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 113.914 -1.494 . . . . 10.0 110.282 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.6 mmt -119.98 49.36 1.41 Allowed 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 101.387 -3.56 . . . . 10.0 101.387 179.772 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 42.3 m -44.93 104.23 0.04 OUTLIER 'General case' 0 N--CA 1.439 -1.003 0 N-CA-C 119.243 3.053 . . . . 10.0 119.243 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 22.7 m -102.34 133.99 46.37 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 105.359 -2.089 . . . . 10.0 105.359 -179.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.409 HG13 ' O ' ' A' ' 65' ' ' GLN . 0.2 OUTLIER -117.57 109.87 28.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 102.956 -2.979 . . . . 10.0 102.956 -179.828 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 17.3 m -104.05 166.42 10.42 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 115.888 -0.596 . . . . 10.0 111.484 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 11.5 p-90 -126.61 55.09 1.55 Allowed 'General case' 0 CA--C 1.511 -0.544 0 CA-C-O 125.027 2.346 . . . . 10.0 109.991 -179.744 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -66.4 109.25 2.65 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 101.343 -3.577 . . . . 10.0 101.343 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 81.93 -154.4 33.78 Favored Glycine 0 N--CA 1.446 -0.696 0 N-CA-C 108.273 -1.931 . . . . 10.0 108.273 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -103.46 42.42 1.17 Allowed 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 123.073 1.416 . . . . 10.0 109.846 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 7.2 mtmt -122.27 -166.16 1.37 Allowed 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 113.195 -1.821 . . . . 10.0 108.228 179.82 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 5.2 tt -141.33 102.57 4.25 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 105.573 -2.01 . . . . 10.0 105.573 -179.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -113.77 118.99 35.83 Favored 'General case' 0 CA--C 1.507 -0.674 0 O-C-N 120.81 -1.181 . . . . 10.0 112.84 179.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 19.9 p -127.51 148.41 50.32 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 112.828 0.677 . . . . 10.0 112.828 179.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 88.9 t -126.33 125.75 68.09 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.75 0 N-CA-C 106.399 -1.704 . . . . 10.0 106.399 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 59.3 mt-30 -107.84 57.96 0.62 Allowed 'General case' 0 C--N 1.317 -0.822 0 O-C-N 126.654 2.471 . . . . 10.0 110.997 -179.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 1.5 mmmm -9.41 -92.23 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.602 0 O-C-N 128.032 3.333 . . . . 10.0 115.754 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 43.73 38.06 4.16 Favored Glycine 0 N--CA 1.44 -1.044 0 CA-C-O 118.025 -1.431 . . . . 10.0 113.054 179.551 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 68.03 -141.01 0.11 Allowed 'General case' 0 C--N 1.32 -0.698 0 O-C-N 125.723 1.484 . . . . 10.0 111.09 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 2.1 mmmm 57.32 174.1 0.05 OUTLIER 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 117.293 2.331 . . . . 10.0 117.293 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 45.8 mm-40 -82.06 -44.26 16.82 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 126.589 1.956 . . . . 10.0 109.423 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -113.26 -102.33 2.55 Favored Glycine 0 N--CA 1.444 -0.812 0 CA-C-O 122.641 1.134 . . . . 10.0 115.776 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 2.4 mtt180 63.19 91.83 0.07 Allowed 'General case' 0 CA--C 1.535 0.383 0 O-C-N 120.765 -1.432 . . . . 10.0 114.166 179.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 166.3 155.68 9.01 Favored Glycine 0 N--CA 1.447 -0.631 0 O-C-N 126.284 2.24 . . . . 10.0 108.163 -179.796 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 1.6 m0 -114.43 169.29 9.15 Favored 'General case' 0 CA--C 1.505 -0.75 0 O-C-N 125.314 1.244 . . . . 10.0 109.969 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 2.2 m -149.65 118.38 6.6 Favored 'General case' 0 CA--C 1.506 -0.728 0 N-CA-C 107.577 -1.268 . . . . 10.0 107.577 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -112.55 117.07 31.31 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.986 -179.719 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 1.5 p90 -137.07 140.59 42.1 Favored 'General case' 0 C--O 1.217 -0.607 0 N-CA-C 107.201 -1.407 . . . . 10.0 107.201 179.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 60.7 mt -96.18 159.76 2.92 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.004 0 N-CA-C 114.506 1.299 . . . . 10.0 114.506 179.609 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -166.97 113.32 0.79 Allowed 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 116.939 -1.505 . . . . 10.0 107.208 -179.73 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 53.51 40.78 62.9 Favored Glycine 0 N--CA 1.464 0.544 0 N-CA-C 106.447 -2.661 . . . . 10.0 106.447 179.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 64.0 9.41 4.59 Favored 'General case' 0 CA--C 1.552 1.054 0 CA-C-O 117.396 -1.287 . . . . 10.0 111.035 179.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -100.27 90.61 4.4 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 124.06 0.85 . . . . 10.0 110.184 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.417 ' HB3' ' HB2' ' A' ' 130' ' ' PHE . 12.1 tp -57.83 118.96 5.87 Favored 'General case' 0 N--CA 1.444 -0.764 0 N-CA-C 106.887 -1.523 . . . . 10.0 106.887 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . 0.545 ' CE1' HG12 ' A' ' 129' ' ' VAL . 1.4 m-70 -112.83 103.22 11.21 Favored 'General case' 0 CA--C 1.5 -0.968 0 O-C-N 125.772 1.92 . . . . 10.0 107.401 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 42.4 tp -93.55 143.9 25.87 Favored 'General case' 0 C--O 1.241 0.615 0 O-C-N 119.282 -2.136 . . . . 10.0 113.385 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 66.6 tt0 -130.32 123.57 30.29 Favored 'General case' 0 C--O 1.217 -0.607 0 CA-C-O 117.636 -1.173 . . . . 10.0 109.661 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 6.5 mtt -116.63 153.45 32.26 Favored 'General case' 0 C--O 1.239 0.546 0 O-C-N 124.295 0.997 . . . . 10.0 110.599 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 1.1 mmm-85 -147.6 139.99 24.52 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 117.935 -1.031 . . . . 10.0 110.644 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -153.98 117.09 4.52 Favored 'General case' 0 N--CA 1.443 -0.805 0 O-C-N 124.527 1.142 . . . . 10.0 111.342 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 56.28 39.88 30.05 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 116.953 2.205 . . . . 10.0 116.953 179.789 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 87.79 -6.43 83.47 Favored Glycine 0 CA--C 1.539 1.546 0 CA-C-O 118.663 -1.076 . . . . 10.0 112.272 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 2.0 t -98.9 131.92 45.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 125.213 1.405 . . . . 10.0 108.206 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 94.3 m -111.67 140.2 46.5 Favored 'General case' 0 N--CA 1.446 -0.642 0 O-C-N 125.724 1.89 . . . . 10.0 110.822 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -129.16 145.46 51.31 Favored 'General case' 0 C--O 1.221 -0.417 0 N-CA-C 106.043 -1.836 . . . . 10.0 106.043 -179.911 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 2.2 mtmm -137.44 141.83 41.61 Favored 'General case' 0 C--N 1.328 -0.343 0 O-C-N 120.431 -1.418 . . . . 10.0 114.141 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -132.99 130.46 39.52 Favored 'General case' 0 CA--C 1.503 -0.854 0 O-C-N 125.209 1.568 . . . . 10.0 109.815 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.545 HG12 ' CE1' ' A' ' 116' ' ' HIS . 0.0 OUTLIER -106.15 96.33 4.52 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.379 0 C-N-CA 124.005 0.922 . . . . 10.0 110.543 179.92 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . 0.488 ' CZ ' ' CZ2' ' A' ' 8' ' ' TRP . 5.5 m-85 -83.86 175.98 9.23 Favored 'General case' 0 C--N 1.321 -0.631 0 O-C-N 126.637 2.461 . . . . 10.0 109.054 -179.766 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 23.4 tptp -148.27 98.39 2.91 Favored 'General case' 0 N--CA 1.44 -0.935 0 N-CA-C 106.852 -1.536 . . . . 10.0 106.852 179.754 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 7.7 ttpt -63.5 122.9 17.41 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 125.636 1.835 . . . . 10.0 108.795 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 24.6 t -102.45 -57.3 4.57 Favored 'Isoleucine or valine' 0 C--O 1.244 0.809 0 N-CA-C 113.911 1.078 . . . . 10.0 113.911 179.665 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 3.3 t-80 . . . . . 0 C--O 1.244 0.8 0 C-N-CA 118.086 -1.446 . . . . 10.0 113.828 179.824 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo . . . . . 0 CA--C 1.533 0.455 0 CA-C-O 117.174 -1.261 . . . . 10.0 109.459 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.402 ' O ' HG12 ' A' ' 2' ' ' VAL . 21.5 t -6.23 69.69 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.243 0.73 0 O-C-N 128.787 3.804 . . . . 10.0 114.118 -179.789 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -75.69 129.6 37.37 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 114.734 -1.121 . . . . 10.0 108.654 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 2.8 m-30 -72.41 -28.18 62.82 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 115.999 1.851 . . . . 10.0 115.999 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.4 p30 -68.13 139.32 56.16 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-N 120.921 1.691 . . . . 10.0 114.389 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -156.5 -93.12 0.09 OUTLIER Glycine 0 C--O 1.216 -1.006 0 N-CA-C 119.114 2.406 . . . . 10.0 119.114 -179.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.499 ' HA ' ' CE3' ' A' ' 8' ' ' TRP . 0.8 OUTLIER 172.7 170.91 0.12 Allowed 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 103.501 -2.778 . . . . 10.0 103.501 179.362 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.733 ' HA ' ' HB3' ' A' ' 132' ' ' LYS 0.331 32.0 p90 -152.05 159.25 43.75 Favored 'General case' 0 N--CA 1.441 -0.899 0 N-CA-C 115.459 1.651 . . . . 10.0 115.459 -178.116 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.519 ' HD3' ' CG ' ' A' ' 132' ' ' LYS . 2.3 pttp -167.28 88.38 0.3 Allowed 'General case' 0 C--O 1.216 -0.709 0 O-C-N 127.879 3.237 . . . . 10.0 108.313 175.844 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.538 ' HE1' ' HD2' ' A' ' 38' ' ' PRO . 2.1 ttp -54.49 140.12 35.44 Favored 'General case' 0 CA--C 1.509 -0.616 0 N-CA-C 116.521 2.045 . . . . 10.0 116.521 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.8 tp -101.73 -42.95 6.0 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 114.448 -1.251 . . . . 10.0 108.07 179.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -162.0 161.71 28.62 Favored 'General case' 0 C--O 1.244 0.792 0 O-C-N 125.377 1.673 . . . . 10.0 115.446 179.663 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -135.43 173.25 11.93 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 105.247 -2.131 . . . . 10.0 105.247 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -162.19 151.84 16.17 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 119.889 -1.757 . . . . 10.0 115.497 179.616 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 57.51 27.46 14.07 Favored 'General case' 0 C--N 1.324 -0.541 0 O-C-N 127.084 2.74 . . . . 10.0 115.582 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.4 ' CD1' ' N ' ' A' ' 16' ' ' PHE . 0.0 OUTLIER -56.55 -29.56 62.09 Favored 'General case' 0 C--O 1.244 0.784 0 C-N-CA 126.045 1.738 . . . . 10.0 114.932 179.931 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -78.66 -43.43 26.15 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 120.414 1.461 . . . . 10.0 109.169 179.186 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.08 -21.95 63.1 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-O 117.834 -1.079 . . . . 10.0 110.884 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -72.76 -36.04 67.59 Favored 'General case' 0 CA--C 1.552 1.052 0 O-C-N 124.79 1.306 . . . . 10.0 109.783 -179.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.625 HD22 HG11 ' A' ' 25' ' ' VAL . 75.0 mt -74.17 -27.96 61.07 Favored 'General case' 0 C--O 1.22 -0.454 0 CA-C-N 114.022 -1.444 . . . . 10.0 111.207 -179.83 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.5 ttt180 -73.47 -23.48 60.08 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 114.099 -1.409 . . . . 10.0 110.057 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.24 -24.62 62.22 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 122.258 1.028 . . . . 10.0 112.205 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.5 mt -109.71 -1.28 18.1 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 114.222 -1.354 . . . . 10.0 114.444 -179.784 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 55.68 72.06 0.51 Allowed 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 118.884 0.766 . . . . 10.0 111.415 179.717 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.625 HG11 HD22 ' A' ' 20' ' ' LEU . 2.2 p -94.58 -109.94 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.24 0.563 0 CA-C-O 117.084 -1.436 . . . . 10.0 107.416 179.965 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.58 ' N ' HG22 ' A' ' 25' ' ' VAL . 0.9 OUTLIER -148.37 161.99 40.46 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-N 120.437 1.471 . . . . 10.0 113.582 179.761 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -77.25 -20.0 14.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 O-C-N 125.876 1.985 . . . . 10.0 114.017 -179.6 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -77.32 -34.18 55.39 Favored 'General case' 0 C--O 1.242 0.677 0 O-C-N 125.274 1.609 . . . . 10.0 109.326 179.784 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.492 HD23 HG21 ' A' ' 25' ' ' VAL . 44.8 tp -77.91 -40.01 41.14 Favored 'General case' 0 C--O 1.222 -0.392 0 C-N-CA 118.393 -1.323 . . . . 10.0 113.487 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 8.8 mtm-85 -59.09 -23.26 61.92 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 125.65 1.58 . . . . 10.0 114.163 179.714 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.7 ttpp -76.53 -43.25 40.07 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 117.844 -1.074 . . . . 10.0 109.971 179.784 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.404 HD12 ' CE1' ' A' ' 57' ' ' PHE . 0.8 OUTLIER -79.52 -40.94 21.91 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 O-C-N 125.709 1.881 . . . . 10.0 109.807 -179.835 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -55.4 -58.6 7.06 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-O 121.83 0.824 . . . . 10.0 112.094 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -64.89 82.28 0.04 OUTLIER 'General case' 0 C--N 1.342 0.265 0 CA-C-N 113.775 -1.557 . . . . 10.0 110.247 179.746 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 162.77 -32.59 0.0 OUTLIER 'General case' 0 N--CA 1.444 -0.77 0 O-C-N 126.112 2.132 . . . . 10.0 111.144 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.5 mt -88.98 155.38 19.53 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 124.372 1.045 . . . . 10.0 111.096 179.562 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.1 pttt -138.35 105.64 7.82 Favored Pre-proline 0 C--N 1.319 -0.723 0 N-CA-C 103.911 -2.625 . . . . 10.0 103.911 179.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.538 ' HD2' ' HE1' ' A' ' 10' ' ' MET . 95.8 Cg_exo -51.15 -166.68 0.0 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.327 0 C-N-CA 125.04 3.827 . . . . 10.0 119.123 179.785 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.601 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 4.7 p30 -153.22 167.79 28.13 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 112.724 -2.035 . . . . 10.0 106.522 -179.555 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.45 ' HB2' ' CZ ' ' A' ' 130' ' ' PHE . 0.3 OUTLIER -149.97 121.07 7.74 Favored 'General case' 0 CA--C 1.497 -1.085 0 C-N-CA 116.994 -1.882 . . . . 10.0 112.819 -179.433 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.626 ' HA ' ' CE3' ' A' ' 8' ' ' TRP . 2.4 tt0 -110.36 103.12 11.73 Favored 'General case' 0 CA--C 1.509 -0.611 0 O-C-N 119.95 -1.719 . . . . 10.0 106.91 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 67.6 mt -93.44 130.13 42.89 Favored 'Isoleucine or valine' 0 C--O 1.243 0.737 0 CA-C-N 115.115 -0.948 . . . . 10.0 108.906 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -119.13 122.65 69.76 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.934 0 N-CA-C 107.04 -1.467 . . . . 10.0 107.04 -179.885 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -143.78 107.05 4.54 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 105.921 -1.881 . . . . 10.0 105.921 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -81.03 -51.44 8.5 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 123.281 1.515 . . . . 10.0 107.822 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -155.15 -83.93 0.04 OUTLIER Glycine 0 C--N 1.345 1.06 0 N-CA-C 108.916 -1.674 . . . . 10.0 108.916 -179.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -111.27 -1.61 16.01 Favored 'General case' 0 N--CA 1.443 -0.817 0 O-C-N 121.124 -1.221 . . . . 10.0 109.658 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 65.9 m170 -107.5 102.87 12.1 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 109.085 -0.709 . . . . 10.0 109.085 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 2.5 ttt -95.15 151.13 19.47 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 116.495 2.035 . . . . 10.0 116.495 -179.843 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 19.4 mt -145.64 127.42 8.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 105.939 -1.874 . . . . 10.0 105.939 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.4 mp -112.2 123.66 68.15 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 CA-C-N 114.664 -1.153 . . . . 10.0 108.328 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 4.9 tpt180 -114.34 86.6 2.46 Favored 'General case' 0 C--N 1.319 -0.744 0 C-N-CA 124.714 1.206 . . . . 10.0 111.581 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 93.7 m -87.63 131.47 34.42 Favored 'General case' 0 N--CA 1.444 -0.728 0 N-CA-C 103.033 -2.951 . . . . 10.0 103.033 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 3.9 mt -105.51 66.56 0.74 Allowed 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 120.497 3.517 . . . . 10.0 120.497 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 43.8 m -76.84 116.57 17.62 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 102.706 -3.072 . . . . 10.0 102.706 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -57.58 -17.87 16.6 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 108.043 -1.095 . . . . 10.0 108.043 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.404 ' CE1' HD12 ' A' ' 32' ' ' ILE . 0.3 OUTLIER -117.93 105.7 12.18 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 106.86 -1.533 . . . . 10.0 106.86 179.914 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 6.0 mmt-85 61.52 92.14 0.05 Allowed 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 114.385 -1.279 . . . . 10.0 112.816 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -40.85 150.21 0.07 Allowed 'General case' 0 CA--C 1.532 0.277 0 O-C-N 126.707 2.504 . . . . 10.0 113.067 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -132.33 98.0 4.27 Favored 'General case' 0 C--N 1.311 -1.072 0 N-CA-C 103.012 -2.958 . . . . 10.0 103.012 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.4 ' CG2' ' N ' ' A' ' 62' ' ' MET . 1.7 mp -135.18 146.84 29.61 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.055 0 N-CA-C 115.164 1.542 . . . . 10.0 115.164 179.785 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.4 ' N ' ' CG2' ' A' ' 61' ' ' ILE . 0.0 OUTLIER -147.09 -171.49 3.79 Favored 'General case' 0 C--O 1.216 -0.689 0 N-CA-C 106.318 -1.734 . . . . 10.0 106.318 179.905 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -167.64 123.79 1.09 Allowed 'General case' 0 C--O 1.223 -0.312 0 N-CA-C 100.923 -3.732 . . . . 10.0 100.923 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.449 ' CE1' ' CE1' ' A' ' 70' ' ' PHE . 12.7 m-85 -123.42 -175.0 3.09 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 115.144 1.535 . . . . 10.0 115.144 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -133.71 95.3 3.44 Favored 'General case' 0 N--CA 1.443 -0.782 0 N-CA-C 103.729 -2.693 . . . . 10.0 103.729 179.798 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 9.4 t -53.27 137.68 13.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 O-C-N 124.971 1.419 . . . . 10.0 109.046 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 76.64 15.44 81.56 Favored Glycine 0 N--CA 1.443 -0.877 0 CA-C-O 117.462 -1.744 . . . . 10.0 113.113 -179.78 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 3.8 tppt? -139.41 132.32 29.33 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 125.308 1.443 . . . . 10.0 112.116 -179.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -69.83 148.95 48.42 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 118.153 -0.927 . . . . 10.0 109.474 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.449 ' CE1' ' CE1' ' A' ' 64' ' ' PHE . 3.6 p90 -155.17 161.59 41.18 Favored 'General case' 0 C--O 1.245 0.841 0 O-C-N 124.894 1.372 . . . . 10.0 107.813 -179.787 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -100.6 123.32 44.65 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.518 -0.919 . . . . 10.0 108.518 179.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -75.01 78.03 2.2 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 114.696 -1.138 . . . . 10.0 113.639 -179.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -60.92 133.56 56.22 Favored 'General case' 0 C--N 1.316 -0.891 0 C-N-CA 119.126 -1.03 . . . . 10.0 108.247 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.0 tp -147.58 99.57 3.13 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 117.67 -1.157 . . . . 10.0 113.071 179.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.499 HG23 ' O ' ' A' ' 75' ' ' THR . 3.4 t -127.5 78.78 1.84 Allowed 'General case' 0 N--CA 1.443 -0.797 0 O-C-N 124.723 1.265 . . . . 10.0 108.837 -179.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 153.25 110.94 0.43 Allowed Glycine 0 C--O 1.244 0.775 0 C-N-CA 120.006 -1.092 . . . . 10.0 110.671 179.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.6 mt 69.71 106.22 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 N-CA-C 107.527 -1.286 . . . . 10.0 107.527 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 87.64 -33.95 0.03 OUTLIER 'General case' 0 C--O 1.242 0.662 0 O-C-N 127.492 2.995 . . . . 10.0 114.319 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.2 p30 35.04 97.62 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.808 0 C-N-CA 126.956 2.103 . . . . 10.0 116.286 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.479 ' HD2' ' CZ ' ' A' ' 104' ' ' ARG . 13.6 ttp180 -124.8 -65.62 1.02 Allowed 'General case' 0 CA--C 1.512 -0.493 0 O-C-N 119.629 -1.919 . . . . 10.0 115.196 -179.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 76.02 120.95 0.05 OUTLIER 'General case' 0 N--CA 1.439 -1.017 0 N-CA-C 103.882 -2.636 . . . . 10.0 103.882 179.658 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -155.63 -174.46 4.98 Favored 'General case' 0 CA--C 1.512 -0.486 0 N-CA-C 108.953 -0.758 . . . . 10.0 108.953 179.898 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 4.0 ptm -121.76 148.33 44.79 Favored 'General case' 0 N--CA 1.438 -1.028 0 N-CA-C 100.237 -3.986 . . . . 10.0 100.237 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.437 HG21 ' NE2' ' A' ' 97' ' ' GLN . 1.2 m -155.68 150.29 26.12 Favored 'General case' 0 CA--C 1.501 -0.914 0 N-CA-C 114.611 1.337 . . . . 10.0 114.611 179.95 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 16.4 m -133.69 106.71 7.51 Favored 'General case' 0 N--CA 1.438 -1.052 0 O-C-N 120.965 -1.085 . . . . 10.0 109.059 -179.779 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.8 m -90.01 147.06 5.46 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.61 0 N-CA-C 103.205 -2.887 . . . . 10.0 103.205 179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -163.83 169.51 18.16 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 126.479 2.362 . . . . 10.0 114.207 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 2.6 m-90 -97.83 122.86 41.44 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 124.096 0.958 . . . . 10.0 110.467 179.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -99.49 -63.21 1.15 Allowed 'General case' 0 C--O 1.247 0.944 0 N-CA-C 101.93 -3.359 . . . . 10.0 101.93 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -160.53 92.92 0.12 Allowed Glycine 0 CA--C 1.498 -1.011 0 N-CA-C 108.34 -1.904 . . . . 10.0 108.34 179.769 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 57.53 30.69 19.12 Favored 'General case' 0 C--N 1.318 -0.773 0 O-C-N 124.951 1.03 . . . . 10.0 113.054 -179.683 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.4 mtpt -148.42 166.15 28.99 Favored 'General case' 0 C--O 1.238 0.49 0 N-CA-C 109.282 -0.636 . . . . 10.0 109.282 -179.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.2 tt -117.57 116.65 27.52 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 105.032 -2.211 . . . . 10.0 105.032 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 25.0 mm100 -106.9 156.86 18.24 Favored 'General case' 0 N--CA 1.445 -0.724 0 O-C-N 118.411 -2.681 . . . . 10.0 111.429 179.759 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -148.02 142.48 26.39 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 118.946 -1.101 . . . . 10.0 112.126 -179.676 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 57.6 t -131.68 106.92 12.42 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 CA-C-N 114.128 -1.397 . . . . 10.0 109.133 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.437 ' NE2' HG21 ' A' ' 84' ' ' THR . 3.2 mp0 -91.72 114.92 27.59 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 106.144 -1.799 . . . . 10.0 106.144 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.01 -85.37 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 116.651 -1.642 . . . . 10.0 113.734 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 40.66 -142.92 0.69 Allowed Glycine 0 CA--C 1.528 0.887 0 O-C-N 125.284 1.615 . . . . 10.0 112.475 -179.683 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.47 ' H ' ' NH1' ' A' ' 104' ' ' ARG . 3.1 mm-40 -105.19 -159.27 0.7 Allowed 'General case' 0 C--N 1.315 -0.929 0 O-C-N 126.785 2.109 . . . . 10.0 110.461 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 68.22 -166.22 0.19 Allowed 'General case' 0 C--N 1.316 -0.855 0 O-C-N 126.333 2.271 . . . . 10.0 113.636 179.875 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -135.18 12.33 3.56 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 125.249 1.419 . . . . 10.0 114.445 -179.854 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -149.76 41.7 0.81 Allowed Glycine 0 N--CA 1.467 0.701 0 N-CA-C 116.151 1.22 . . . . 10.0 116.151 179.749 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.479 ' CZ ' ' HD2' ' A' ' 80' ' ' ARG . 70.2 mtt180 -91.73 129.4 37.71 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 113.829 1.048 . . . . 10.0 113.829 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 148.41 159.72 8.64 Favored Glycine 0 N--CA 1.462 0.379 0 C-N-CA 117.369 -2.348 . . . . 10.0 110.668 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 16.2 m0 -123.41 171.19 9.63 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 124.818 1.247 . . . . 10.0 109.75 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 3.4 m -153.35 112.98 3.85 Favored 'General case' 0 C--O 1.212 -0.91 0 N-CA-C 106.466 -1.679 . . . . 10.0 106.466 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -93.81 170.64 9.41 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 122.252 1.025 . . . . 10.0 112.567 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 2.0 t90 -176.37 108.56 0.08 Allowed 'General case' 0 C--O 1.219 -0.525 0 N-CA-C 106.935 -1.506 . . . . 10.0 106.935 179.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 54.1 mt -92.6 129.63 42.9 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 CA-C-O 124.275 1.988 . . . . 10.0 111.294 -179.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -110.48 -164.26 0.91 Allowed 'General case' 0 C--O 1.242 0.659 0 N-CA-C 106.803 -1.554 . . . . 10.0 106.803 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -96.78 108.06 3.61 Favored Glycine 0 CA--C 1.522 0.506 0 N-CA-C 107.541 -2.224 . . . . 10.0 107.541 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 78.25 12.29 1.7 Allowed 'General case' 0 C--O 1.214 -0.774 0 N-CA-C 108.461 -0.94 . . . . 10.0 108.461 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -149.79 149.88 31.18 Favored 'General case' 0 CA--C 1.509 -0.632 0 CA-C-O 123.195 1.474 . . . . 10.0 110.849 179.747 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.529 ' HB3' ' HB2' ' A' ' 130' ' ' PHE . 11.9 tp -116.83 121.27 41.03 Favored 'General case' 0 C--O 1.241 0.611 0 N-CA-C 104.3 -2.481 . . . . 10.0 104.3 -179.744 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 59.7 t-80 -114.13 117.14 30.38 Favored 'General case' 0 C--O 1.213 -0.849 0 N-CA-C 106.881 -1.526 . . . . 10.0 106.881 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.526 HD21 ' HG3' ' A' ' 119' ' ' MET . 0.6 OUTLIER -128.62 154.26 46.41 Favored 'General case' 0 CA--C 1.51 -0.567 0 O-C-N 126.0 2.063 . . . . 10.0 110.704 -179.987 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -143.36 126.48 16.46 Favored 'General case' 0 CA--C 1.495 -1.161 0 N-CA-C 106.747 -1.575 . . . . 10.0 106.747 179.647 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.526 ' HG3' HD21 ' A' ' 117' ' ' LEU . 28.7 mtp -107.97 126.75 53.08 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 113.68 -1.6 . . . . 10.0 113.006 179.929 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.611 ' HG3' HG23 ' A' ' 125' ' ' THR . 0.0 OUTLIER -125.82 142.38 51.54 Favored 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 118.725 -1.19 . . . . 10.0 110.17 -179.931 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -158.49 127.55 5.58 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.42 -0.956 . . . . 10.0 108.42 179.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 34.86 56.84 0.75 Allowed 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 117.881 2.548 . . . . 10.0 117.881 179.903 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 77.09 11.32 85.67 Favored Glycine 0 C--N 1.317 -0.482 0 N-CA-C 116.763 1.465 . . . . 10.0 116.763 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 22.5 t -124.26 130.81 73.55 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.335 0 N-CA-C 108.124 -1.065 . . . . 10.0 108.124 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' THR . . . . . 0.611 HG23 ' HG3' ' A' ' 120' ' ' ARG . 1.6 m -119.23 108.53 14.76 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 126.553 2.408 . . . . 10.0 114.152 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.51 144.59 25.45 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 106.331 -1.729 . . . . 10.0 106.331 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -144.55 179.49 7.25 Favored 'General case' 0 C--O 1.22 -0.454 0 O-C-N 125.414 1.696 . . . . 10.0 112.477 -179.947 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -169.76 145.25 3.0 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-N 114.45 -1.25 . . . . 10.0 108.402 -179.718 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -111.96 98.59 7.24 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 O-C-N 124.687 1.242 . . . . 10.0 108.007 179.769 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . 0.529 ' HB2' ' HB3' ' A' ' 115' ' ' LEU . 5.6 m-85 -74.0 169.67 17.01 Favored 'General case' 0 C--O 1.214 -0.767 0 O-C-N 125.734 1.896 . . . . 10.0 107.435 179.894 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.491 ' HD2' ' C ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -145.15 57.72 1.27 Allowed 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 122.999 1.38 . . . . 10.0 111.068 -179.76 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . 0.733 ' HB3' ' HA ' ' A' ' 8' ' ' TRP . 0.9 OUTLIER -162.14 -144.86 0.1 Allowed 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 104.728 -2.323 . . . . 10.0 104.728 179.588 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . 0.553 ' O ' HG13 ' A' ' 133' ' ' VAL . 0.4 OUTLIER 97.01 30.12 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.308 -1.201 0 O-C-N 127.708 3.13 . . . . 10.0 109.284 -179.911 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 51.1 t-80 . . . . . 0 N--CA 1.441 -0.879 0 CA-C-N 112.446 -2.161 . . . . 10.0 109.831 179.666 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo . . . . . 0 C--O 1.243 0.774 0 CA-C-O 120.884 0.285 . . . . 10.0 112.286 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.475 HG12 ' CD1' ' A' ' 4' ' ' PHE . 22.1 t -116.27 99.99 9.49 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 CA-C-N 114.566 -1.197 . . . . 10.0 107.956 -179.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -96.4 104.66 16.64 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 124.927 1.392 . . . . 10.0 108.885 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.517 ' CZ ' HD12 ' A' ' 110' ' ' ILE . 3.4 m-30 -89.99 -16.9 28.89 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 117.211 2.3 . . . . 10.0 117.211 -179.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -39.28 146.27 0.09 Allowed 'General case' 0 C--O 1.244 0.787 0 O-C-N 126.358 2.287 . . . . 10.0 113.433 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -179.53 -138.02 3.17 Favored Glycine 0 C--O 1.227 -0.323 0 N-CA-C 118.573 2.189 . . . . 10.0 118.573 -179.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.433 ' CB ' HG12 ' A' ' 133' ' ' VAL . 50.0 m-85 -144.9 -175.88 4.85 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 119.604 -2.116 . . . . 10.0 106.616 -179.655 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.64 ' CE3' ' HB3' ' A' ' 39' ' ' ASP 0.287 11.5 p-90 -158.97 -177.32 6.42 Favored 'General case' 0 C--O 1.214 -0.766 0 N-CA-C 113.883 1.068 . . . . 10.0 113.883 -179.262 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.484 ' HD3' ' HB ' ' A' ' 133' ' ' VAL . 11.5 ptmt 157.3 97.67 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.557 0 O-C-N 127.663 3.102 . . . . 10.0 107.167 178.454 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.448 ' CE ' ' HB2' ' A' ' 13' ' ' ASN . 3.8 ppp? -61.01 139.32 58.08 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-O 117.711 -1.138 . . . . 10.0 112.29 -179.536 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.405 ' O ' HD23 ' A' ' 11' ' ' LEU . 1.1 tt -96.97 -38.27 9.86 Favored 'General case' 0 C--N 1.32 -0.68 0 O-C-N 125.876 1.985 . . . . 10.0 108.289 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -163.27 136.05 5.45 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 116.724 2.12 . . . . 10.0 116.724 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.448 ' HB2' ' CE ' ' A' ' 10' ' ' MET . 29.6 t30 -134.03 152.42 51.84 Favored 'General case' 0 C--O 1.239 0.538 0 O-C-N 125.888 1.992 . . . . 10.0 107.712 -179.795 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -173.76 170.66 3.93 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 118.612 -0.709 . . . . 10.0 112.372 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.463 ' HB2' ' HA ' ' A' ' 126' ' ' CYS . 6.0 m-20 66.95 20.6 10.48 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 127.644 2.377 . . . . 10.0 113.725 179.347 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -67.04 -30.72 70.88 Favored 'General case' 0 CA--C 1.548 0.876 0 CA-C-N 114.62 -1.173 . . . . 10.0 112.418 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -71.24 -42.46 68.82 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-O 122.395 1.093 . . . . 10.0 111.891 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -75.17 -25.14 58.08 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 114.108 -1.406 . . . . 10.0 107.262 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 10.2 t80 -75.5 -43.39 49.36 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 118.335 -0.84 . . . . 10.0 111.016 -179.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.475 HD22 HG21 ' A' ' 25' ' ' VAL . 50.6 mt -72.2 -21.84 61.36 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 113.02 0.748 . . . . 10.0 113.02 -179.621 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.4 ttm-85 -74.4 -24.68 59.15 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 114.49 -1.232 . . . . 10.0 108.833 179.809 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.16 -32.53 69.04 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 122.587 1.184 . . . . 10.0 110.607 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 51.5 mt -100.5 -7.92 23.67 Favored 'General case' 0 C--O 1.236 0.379 0 O-C-N 119.669 -1.894 . . . . 10.0 110.668 179.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.403 ' OD1' ' N ' ' A' ' 24' ' ' ASP . 0.3 OUTLIER 51.35 62.85 2.5 Favored 'General case' 0 C--O 1.245 0.864 0 O-C-N 124.085 0.865 . . . . 10.0 111.935 179.854 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.527 HG12 ' HB2' ' A' ' 78' ' ' ASP . 20.8 m -94.29 39.71 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 N-CA-C 104.054 -2.572 . . . . 10.0 104.054 179.959 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 65.55 154.63 0.08 Allowed 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 115.719 1.748 . . . . 10.0 115.719 -179.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 15.5 m -72.11 -22.07 20.91 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.656 0 N-CA-C 114.886 1.439 . . . . 10.0 114.886 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -73.65 -27.08 61.06 Favored 'General case' 0 C--O 1.234 0.28 0 O-C-N 124.838 1.336 . . . . 10.0 111.468 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.458 HD22 ' CG2' ' A' ' 25' ' ' VAL . 0.2 OUTLIER -76.27 -30.56 57.87 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 119.556 -0.858 . . . . 10.0 112.96 179.833 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.72 -22.89 61.56 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-O 124.189 1.947 . . . . 10.0 110.214 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.33 -41.51 33.42 Favored 'General case' 0 N--CA 1.444 -0.728 0 N-CA-C 107.384 -1.339 . . . . 10.0 107.384 -179.733 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.2 mp -72.58 -35.5 51.0 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.512 0 O-C-N 127.315 2.884 . . . . 10.0 110.499 -179.742 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.32 -31.05 43.09 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 113.18 -1.827 . . . . 10.0 113.22 179.804 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -56.97 -30.57 64.2 Favored 'General case' 0 C--N 1.318 -0.765 0 O-C-N 119.753 -1.842 . . . . 10.0 115.213 179.672 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -110.81 40.59 1.98 Allowed 'General case' 0 C--N 1.322 -0.596 0 O-C-N 124.563 1.164 . . . . 10.0 109.511 179.877 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -117.08 131.56 56.89 Favored 'General case' 0 CA--C 1.515 -0.396 0 C-N-CA 124.386 1.074 . . . . 10.0 109.686 179.952 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -143.97 100.79 4.96 Favored Pre-proline 0 N--CA 1.47 0.546 0 N-CA-C 106.776 -1.564 . . . . 10.0 106.776 179.821 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -98.94 168.47 0.56 Allowed 'Trans proline' 0 N--CA 1.447 -1.247 0 C-N-CA 124.606 3.537 . . . . 10.0 116.458 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.64 ' HB3' ' CE3' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -121.87 -174.29 2.84 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 105.723 -1.955 . . . . 10.0 105.723 -179.725 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.449 ' HB2' ' CE2' ' A' ' 130' ' ' PHE . 2.5 mttt -156.48 105.56 2.27 Favored 'General case' 0 CA--C 1.501 -0.923 0 C-N-CA 118.475 -1.29 . . . . 10.0 112.833 -179.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -97.64 107.86 20.45 Favored 'General case' 0 C--N 1.341 0.234 0 N-CA-C 102.682 -3.081 . . . . 10.0 102.682 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.522 HG23 HD12 ' A' ' 51' ' ' ILE . 86.0 mt -89.27 141.68 13.95 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.022 0 CA-C-O 118.845 -0.598 . . . . 10.0 110.511 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -134.8 158.97 41.79 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 O-C-N 124.727 1.267 . . . . 10.0 107.677 -179.883 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.445 ' HG3' ' CB ' ' A' ' 48' ' ' HIS . 0.0 OUTLIER -129.41 136.93 50.57 Favored 'General case' 0 C--N 1.323 -0.584 0 O-C-N 125.961 2.038 . . . . 10.0 111.566 -179.653 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -133.8 -143.94 0.22 Allowed 'General case' 0 C--O 1.243 0.739 0 CA-C-O 114.776 -2.535 . . . . 10.0 107.791 -179.723 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.423 ' O ' ' NE2' ' A' ' 65' ' ' GLN . . . -42.1 138.28 2.59 Favored Glycine 0 CA--C 1.534 1.237 0 N-CA-C 104.587 -3.405 . . . . 10.0 104.587 179.959 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.54 ' CB ' ' HB3' ' A' ' 65' ' ' GLN . 11.3 m-20 59.19 -115.2 0.76 Allowed 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 102.595 -3.113 . . . . 10.0 102.595 -176.82 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . 0.589 ' CD2' ' HB ' ' A' ' 66' ' ' VAL . 0.1 OUTLIER 164.27 85.04 0.0 OUTLIER 'General case' 0 CA--C 1.5 -0.97 0 O-C-N 126.487 2.367 . . . . 10.0 112.611 175.31 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.7 ' HE2' HD21 ' A' ' 93' ' ' LEU . 36.4 ttm -169.38 83.07 0.13 Allowed 'General case' 0 N--CA 1.435 -1.22 0 N-CA-C 115.771 1.767 . . . . 10.0 115.771 175.416 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.566 HD12 ' C ' ' A' ' 49' ' ' MET . 1.3 mp -117.46 107.22 21.64 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.172 0 N-CA-C 102.208 -3.256 . . . . 10.0 102.208 179.533 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.522 HD12 HG23 ' A' ' 42' ' ' ILE . 0.2 OUTLIER -106.3 108.12 24.35 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.952 0 N-CA-C 109.243 -0.651 . . . . 10.0 109.243 -179.999 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.461 ' HG3' HD13 ' A' ' 61' ' ' ILE . 19.9 ttp180 -101.55 110.24 22.2 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.694 -1.139 . . . . 10.0 113.519 -179.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 20.7 m -97.77 122.93 41.45 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 102.24 -3.244 . . . . 10.0 102.24 -179.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -125.83 61.62 1.25 Allowed 'General case' 0 C--N 1.324 -0.51 1 N-CA-C 121.917 4.043 . . . . 10.0 121.917 -179.795 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.0 m -65.5 -175.94 0.3 Allowed 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 125.908 1.683 . . . . 10.0 107.976 -179.755 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 58.7 p -105.15 -20.93 13.36 Favored 'General case' 0 C--O 1.242 0.69 0 CA-C-O 117.388 -1.291 . . . . 10.0 109.927 179.698 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -73.48 -56.64 4.78 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 122.892 1.329 . . . . 10.0 108.609 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.42 -165.06 1.9 Allowed 'General case' 0 C--O 1.244 0.814 0 CA-C-N 114.183 -1.371 . . . . 10.0 110.089 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -156.84 133.28 9.94 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-O 123.965 1.841 . . . . 10.0 111.849 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -109.9 125.48 52.85 Favored 'General case' 0 CA--C 1.501 -0.929 0 N-CA-C 102.398 -3.186 . . . . 10.0 102.398 179.751 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.461 HD13 ' HG3' ' A' ' 52' ' ' ARG . 1.1 mt -132.73 158.46 43.28 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.706 0 O-C-N 118.237 -2.789 . . . . 10.0 116.102 -179.663 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -141.23 155.23 46.05 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 104.406 -2.442 . . . . 10.0 104.406 -179.911 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -131.67 69.61 1.47 Allowed 'General case' 0 C--N 1.311 -1.066 1 N-CA-C 99.436 -4.283 . . . . 10.0 99.436 179.884 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.467 ' HB3' ' HB3' ' A' ' 49' ' ' MET . 2.2 m-85 -69.78 -172.91 0.55 Allowed 'General case' 0 C--O 1.241 0.657 0 CA-C-N 113.383 -1.735 . . . . 10.0 113.546 179.772 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.54 ' HB3' ' CB ' ' A' ' 47' ' ' ASP . 22.6 mt-30 -171.58 121.32 0.5 Allowed 'General case' 0 C--N 1.317 -0.838 0 C-N-CA 128.001 2.52 . . . . 10.0 107.092 -179.404 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.589 ' HB ' ' CD2' ' A' ' 48' ' ' HIS . 24.8 t -58.89 156.32 2.29 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 C-N-CA 125.961 1.704 . . . . 10.0 113.231 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.453 ' N ' ' CG1' ' A' ' 66' ' ' VAL . . . 63.58 11.26 41.02 Favored Glycine 0 C--O 1.218 -0.889 0 N-CA-C 118.38 2.112 . . . . 10.0 118.38 179.791 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 9.0 tttp -124.26 148.63 47.23 Favored 'General case' 0 C--O 1.22 -0.459 0 CA-C-N 118.105 0.953 . . . . 10.0 112.241 179.901 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 53.4 tt0 -91.12 136.58 32.99 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 125.402 1.688 . . . . 10.0 109.076 -179.807 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -122.53 179.02 4.74 Favored 'General case' 0 C--N 1.318 -0.797 0 C-N-CA 124.566 1.146 . . . . 10.0 108.358 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -154.03 67.98 0.75 Allowed 'General case' 0 C--N 1.317 -0.811 0 O-C-N 127.205 2.815 . . . . 10.0 111.198 -179.754 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -51.71 126.7 18.52 Favored 'General case' 0 N--CA 1.442 -0.847 0 N-CA-C 112.355 0.502 . . . . 10.0 112.355 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.41 ' OD2' HD12 ' A' ' 74' ' ' LEU . 5.3 p-10 -70.68 -20.02 62.73 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.785 0.802 . . . . 10.0 110.227 179.959 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.74 HD13 ' O ' ' A' ' 74' ' ' LEU . 0.0 OUTLIER -156.75 127.46 6.69 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 116.395 1.998 . . . . 10.0 116.395 -179.959 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.592 ' N ' ' HA ' ' A' ' 79' ' ' ASP . 18.3 m -96.43 123.59 40.14 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-O 124.116 1.913 . . . . 10.0 111.194 -179.591 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 52.48 -133.22 39.05 Favored Glycine 0 N--CA 1.441 -0.994 0 N-CA-C 107.172 -2.371 . . . . 10.0 107.172 179.797 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.803 ' O ' HD12 ' A' ' 77' ' ' ILE . 0.9 OUTLIER -107.38 -11.85 10.48 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 N-CA-C 106.843 -1.54 . . . . 10.0 106.843 179.374 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.527 ' HB2' HG12 ' A' ' 25' ' ' VAL . 0.2 OUTLIER -82.17 -4.97 58.09 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-N 113.67 -1.604 . . . . 10.0 109.262 179.848 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.592 ' HA ' ' N ' ' A' ' 75' ' ' THR . 4.0 m-20 39.68 -128.15 0.35 Allowed 'General case' 0 C--N 1.316 -0.88 0 C-N-CA 128.314 2.646 . . . . 10.0 115.953 -179.596 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 16.9 ttt85 84.8 114.37 0.05 Allowed 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 120.481 1.491 . . . . 10.0 107.231 -179.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 5.4 mmtp -57.19 141.84 44.96 Favored 'General case' 0 C--N 1.316 -0.873 0 O-C-N 127.156 2.785 . . . . 10.0 105.583 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 72.8 m -152.12 149.66 29.04 Favored 'General case' 0 C--O 1.213 -0.86 0 O-C-N 125.412 1.695 . . . . 10.0 109.601 -179.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.6 mtm -100.69 114.54 28.36 Favored 'General case' 0 C--O 1.241 0.617 1 N-CA-C 100.163 -4.014 . . . . 10.0 100.163 179.869 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 98.8 m -112.12 135.53 52.66 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 115.844 1.794 . . . . 10.0 115.844 179.734 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -131.3 145.22 51.79 Favored 'General case' 0 C--N 1.343 0.287 0 N-CA-C 108.134 -1.061 . . . . 10.0 108.134 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.489 HG11 ' HE3' ' A' ' 49' ' ' MET . 1.2 t -113.23 172.88 3.1 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.986 0 N-CA-C 104.02 -2.585 . . . . 10.0 104.02 179.887 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -169.49 169.11 9.05 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 120.526 1.512 . . . . 10.0 113.96 179.783 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -106.81 122.62 46.76 Favored 'General case' 0 C--O 1.224 -0.24 0 O-C-N 125.844 1.965 . . . . 10.0 106.905 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.424 ' HB3' ' HB2' ' A' ' 92' ' ' LYS . 24.5 t0 -107.69 3.89 25.15 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 101.381 -3.563 . . . . 10.0 101.381 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 111.47 -96.46 0.88 Allowed Glycine 0 C--O 1.24 0.51 0 N-CA-C 104.066 -3.614 . . . . 10.0 104.066 -179.719 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 8.9 p30 -84.83 -35.78 22.06 Favored 'General case' 0 C--O 1.222 -0.373 0 C-N-CA 119.641 -0.824 . . . . 10.0 109.657 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.424 ' HB2' ' HB3' ' A' ' 89' ' ' ASP . 1.6 mtmm -82.17 142.6 32.07 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 124.009 0.924 . . . . 10.0 111.843 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.7 HD21 ' HE2' ' A' ' 49' ' ' MET . 9.8 tp -119.22 100.72 7.5 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 104.254 -2.499 . . . . 10.0 104.254 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . 0.444 ' HB3' HG23 ' A' ' 107' ' ' THR . 10.6 pt20 -123.92 168.07 13.28 Favored 'General case' 0 CA--C 1.497 -1.073 0 N-CA-C 114.985 1.476 . . . . 10.0 114.985 179.836 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 19.9 p -131.67 -173.03 3.01 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-N 113.547 -1.66 . . . . 10.0 110.026 179.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.4 HG12 ' N ' ' A' ' 97' ' ' GLN . 7.0 t -134.76 -74.08 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.744 0 C-N-CA 125.062 1.345 . . . . 10.0 109.475 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.4 ' N ' HG12 ' A' ' 96' ' ' VAL . 21.7 mt-30 87.78 118.45 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.569 0 O-C-N 127.273 2.858 . . . . 10.0 110.423 179.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.8 mmtt -88.96 114.2 25.32 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 125.386 1.474 . . . . 10.0 114.247 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . 0.505 ' N ' HH22 ' A' ' 104' ' ' ARG . . . -153.32 -160.05 9.47 Favored Glycine 0 CA--C 1.523 0.573 0 N-CA-C 108.753 -1.739 . . . . 10.0 108.753 -179.911 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 14.4 tm-20 -86.63 -14.51 42.5 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 116.645 2.091 . . . . 10.0 116.645 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 15.3 mmtt -81.78 178.44 8.32 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 113.273 0.842 . . . . 10.0 113.273 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 3.7 pm0 -121.71 28.89 7.42 Favored 'General case' 0 CA--C 1.509 -0.6 0 C-N-CA 125.933 1.693 . . . . 10.0 110.517 179.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -159.19 -18.4 0.03 OUTLIER Glycine 0 N--CA 1.462 0.383 0 CA-C-O 116.554 -2.248 . . . . 10.0 118.481 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.505 HH22 ' N ' ' A' ' 99' ' ' GLY . 24.0 mtm-85 -47.4 144.82 2.75 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 120.209 2.004 . . . . 10.0 109.017 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 129.65 152.11 7.47 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 107.592 -2.203 . . . . 10.0 107.592 -179.786 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -124.95 -170.97 2.26 Favored 'General case' 0 C--O 1.239 0.531 0 C-N-CA 125.223 1.409 . . . . 10.0 109.916 179.713 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . 0.444 HG23 ' HB3' ' A' ' 94' ' ' GLN . 3.1 m -161.39 117.75 2.18 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-O 117.307 -1.33 . . . . 10.0 109.55 179.724 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 -93.45 128.17 39.42 Favored 'General case' 0 C--N 1.318 -0.772 0 O-C-N 126.796 2.56 . . . . 10.0 107.287 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 4.5 t90 -139.55 101.47 4.23 Favored 'General case' 0 CA--C 1.511 -0.521 0 O-C-N 120.505 -1.372 . . . . 10.0 112.271 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.517 HD12 ' CZ ' ' A' ' 4' ' ' PHE . 72.2 mt -85.64 119.4 34.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 O-C-N 126.405 2.316 . . . . 10.0 114.069 179.689 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -132.25 148.09 52.44 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 104.301 -2.481 . . . . 10.0 104.301 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 26.73 -103.16 0.01 OUTLIER Glycine 0 N--CA 1.445 -0.737 0 O-C-N 128.161 3.413 . . . . 10.0 111.926 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -116.05 24.77 11.19 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 125.766 1.509 . . . . 10.0 112.251 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.485 ' C ' HD23 ' A' ' 115' ' ' LEU . 0.1 OUTLIER -139.99 163.19 33.33 Favored 'General case' 0 CA--C 1.501 -0.912 0 CA-C-O 123.502 1.62 . . . . 10.0 114.13 -179.995 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.485 HD23 ' C ' ' A' ' 114' ' ' GLU . 4.5 mt -124.6 108.78 12.42 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 104.781 -2.303 . . . . 10.0 104.781 -179.959 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -94.85 73.95 3.57 Favored 'General case' 0 C--N 1.313 -1.006 0 C-N-CA 119.332 -0.947 . . . . 10.0 109.33 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.525 HD22 ' HB2' ' A' ' 128' ' ' GLN . 8.9 tt -66.89 153.68 42.88 Favored 'General case' 0 N--CA 1.45 -0.456 0 O-C-N 126.355 2.285 . . . . 10.0 112.71 179.79 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -141.51 138.49 32.81 Favored 'General case' 0 C--O 1.214 -0.807 0 O-C-N 125.037 1.461 . . . . 10.0 109.986 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -136.21 121.44 19.12 Favored 'General case' 0 C--N 1.322 -0.596 0 O-C-N 124.738 1.274 . . . . 10.0 111.013 179.781 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -123.19 152.99 40.69 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 114.842 -1.072 . . . . 10.0 111.161 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -165.07 130.38 2.62 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 104.829 -2.286 . . . . 10.0 104.829 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 47.22 30.27 1.4 Allowed 'General case' 0 C--N 1.321 -0.672 0 O-C-N 125.345 1.653 . . . . 10.0 111.977 -179.884 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 86.58 -8.41 75.21 Favored Glycine 0 CA--C 1.535 1.335 0 C-N-CA 119.604 -1.284 . . . . 10.0 114.497 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 22.1 t -86.08 124.24 40.12 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 CA-C-N 118.723 1.262 . . . . 10.0 108.517 -179.787 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 5.4 m -103.42 120.6 41.14 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-O 123.943 1.83 . . . . 10.0 114.39 -179.813 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . 0.463 ' HA ' ' HB2' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -124.92 129.4 50.29 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 112.443 -2.162 . . . . 10.0 105.272 179.996 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -115.46 173.77 6.35 Favored 'General case' 0 C--O 1.24 0.597 0 N-CA-C 115.319 1.6 . . . . 10.0 115.319 179.784 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . 0.525 ' HB2' HD22 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -151.87 88.71 1.41 Allowed 'General case' 0 CA--C 1.512 -0.519 0 CA-C-N 113.012 -1.904 . . . . 10.0 110.3 179.832 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 38.5 t -70.17 119.13 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 N-CA-C 104.874 -2.269 . . . . 10.0 104.874 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . 0.449 ' CE2' ' HB2' ' A' ' 40' ' ' LYS . 0.3 OUTLIER -101.03 174.86 5.81 Favored 'General case' 0 C--O 1.218 -0.562 0 CA-C-O 123.687 1.708 . . . . 10.0 108.94 179.758 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 2.3 tptm -143.22 88.88 2.05 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 113.578 -1.646 . . . . 10.0 106.616 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 22.9 ttpt -65.08 98.0 0.28 Allowed 'General case' 0 CA--C 1.504 -0.796 0 C-N-CA 118.008 -1.477 . . . . 10.0 107.709 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . 0.495 HG13 ' N ' ' A' ' 134' ' ' HIS . 7.1 p -53.66 -37.25 31.0 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.353 0 CA-C-N 114.417 -1.265 . . . . 10.0 110.209 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . 0.495 ' N ' HG13 ' A' ' 133' ' ' VAL . 1.9 t-160 . . . . . 0 N--CA 1.438 -1.064 0 O-C-N 126.049 2.093 . . . . 10.0 111.511 -179.981 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.246 0.915 0 N-CA-C 114.778 1.03 . . . . 10.0 114.778 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.58 -13.82 14.99 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 O-C-N 124.409 1.068 . . . . 10.0 111.811 -179.886 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -46.71 129.47 11.32 Favored 'General case' 0 C--O 1.217 -0.611 0 CA-C-N 114.456 -1.247 . . . . 10.0 111.751 179.993 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.412 ' CE2' ' CD1' ' A' ' 93' ' ' LEU . 19.8 m-30 -90.11 -9.67 47.49 Favored 'General case' 0 C--N 1.319 -0.74 0 O-C-N 127.881 3.238 . . . . 10.0 116.326 -179.906 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 71.8 m-20 -43.57 143.8 0.9 Allowed 'General case' 0 N--CA 1.471 0.619 0 O-C-N 127.253 2.845 . . . . 10.0 111.905 179.97 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.429 ' HA2' ' HA ' ' A' ' 134' ' ' HIS . . . -146.58 -177.49 21.23 Favored Glycine 0 C--N 1.346 1.12 0 N-CA-C 119.669 2.628 . . . . 10.0 119.669 -179.569 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -151.48 46.44 0.8 Allowed 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 103.839 -2.652 . . . . 10.0 103.839 -179.582 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.618 ' CZ3' ' CB ' ' A' ' 39' ' ' ASP 0.397 30.2 p-90 -37.61 169.61 0.0 OUTLIER 'General case' 0 C--O 1.211 -0.931 0 C-N-CA 127.19 2.196 . . . . 10.0 115.272 179.331 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.509 ' HE3' ' HB2' ' A' ' 132' ' ' LYS . 0.0 OUTLIER -157.55 150.49 23.26 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 111.633 -2.531 . . . . 10.0 104.473 174.976 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.3 ppp? -106.4 168.37 9.2 Favored 'General case' 0 C--O 1.24 0.561 0 O-C-N 119.834 -1.791 . . . . 10.0 112.67 -179.777 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -137.3 -59.9 0.68 Allowed 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 105.719 -1.956 . . . . 10.0 105.719 -179.902 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 61.8 p -161.85 173.68 14.21 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 124.689 2.185 . . . . 10.0 112.623 179.771 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.42 ' OD1' ' N ' ' A' ' 13' ' ' ASN . 3.1 p-10 -126.16 161.35 27.87 Favored 'General case' 0 CA--C 1.513 -0.481 0 CA-C-N 112.67 -2.059 . . . . 10.0 108.088 -179.597 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 35.9 tp10 -149.0 134.8 18.86 Favored 'General case' 0 C--O 1.215 -0.722 0 O-C-N 119.539 -1.975 . . . . 10.0 113.519 179.676 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 61.25 27.84 17.49 Favored 'General case' 0 C--O 1.244 0.78 0 C-N-CA 125.015 1.326 . . . . 10.0 111.846 -179.958 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.497 ' CD2' HD11 ' A' ' 20' ' ' LEU . 40.2 t80 -69.16 -27.62 65.69 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 114.797 1.406 . . . . 10.0 114.797 -179.399 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -76.61 -29.07 56.37 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 120.205 -1.559 . . . . 10.0 112.778 179.916 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -79.37 -28.18 41.94 Favored 'General case' 0 C--O 1.219 -0.505 0 CA-C-N 114.512 -1.222 . . . . 10.0 109.445 -179.948 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.6 ' CE1' HD11 ' A' ' 23' ' ' LEU . 0.2 OUTLIER -65.9 -43.67 87.55 Favored 'General case' 0 CA--C 1.555 1.172 0 O-C-N 125.489 1.743 . . . . 10.0 108.978 -179.998 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.503 ' CD1' ' HG3' ' A' ' 30' ' ' ARG . 0.7 OUTLIER -76.82 -23.22 52.8 Favored 'General case' 0 C--O 1.22 -0.462 0 O-C-N 126.146 2.154 . . . . 10.0 112.609 179.707 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.89 -26.01 40.39 Favored 'General case' 0 C--N 1.321 -0.662 0 O-C-N 126.224 2.202 . . . . 10.0 108.816 179.531 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.403 ' HB1' ' HB3' ' A' ' 122' ' ' GLU . . . -69.89 -27.64 64.97 Favored 'General case' 0 C--O 1.218 -0.57 0 C-N-CA 125.976 1.711 . . . . 10.0 112.984 179.781 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.6 HD11 ' CE1' ' A' ' 19' ' ' TYR . 0.0 OUTLIER -113.27 9.64 18.37 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 114.197 -1.365 . . . . 10.0 109.886 179.567 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 38.41 72.19 0.14 Allowed 'General case' 0 C--N 1.322 -0.6 0 O-C-N 126.697 2.498 . . . . 10.0 114.957 179.466 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 3.8 m -88.78 170.05 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-O 117.027 -1.463 . . . . 10.0 108.841 -179.661 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 9.0 m120 -53.98 152.63 5.58 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 117.913 -1.042 . . . . 10.0 111.502 179.48 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 2.5 p -71.6 -23.1 22.29 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.855 0 N-CA-C 117.284 2.327 . . . . 10.0 117.284 -179.632 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -79.82 -32.04 40.67 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 114.43 -1.259 . . . . 10.0 109.919 -179.806 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 54.3 tp -70.75 -44.72 66.18 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 114.64 1.348 . . . . 10.0 114.64 -179.732 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.503 ' HG3' ' CD1' ' A' ' 20' ' ' LEU . 18.4 ttp180 -56.86 -36.72 70.37 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 126.254 1.822 . . . . 10.0 114.377 179.813 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.87 -32.66 61.93 Favored 'General case' 0 C--O 1.218 -0.585 0 O-C-N 126.274 2.234 . . . . 10.0 110.588 179.806 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 20.7 mm -77.41 -41.04 29.52 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.453 0 O-C-N 125.489 1.743 . . . . 10.0 109.261 -179.739 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -80.35 -6.25 57.69 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.785 -0.643 . . . . 10.0 112.399 179.828 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -93.46 -30.42 15.06 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 115.294 1.59 . . . . 10.0 115.294 -179.785 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -92.33 -14.06 29.32 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 120.017 1.281 . . . . 10.0 110.456 179.893 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.4 HD11 ' HB3' ' A' ' 57' ' ' PHE . 0.0 OUTLIER -80.42 118.26 21.89 Favored 'General case' 0 CA--C 1.514 -0.423 0 C-N-CA 125.677 1.591 . . . . 10.0 109.468 -179.735 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.7 135.75 19.7 Favored Pre-proline 0 C--N 1.318 -0.783 0 N-CA-C 106.495 -1.668 . . . . 10.0 106.495 -179.975 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_exo -90.7 179.18 1.83 Allowed 'Trans proline' 0 N--CA 1.447 -1.258 0 C-N-CA 124.268 3.312 . . . . 10.0 119.545 -179.443 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.618 ' CB ' ' CZ3' ' A' ' 8' ' ' TRP . 0.3 OUTLIER -149.39 143.84 26.0 Favored 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 127.636 2.375 . . . . 10.0 104.724 179.72 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.573 ' C ' ' CD1' ' A' ' 8' ' ' TRP . 1.2 tptt -97.56 -143.22 0.3 Allowed 'General case' 0 C--N 1.305 -1.335 0 CA-C-O 114.672 -2.585 . . . . 10.0 106.905 -179.42 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.544 ' HA ' ' CD1' ' A' ' 8' ' ' TRP . 0.2 OUTLIER 152.92 117.32 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.938 0 O-C-N 127.728 3.143 . . . . 10.0 102.77 178.586 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 6.3 mm -121.86 145.76 28.01 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.981 0 O-C-N 124.701 1.251 . . . . 10.0 113.602 179.451 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 67.0 t -147.48 100.36 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 O-C-N 125.911 2.007 . . . . 10.0 106.35 179.898 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -112.01 116.91 31.33 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 124.668 1.187 . . . . 10.0 108.665 179.862 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -118.86 125.73 50.18 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 104.799 -2.297 . . . . 10.0 104.799 -179.942 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 61.32 -115.29 7.68 Favored Glycine 0 C--O 1.223 -0.532 0 N-CA-C 108.951 -1.66 . . . . 10.0 108.951 -179.723 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -112.58 -20.84 11.57 Favored 'General case' 0 C--N 1.321 -0.652 0 O-C-N 121.693 -0.887 . . . . 10.0 110.609 -179.854 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 46.1 m170 -82.45 119.08 23.74 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 107.802 -1.184 . . . . 10.0 107.802 -179.954 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 17.5 ttp -104.21 155.18 18.95 Favored 'General case' 0 C--N 1.32 -0.684 0 O-C-N 126.664 2.478 . . . . 10.0 114.454 179.961 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 4.8 mt -145.7 122.8 4.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 106.419 -1.697 . . . . 10.0 106.419 -179.937 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.5 mp -119.23 131.41 72.0 Favored 'Isoleucine or valine' 0 C--O 1.242 0.699 0 N-CA-C 104.683 -2.34 . . . . 10.0 104.683 179.823 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.84 98.66 6.01 Favored 'General case' 0 N--CA 1.442 -0.872 0 CA-C-N 114.971 -1.013 . . . . 10.0 111.571 -179.76 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 89.2 m -72.33 139.88 48.2 Favored 'General case' 0 C--O 1.219 -0.538 0 N-CA-C 101.784 -3.413 . . . . 10.0 101.784 179.983 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.2 mt -113.11 54.74 0.72 Allowed 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 119.902 3.297 . . . . 10.0 119.902 -179.886 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 64.8 m -93.38 131.01 38.95 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 104.04 -2.578 . . . . 10.0 104.04 -179.757 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -69.51 -13.34 62.29 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 123.236 1.493 . . . . 10.0 107.727 -179.848 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.4 ' HB3' HD11 ' A' ' 36' ' ' LEU . 28.5 t80 -95.22 84.17 4.02 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 106.799 -1.556 . . . . 10.0 106.799 179.954 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.42 ' CZ ' ' HB3' ' A' ' 58' ' ' ARG . 0.0 OUTLIER 50.95 80.11 0.08 Allowed 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 114.471 1.286 . . . . 10.0 114.471 -179.822 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.401 ' OD1' ' N ' ' A' ' 59' ' ' ASN . 4.8 p-10 -71.94 90.62 1.15 Allowed 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 113.747 -1.57 . . . . 10.0 112.206 179.787 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 25.6 p90 -75.32 130.1 38.5 Favored 'General case' 0 C--N 1.321 -0.648 0 O-C-N 126.638 2.461 . . . . 10.0 105.483 -179.854 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.471 HG22 ' N ' ' A' ' 62' ' ' MET . 6.2 mm -104.34 164.28 3.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 O-C-N 121.409 -0.807 . . . . 10.0 111.277 -179.716 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.471 ' N ' HG22 ' A' ' 61' ' ' ILE . 27.7 mmm -144.78 150.98 38.13 Favored 'General case' 0 N--CA 1.442 -0.827 0 N-CA-C 107.291 -1.374 . . . . 10.0 107.291 179.992 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -133.52 88.5 2.49 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 103.684 -2.71 . . . . 10.0 103.684 179.953 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -76.34 178.47 6.49 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 119.619 -1.926 . . . . 10.0 114.474 179.961 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 10.5 mt-30 -147.35 113.98 6.03 Favored 'General case' 0 C--N 1.315 -0.893 0 O-C-N 128.764 3.79 . . . . 10.0 103.187 -179.86 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -62.05 137.52 23.88 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 O-C-N 124.38 1.05 . . . . 10.0 113.721 -179.846 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.99 -25.16 0.67 Allowed Glycine 0 C--O 1.218 -0.869 0 CA-C-O 117.025 -1.986 . . . . 10.0 116.281 179.804 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 15.2 mttp -91.78 160.33 15.38 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 120.492 2.146 . . . . 10.0 116.7 -179.777 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -69.05 158.74 34.2 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 107.947 -1.131 . . . . 10.0 107.947 -179.955 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 45.9 t80 -165.95 113.11 0.91 Allowed 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 113.994 -1.457 . . . . 10.0 113.24 -179.583 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -79.73 145.84 32.7 Favored 'General case' 0 C--N 1.314 -0.955 0 O-C-N 125.181 1.551 . . . . 10.0 107.525 -179.79 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.646 ' OE2' HD23 ' A' ' 74' ' ' LEU . 13.8 tt0 -107.1 -42.24 4.93 Favored 'General case' 0 C--O 1.24 0.591 0 N-CA-C 117.193 2.294 . . . . 10.0 117.193 -179.922 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.434 ' HA ' ' HA ' ' A' ' 81' ' ' LYS . 6.3 t70 53.08 35.95 20.97 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.467 0.651 . . . . 10.0 110.695 179.777 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.646 HD23 ' OE2' ' A' ' 72' ' ' GLU . 0.3 OUTLIER -46.28 117.54 1.61 Allowed 'General case' 0 C--N 1.32 -0.708 0 O-C-N 120.555 -1.341 . . . . 10.0 114.167 179.894 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -129.32 8.24 5.48 Favored 'General case' 0 CA--C 1.514 -0.418 0 O-C-N 121.61 -0.681 . . . . 10.0 109.909 179.956 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . 0.439 ' H ' HD13 ' A' ' 74' ' ' LEU . . . -78.94 -43.54 10.95 Favored Glycine 0 CA--C 1.5 -0.902 0 CA-C-O 117.505 -1.719 . . . . 10.0 110.453 -179.749 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.7 pp -142.44 142.2 27.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 CA-C-N 118.775 1.287 . . . . 10.0 107.917 179.848 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 75.34 -59.02 0.55 Allowed 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.639 0.733 . . . . 10.0 111.632 179.709 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 87.06 82.77 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 115.44 1.645 . . . . 10.0 115.44 179.926 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 3.4 ptt85 -155.32 143.29 19.99 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 113.985 -1.462 . . . . 10.0 111.026 179.767 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.434 ' HA ' ' HA ' ' A' ' 73' ' ' ASP . 4.3 ptpp? -95.21 175.81 6.46 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 103.731 -2.692 . . . . 10.0 103.731 179.894 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 6.0 p -177.84 158.72 1.32 Allowed 'General case' 0 C--O 1.213 -0.82 0 N-CA-C 106.344 -1.725 . . . . 10.0 106.344 179.824 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.6 ttm -105.57 117.83 35.01 Favored 'General case' 0 C--N 1.329 -0.323 1 N-CA-C 98.683 -4.562 . . . . 10.0 98.683 179.998 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 43.0 m -121.24 124.09 43.81 Favored 'General case' 0 C--O 1.215 -0.745 0 CA-C-N 112.068 -2.333 . . . . 10.0 117.113 -179.743 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.53 121.52 36.73 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 114.397 -1.274 . . . . 10.0 108.065 179.919 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 13.8 t -98.01 104.89 16.49 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.875 0 N-CA-C 105.488 -2.041 . . . . 10.0 105.488 -179.819 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -110.59 -178.65 3.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 122.238 1.018 . . . . 10.0 113.358 179.956 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 19.0 m0 -111.91 134.24 53.6 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 112.883 -1.962 . . . . 10.0 107.446 179.75 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -102.95 -58.94 1.79 Allowed 'General case' 0 C--O 1.246 0.892 0 N-CA-C 102.879 -3.008 . . . . 10.0 102.879 179.954 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 157.73 90.01 0.07 OUTLIER Glycine 0 CA--C 1.504 -0.614 0 N-CA-C 105.96 -2.856 . . . . 10.0 105.96 179.819 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 65.9 47.0 2.12 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 108.084 -1.08 . . . . 10.0 108.084 -179.904 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 25.6 mtmt -169.37 124.63 0.85 Allowed 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 125.51 1.524 . . . . 10.0 108.724 -179.991 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.412 ' CD1' ' CE2' ' A' ' 4' ' ' PHE . 0.3 OUTLIER -82.71 77.56 9.45 Favored 'General case' 0 CA--C 1.515 -0.394 0 O-C-N 126.451 2.344 . . . . 10.0 107.576 179.934 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.59 105.88 7.91 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 114.561 -1.199 . . . . 10.0 112.487 -179.982 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -108.45 138.48 44.68 Favored 'General case' 0 C--N 1.341 0.23 0 O-C-N 125.129 1.518 . . . . 10.0 112.598 -179.912 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 40.9 t -125.57 131.93 71.52 Favored 'Isoleucine or valine' 0 C--O 1.242 0.67 0 CA-C-O 124.457 2.075 . . . . 10.0 109.367 179.711 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.438 ' CG ' ' HA2' ' A' ' 105' ' ' GLY . 0.0 OUTLIER -134.95 141.2 46.21 Favored 'General case' 0 C--O 1.242 0.678 0 O-C-N 120.231 -1.543 . . . . 10.0 107.159 179.876 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 9.9 pttp -149.33 110.89 4.49 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 122.586 1.184 . . . . 10.0 111.08 179.988 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -163.37 74.49 0.18 Allowed Glycine 0 C--O 1.221 -0.691 0 O-C-N 119.653 -1.904 . . . . 10.0 112.135 -179.958 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 94.6 23.33 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.579 0 O-C-N 127.458 2.505 . . . . 10.0 115.024 179.791 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.427 ' CE ' ' HA ' ' A' ' 101' ' ' LYS . 0.0 OUTLIER -139.33 -155.49 0.6 Allowed 'General case' 0 N--CA 1.471 0.585 0 O-C-N 126.379 2.3 . . . . 10.0 110.982 -179.948 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -136.77 -57.24 0.73 Allowed 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 125.309 1.443 . . . . 10.0 113.564 -179.979 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -109.31 42.5 1.94 Allowed Glycine 0 N--CA 1.449 -0.436 0 N-CA-C 119.333 2.493 . . . . 10.0 119.333 -179.808 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 3.1 mtm180 -88.18 168.02 13.11 Favored 'General case' 0 C--O 1.244 0.805 0 O-C-N 120.71 -1.465 . . . . 10.0 110.805 -179.961 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . 0.438 ' HA2' ' CG ' ' A' ' 97' ' ' GLN . . . 120.96 139.02 5.63 Favored Glycine 0 N--CA 1.45 -0.426 0 N-CA-C 108.638 -1.785 . . . . 10.0 108.638 -179.819 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 106' ' ' TRP . . . . . 0.48 ' CD1' ' CG ' ' A' ' 119' ' ' MET . 3.1 m0 -104.93 176.5 5.14 Favored 'General case' 0 C--N 1.316 -0.87 0 O-C-N 119.959 -1.906 . . . . 10.0 109.096 -179.754 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 4.5 m -140.62 120.31 13.38 Favored 'General case' 0 C--O 1.222 -0.347 0 O-C-N 126.69 2.493 . . . . 10.0 107.074 179.915 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -108.65 133.31 52.93 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 114.342 -1.299 . . . . 10.0 109.676 -179.979 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 2.0 t90 -138.8 113.27 8.9 Favored 'General case' 0 CA--C 1.502 -0.882 0 O-C-N 125.783 1.927 . . . . 10.0 109.19 179.645 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -82.97 128.51 38.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 121.994 0.902 . . . . 10.0 111.651 -179.981 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -127.05 88.16 2.77 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 122.883 1.325 . . . . 10.0 108.044 179.991 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 53.27 -103.6 0.15 Allowed Glycine 0 C--N 1.346 1.134 0 O-C-N 119.21 -2.181 . . . . 10.0 111.16 -179.79 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.407 ' N ' ' OD1' ' A' ' 113' ' ' ASP . 0.5 OUTLIER -102.17 28.88 5.47 Favored 'General case' 0 N--CA 1.463 0.199 0 C-N-CA 124.378 1.071 . . . . 10.0 113.692 -179.967 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -146.12 145.21 30.43 Favored 'General case' 0 C--N 1.321 -0.669 0 O-C-N 119.73 -1.856 . . . . 10.0 109.68 179.989 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 1.068 ' HG ' HG11 ' A' ' 133' ' ' VAL . 0.1 OUTLIER -107.75 133.96 51.39 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 104.593 -2.373 . . . . 10.0 104.593 -179.559 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -120.72 95.78 4.85 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 106.022 -1.844 . . . . 10.0 106.022 -179.969 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 5.0 tp -101.29 134.0 45.01 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 113.811 -1.54 . . . . 10.0 108.907 179.929 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -133.61 100.83 4.91 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 105.059 -2.2 . . . . 10.0 105.059 179.685 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.48 ' CG ' ' CD1' ' A' ' 106' ' ' TRP . 2.2 ttm -96.39 139.4 32.57 Favored 'General case' 0 CA--C 1.504 -0.821 0 O-C-N 126.449 2.343 . . . . 10.0 113.435 -179.907 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.409 ' O ' ' HB2' ' A' ' 121' ' ' ALA . 3.2 ptt180 -131.27 177.92 7.1 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 114.004 1.113 . . . . 10.0 114.004 -179.998 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . 0.409 ' HB2' ' O ' ' A' ' 120' ' ' ARG . . . 174.19 132.07 0.03 OUTLIER 'General case' 0 C--N 1.319 -0.755 0 O-C-N 124.526 1.142 . . . . 10.0 108.908 179.647 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . 0.403 ' HB3' ' HB1' ' A' ' 22' ' ' ALA . 2.6 tm-20 44.97 51.82 8.52 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 116.272 1.953 . . . . 10.0 116.272 -179.918 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 66.19 24.12 71.79 Favored Glycine 0 CA--C 1.534 1.243 0 CA-C-N 114.316 -1.311 . . . . 10.0 114.854 -179.77 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 1.6 t -136.86 118.85 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 CA-C-O 123.796 1.76 . . . . 10.0 107.326 179.962 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 125' ' ' THR . . . . . 0.441 HG22 ' N ' ' A' ' 126' ' ' CYS . 18.7 m -94.55 159.05 15.26 Favored 'General case' 0 C--N 1.314 -0.937 0 C-N-CA 125.507 1.523 . . . . 10.0 110.575 -179.977 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . 0.441 ' N ' HG22 ' A' ' 125' ' ' THR . 0.0 OUTLIER -149.52 153.64 37.52 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 127.829 3.206 . . . . 10.0 105.218 -179.816 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 25.3 mttp -151.5 123.44 8.1 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 113.719 1.007 . . . . 10.0 113.719 179.728 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -109.89 118.72 37.23 Favored 'General case' 0 C--N 1.319 -0.747 0 O-C-N 126.658 2.474 . . . . 10.0 109.432 -179.866 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 90.7 t -83.3 118.75 31.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 119.218 -0.993 . . . . 10.0 110.635 -179.741 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . 0.448 ' HB3' ' HB2' ' A' ' 115' ' ' LEU . 0.4 OUTLIER -103.3 133.3 48.59 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 114.147 -1.388 . . . . 10.0 109.095 -179.915 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.463 ' HB3' ' HG2' ' A' ' 9' ' ' LYS . 0.0 OUTLIER -110.15 130.68 55.5 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 105.076 -2.194 . . . . 10.0 105.076 179.577 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . 0.509 ' HB2' ' HE3' ' A' ' 9' ' ' LYS . 25.7 tptt 74.84 161.18 0.24 Allowed 'General case' 0 C--O 1.211 -0.923 0 CA-C-O 116.743 -1.599 . . . . 10.0 107.03 -178.766 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . 1.068 HG11 ' HG ' ' A' ' 115' ' ' LEU . 7.6 p 146.25 57.77 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.31 -1.113 1 O-C-N 130.125 4.641 . . . . 10.0 109.298 -179.529 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . 0.429 ' HA ' ' HA2' ' A' ' 6' ' ' GLY . 8.2 t60 . . . . . 0 C--N 1.314 -0.966 1 O-C-N 129.245 4.091 . . . . 10.0 108.989 179.825 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo . . . . . 0 N--CA 1.485 1.021 0 CA-C-O 122.229 0.845 . . . . 10.0 114.268 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER 153.57 131.0 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 C-N-CA 126.996 2.119 . . . . 10.0 107.78 179.681 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -155.3 121.27 5.13 Favored 'General case' 0 C--N 1.318 -0.779 0 O-C-N 126.578 2.424 . . . . 10.0 111.765 -179.749 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.404 ' CE2' HD12 ' A' ' 110' ' ' ILE . 55.7 m-85 -78.22 -43.57 28.04 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 116.428 2.01 . . . . 10.0 116.428 -179.952 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 10.1 m-20 -43.23 125.18 3.63 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-O 116.954 -1.498 . . . . 10.0 114.796 179.798 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 160.58 -99.25 0.18 Allowed Glycine 0 CA--C 1.531 1.083 0 O-C-N 125.5 1.75 . . . . 10.0 116.899 179.96 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -175.04 128.69 0.29 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 101.579 -3.489 . . . . 10.0 101.579 -179.823 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.615 ' CD2' HD12 ' A' ' 115' ' ' LEU . 82.0 m95 -127.16 114.1 17.25 Favored 'General case' 0 C--N 1.322 -0.608 0 O-C-N 126.78 2.55 . . . . 10.0 111.824 179.727 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.1 175.33 7.78 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 107.306 -1.368 . . . . 10.0 107.306 179.81 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -114.9 149.34 37.35 Favored 'General case' 0 C--O 1.241 0.606 0 N-CA-C 116.306 1.965 . . . . 10.0 116.306 -179.893 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.1 tt -114.84 -0.74 13.39 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 114.212 -1.358 . . . . 10.0 109.582 -179.88 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.1 t 173.83 156.32 0.12 Allowed 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 117.287 2.329 . . . . 10.0 117.287 -179.389 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -146.78 122.31 10.41 Favored 'General case' 0 C--N 1.322 -0.624 0 O-C-N 126.158 2.161 . . . . 10.0 105.289 -179.883 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.2 tt0 -135.81 144.01 45.48 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 115.991 1.849 . . . . 10.0 115.991 179.489 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 62.0 29.36 17.69 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 125.036 1.46 . . . . 10.0 111.799 179.832 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.451 ' CE1' ' HG3' ' A' ' 17' ' ' GLU . 1.7 p90 -76.18 -26.26 56.01 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-O 118.527 -0.749 . . . . 10.0 112.281 179.892 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.451 ' HG3' ' CE1' ' A' ' 16' ' ' PHE . 5.0 mt-10 -71.25 -32.14 68.39 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 122.848 1.308 . . . . 10.0 111.968 179.932 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -78.91 -29.18 44.09 Favored 'General case' 0 C--O 1.215 -0.74 0 CA-C-N 113.37 -1.741 . . . . 10.0 108.103 -179.832 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.43 ' CE1' HD23 ' A' ' 20' ' ' LEU . 0.1 OUTLIER -65.92 -35.81 81.65 Favored 'General case' 0 C--O 1.247 0.956 0 O-C-N 124.213 0.946 . . . . 10.0 110.12 -179.934 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.43 HD23 ' CE1' ' A' ' 19' ' ' TYR . 4.2 mt -77.02 -33.47 57.44 Favored 'General case' 0 C--O 1.22 -0.48 0 CA-C-O 121.692 0.758 . . . . 10.0 109.598 -179.858 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.31 -23.93 60.33 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 107.672 -1.233 . . . . 10.0 107.672 -179.877 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.14 -34.69 66.23 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 126.016 2.073 . . . . 10.0 111.968 -179.699 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -119.28 7.81 11.33 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 119.23 0.923 . . . . 10.0 113.439 179.883 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 t0 55.53 78.16 0.2 Allowed 'General case' 0 N--CA 1.475 0.808 0 O-C-N 124.92 1.387 . . . . 10.0 112.34 -179.831 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.556 HG22 ' O ' ' A' ' 25' ' ' VAL . 2.9 p -118.74 54.29 0.25 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.506 0 CA-C-O 124.057 1.884 . . . . 10.0 107.464 179.737 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.432 ' ND2' ' N ' ' A' ' 26' ' ' ASN . 0.0 OUTLIER 60.14 146.08 0.01 OUTLIER 'General case' 0 C--O 1.225 -0.185 0 N-CA-C 118.655 2.835 . . . . 10.0 118.655 179.328 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 33.7 m -76.04 -30.77 20.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 113.417 -1.719 . . . . 10.0 113.237 179.892 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.27 -28.64 67.38 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 119.885 -1.759 . . . . 10.0 111.576 179.861 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.552 HD22 HG22 ' A' ' 25' ' ' VAL . 7.8 tp -77.87 -32.74 52.13 Favored 'General case' 0 N--CA 1.447 -0.595 0 O-C-N 123.847 0.717 . . . . 10.0 112.486 179.83 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 15.8 ttp85 -64.54 -32.87 74.7 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 124.446 2.07 . . . . 10.0 113.065 179.825 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -74.16 -41.16 61.96 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 113.794 -1.548 . . . . 10.0 111.058 -179.829 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.669 HG21 ' CE2' ' A' ' 57' ' ' PHE . 4.8 mm -74.89 -49.27 29.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 C-N-CA 125.136 1.375 . . . . 10.0 111.488 179.709 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -58.18 -40.51 81.68 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 117.643 -1.17 . . . . 10.0 112.746 -179.906 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.433 ' HA ' ' CZ ' ' A' ' 16' ' ' PHE . 0.1 OUTLIER -52.37 -29.88 26.1 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 120.41 1.459 . . . . 10.0 111.993 -179.486 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -109.0 23.99 13.76 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 119.481 1.037 . . . . 10.0 109.703 -179.777 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 2.3 tt -123.76 132.66 53.85 Favored 'General case' 0 CA--C 1.522 -0.122 0 O-C-N 125.21 1.568 . . . . 10.0 108.925 179.93 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 4.4 mmtp -119.66 106.02 42.62 Favored Pre-proline 0 N--CA 1.477 0.895 0 N-CA-C 104.644 -2.354 . . . . 10.0 104.644 179.66 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -66.6 -145.84 0.02 OUTLIER 'Trans proline' 0 C--N 1.356 0.95 0 C-N-CA 123.962 3.108 . . . . 10.0 117.522 -179.84 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 179.68 113.27 0.04 OUTLIER 'General case' 0 C--O 1.238 0.455 0 N-CA-C 106.236 -1.765 . . . . 10.0 106.236 -179.797 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.6 mmtp -80.08 168.56 18.99 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 117.401 -1.285 . . . . 10.0 111.825 -179.879 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -164.63 149.94 9.98 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 104.796 -2.298 . . . . 10.0 104.796 179.912 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 3.6 mm -133.69 154.58 38.79 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.632 0 N-CA-C 113.343 0.868 . . . . 10.0 113.343 -179.684 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.447 ' CG2' ' HD3' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -148.02 129.66 6.15 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 N-CA-C 105.7 -1.963 . . . . 10.0 105.7 179.576 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.472 ' HG2' ' HA ' ' A' ' 48' ' ' HIS . 0.8 OUTLIER -109.71 122.85 48.42 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-O 122.863 1.316 . . . . 10.0 111.029 -179.93 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -166.04 146.68 6.56 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 116.055 -1.926 . . . . 10.0 108.493 -179.941 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 74.19 -109.54 2.82 Favored Glycine 0 CA--C 1.537 1.417 0 O-C-N 126.119 2.137 . . . . 10.0 109.7 179.946 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.542 ' CB ' ' HB3' ' A' ' 65' ' ' GLN 0.256 2.8 m-20 -96.79 26.03 4.84 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 113.853 -1.174 . . . . 10.0 108.843 179.228 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . 0.472 ' HA ' ' HG2' ' A' ' 44' ' ' GLN . 8.3 m-70 77.01 -163.46 0.04 OUTLIER 'General case' 0 N--CA 1.434 -1.24 0 C-N-CA 126.695 1.998 . . . . 10.0 111.409 176.465 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.498 ' HG2' ' CD1' ' A' ' 51' ' ' ILE . 4.9 ttm 10.01 123.06 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.057 0 O-C-N 129.046 3.966 . . . . 10.0 119.261 -177.879 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 11.8 mt -144.53 106.46 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.865 0 N-CA-C 102.408 -3.182 . . . . 10.0 102.408 179.104 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.498 ' CD1' ' HG2' ' A' ' 49' ' ' MET . 1.2 mp -96.08 131.85 41.82 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.054 0 CA-C-O 124.846 2.26 . . . . 10.0 112.123 -178.795 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.606 HH21 HD11 ' A' ' 54' ' ' LEU . 0.0 OUTLIER -120.14 139.86 51.98 Favored 'General case' 0 N--CA 1.43 -1.466 0 CA-C-N 112.392 -2.186 . . . . 10.0 110.139 179.264 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 92.2 m -120.35 145.7 46.88 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 102.501 -3.148 . . . . 10.0 102.501 -179.86 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.606 HD11 HH21 ' A' ' 52' ' ' ARG . 97.0 mt -139.22 150.45 45.55 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 121.256 3.799 . . . . 10.0 121.256 179.909 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 78.4 p -179.27 174.84 0.99 Allowed 'General case' 0 C--O 1.24 0.577 0 CA-C-N 112.714 -2.039 . . . . 10.0 106.128 179.996 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 16.5 p -71.8 -22.02 61.63 Favored 'General case' 0 C--O 1.241 0.615 0 O-C-N 124.414 1.071 . . . . 10.0 109.892 179.308 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.669 ' CE2' HG21 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -86.11 173.96 9.49 Favored 'General case' 0 C--O 1.245 0.865 0 C-N-CA 125.795 1.638 . . . . 10.0 109.908 -179.919 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -47.35 127.14 10.54 Favored 'General case' 0 C--O 1.241 0.653 0 O-C-N 125.9 2.0 . . . . 10.0 114.159 -179.948 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 10.9 p-10 -100.04 177.31 5.13 Favored 'General case' 0 C--O 1.237 0.421 0 O-C-N 125.683 1.864 . . . . 10.0 108.857 179.794 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.466 ' C ' HD13 ' A' ' 61' ' ' ILE . 9.8 p90 -159.24 143.08 14.99 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 103.269 -2.863 . . . . 10.0 103.269 179.732 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.466 HD13 ' C ' ' A' ' 60' ' ' TYR . 0.1 OUTLIER -115.83 153.43 17.42 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.797 0 CA-C-O 123.679 1.704 . . . . 10.0 110.307 -179.87 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -136.09 -178.63 5.23 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 104.195 -2.521 . . . . 10.0 104.195 179.964 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 34.1 t0 -150.33 122.24 8.17 Favored 'General case' 0 N--CA 1.437 -1.125 0 CA-C-N 113.003 -1.908 . . . . 10.0 106.508 179.888 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.873 ' CD2' HG11 ' A' ' 86' ' ' VAL . 4.8 m-85 -93.67 -96.09 0.15 Allowed 'General case' 0 N--CA 1.44 -0.947 0 C-N-CA 125.629 1.572 . . . . 10.0 114.607 179.429 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.542 ' HB3' ' CB ' ' A' ' 47' ' ' ASP . 86.6 mt-30 84.33 114.01 0.05 Allowed 'General case' 0 C--N 1.298 -1.634 1 O-C-N 131.622 5.576 . . . . 10.0 108.393 -179.679 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 3.2 t -53.56 135.13 15.86 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.726 0 CA-C-N 113.023 -1.899 . . . . 10.0 107.369 179.573 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 63.04 70.5 1.03 Allowed Glycine 0 CA--C 1.53 1.014 0 CA-C-O 117.724 -1.598 . . . . 10.0 116.677 -179.756 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 5.6 tttp -179.43 148.45 0.35 Allowed 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 123.724 1.726 . . . . 10.0 113.715 179.617 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -97.18 133.37 41.91 Favored 'General case' 0 C--O 1.24 0.555 0 CA-C-N 113.129 -1.85 . . . . 10.0 109.662 -179.882 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.476 ' CD1' ' N ' ' A' ' 70' ' ' PHE . 1.0 OUTLIER -146.27 103.29 3.69 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 119.205 0.911 . . . . 10.0 111.345 -179.5 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.12 126.09 26.17 Favored 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 106.325 -1.731 . . . . 10.0 106.325 -179.77 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.426 ' OE1' HD12 ' A' ' 74' ' ' LEU . 2.2 mm-40 -109.72 96.07 6.02 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 112.407 0.521 . . . . 10.0 112.407 179.93 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -76.65 81.07 3.3 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 105.48 -2.044 . . . . 10.0 105.48 179.992 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.426 HD12 ' OE1' ' A' ' 72' ' ' GLU . 1.5 mp -67.43 120.94 14.74 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-N 112.479 -2.146 . . . . 10.0 113.248 179.946 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.452 HG23 ' O ' ' A' ' 75' ' ' THR . 1.2 t -159.83 100.18 1.42 Allowed 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 105.619 -1.993 . . . . 10.0 105.619 -179.924 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -167.69 -46.26 0.03 OUTLIER Glycine 0 N--CA 1.443 -0.884 0 O-C-N 127.277 2.86 . . . . 10.0 111.384 179.932 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 16.0 mt -137.97 -71.53 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 N-CA-C 107.517 -1.29 . . . . 10.0 107.517 -179.994 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -76.41 -22.14 55.09 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 125.585 1.803 . . . . 10.0 113.063 -179.981 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 60.16 -162.63 0.26 Allowed 'General case' 0 N--CA 1.478 0.937 0 CA-C-O 116.903 -1.522 . . . . 10.0 112.136 179.984 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 12.4 ttm105 74.89 137.07 0.06 Allowed 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 121.023 1.738 . . . . 10.0 109.394 -179.678 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.51 164.22 12.35 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 107.874 -1.158 . . . . 10.0 107.874 -179.874 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -162.33 159.47 25.48 Favored 'General case' 0 C--O 1.218 -0.581 0 N-CA-C 105.561 -2.014 . . . . 10.0 105.561 -179.984 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 2.6 ttp -122.24 124.92 44.92 Favored 'General case' 0 N--CA 1.448 -0.554 1 N-CA-C 99.066 -4.42 . . . . 10.0 99.066 -179.838 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.459 HG22 ' CZ ' ' A' ' 70' ' ' PHE . 1.1 m -124.77 137.66 54.31 Favored 'General case' 0 C--O 1.214 -0.77 0 N-CA-C 118.828 2.899 . . . . 10.0 118.828 -179.411 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -124.47 143.63 50.54 Favored 'General case' 0 CA--C 1.502 -0.9 0 N-CA-C 104.793 -2.299 . . . . 10.0 104.793 -179.754 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.873 HG11 ' CD2' ' A' ' 64' ' ' PHE . 3.0 m -123.55 146.62 28.66 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 N-CA-C 102.279 -3.23 . . . . 10.0 102.279 179.932 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 6.0 p -143.91 104.24 4.13 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 113.942 -1.481 . . . . 10.0 111.01 179.965 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 13.8 p-90 -61.74 137.75 58.27 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 104.987 -2.227 . . . . 10.0 104.987 -179.876 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -102.63 -54.91 2.55 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 102.624 -3.102 . . . . 10.0 102.624 179.794 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -168.94 -86.2 0.06 OUTLIER Glycine 0 CA--C 1.501 -0.836 0 N-CA-C 107.023 -2.431 . . . . 10.0 107.023 -179.912 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -102.49 14.0 33.08 Favored 'General case' 0 N--CA 1.446 -0.634 0 O-C-N 124.748 0.911 . . . . 10.0 112.566 -179.884 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -136.65 174.29 10.78 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 123.627 1.679 . . . . 10.0 108.633 -179.86 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -144.85 136.75 25.77 Favored 'General case' 0 C--O 1.216 -0.658 0 CA-C-N 114.549 -1.205 . . . . 10.0 107.949 179.847 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -126.18 149.23 49.15 Favored 'General case' 0 C--O 1.212 -0.906 0 CA-C-N 115.446 -0.797 . . . . 10.0 113.101 179.993 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -139.2 122.83 17.43 Favored 'General case' 0 C--N 1.321 -0.658 0 O-C-N 125.594 1.809 . . . . 10.0 113.219 179.85 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 14.1 t -111.68 113.93 45.6 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 N-CA-C 106.212 -1.773 . . . . 10.0 106.212 179.727 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -90.81 79.96 5.91 Favored 'General case' 0 C--O 1.245 0.826 0 O-C-N 125.118 1.511 . . . . 10.0 108.002 -179.949 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 24.5 ttpp -75.94 89.12 2.93 Favored 'General case' 0 CA--C 1.521 -0.159 0 C-N-CA 124.98 1.312 . . . . 10.0 113.352 -179.919 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -119.91 -65.28 0.27 Allowed Glycine 0 N--CA 1.436 -1.304 0 C-N-CA 125.498 1.523 . . . . 10.0 110.881 179.968 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -148.41 -32.18 0.25 Allowed 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 115.693 1.738 . . . . 10.0 115.693 -179.892 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 61.3 mmtt -80.1 -175.82 5.22 Favored 'General case' 0 C--O 1.215 -0.722 0 N-CA-C 115.115 1.524 . . . . 10.0 115.115 -179.856 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -105.88 -29.48 9.97 Favored 'General case' 0 N--CA 1.452 -0.358 0 O-C-N 125.833 1.958 . . . . 10.0 114.628 179.961 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -113.2 -18.62 7.12 Favored Glycine 0 N--CA 1.465 0.63 0 CA-C-O 118.411 -1.216 . . . . 10.0 115.825 -179.911 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -48.16 109.14 0.2 Allowed 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 120.329 2.065 . . . . 10.0 113.216 -179.918 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 177.55 149.13 7.69 Favored Glycine 0 N--CA 1.448 -0.554 0 N-CA-C 109.539 -1.424 . . . . 10.0 109.539 -179.688 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 9.3 m0 -111.21 121.18 44.62 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 118.708 1.254 . . . . 10.0 109.949 -179.987 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 60.2 m -104.59 108.9 20.58 Favored 'General case' 0 CA--C 1.499 -1.005 0 O-C-N 123.924 0.765 . . . . 10.0 109.259 179.586 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 -88.37 156.52 19.1 Favored 'General case' 0 C--O 1.245 0.835 0 C-N-CA 124.909 1.284 . . . . 10.0 108.237 179.719 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 109' ' ' TRP . . . . . 0.428 ' CD1' ' C ' ' A' ' 109' ' ' TRP . 2.4 t90 -175.46 104.65 0.08 Allowed 'General case' 0 C--O 1.215 -0.741 0 O-C-N 121.306 -0.872 . . . . 10.0 109.141 179.771 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.404 HD12 ' CE2' ' A' ' 4' ' ' PHE . 5.1 mt -78.49 146.47 8.08 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 125.799 2.714 . . . . 10.0 114.519 179.79 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -133.68 78.77 1.79 Allowed 'General case' 0 C--O 1.222 -0.366 0 CA-C-N 113.579 -1.646 . . . . 10.0 108.226 -179.779 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 73.62 -101.89 1.23 Allowed Glycine 0 N--CA 1.449 -0.443 0 N-CA-C 108.22 -1.952 . . . . 10.0 108.22 179.889 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -112.88 21.98 14.92 Favored 'General case' 0 C--O 1.214 -0.797 0 O-C-N 124.928 1.016 . . . . 10.0 109.596 179.889 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -127.71 139.92 52.39 Favored 'General case' 0 C--O 1.216 -0.683 0 CA-C-O 122.64 1.209 . . . . 10.0 110.131 -179.829 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.615 HD12 ' CD2' ' A' ' 8' ' ' TRP . 0.2 OUTLIER -105.58 125.18 50.69 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 114.402 -1.272 . . . . 10.0 109.135 -179.988 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 40.1 t-80 -111.44 101.69 10.12 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 106.491 -1.67 . . . . 10.0 106.491 179.684 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.601 ' O ' HD23 ' A' ' 117' ' ' LEU . 2.0 tt -112.7 126.3 55.24 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 122.415 1.102 . . . . 10.0 113.075 179.989 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -112.59 103.75 11.82 Favored 'General case' 0 CA--C 1.505 -0.781 0 O-C-N 119.891 -1.755 . . . . 10.0 108.272 179.951 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 1.4 ttm -94.23 161.29 14.32 Favored 'General case' 0 CA--C 1.509 -0.601 0 N-CA-C 108.184 -1.043 . . . . 10.0 108.184 -179.923 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 49.9 mtm180 -150.13 -177.37 5.89 Favored 'General case' 0 C--N 1.316 -0.874 0 C-N-CA 125.135 1.374 . . . . 10.0 114.348 179.915 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 165.67 129.92 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.493 0 O-C-N 128.141 3.401 . . . . 10.0 107.985 -179.989 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 53.51 36.21 22.7 Favored 'General case' 0 C--O 1.244 0.787 0 N-CA-C 114.813 1.412 . . . . 10.0 114.813 179.853 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 81.3 -6.69 63.01 Favored Glycine 0 CA--C 1.529 0.914 0 CA-C-O 116.052 -2.527 . . . . 10.0 114.671 -179.818 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -82.02 157.08 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 CA-C-N 119.041 1.421 . . . . 10.0 109.573 -179.854 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 3.5 m -127.5 114.17 17.1 Favored 'General case' 0 C--O 1.239 0.522 0 O-C-N 126.367 2.292 . . . . 10.0 113.074 179.781 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -120.57 151.86 38.86 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 105.908 -1.886 . . . . 10.0 105.908 -179.779 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.61 154.87 51.29 Favored 'General case' 0 C--O 1.224 -0.26 0 O-C-N 125.271 1.607 . . . . 10.0 113.114 -179.905 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . 0.457 ' HB2' HD22 ' A' ' 117' ' ' LEU . 0.4 OUTLIER -145.63 109.63 4.86 Favored 'General case' 0 C--N 1.323 -0.546 0 O-C-N 126.267 2.229 . . . . 10.0 108.378 179.662 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 16.9 t -91.22 140.37 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 N-CA-C 107.935 -1.135 . . . . 10.0 107.935 -179.613 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -123.84 169.44 11.57 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 119.221 -0.418 . . . . 10.0 111.008 179.721 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -141.48 124.74 16.48 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 105.789 -1.93 . . . . 10.0 105.789 -179.988 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . 0.515 ' HB2' ' CZ3' ' A' ' 8' ' ' TRP . 13.7 tttt -78.4 132.0 37.18 Favored 'General case' 0 C--N 1.324 -0.533 0 O-C-N 121.365 -0.834 . . . . 10.0 110.495 -179.893 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 2.2 t -107.31 -54.7 5.78 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 N-CA-C 115.009 1.485 . . . . 10.0 115.009 179.94 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 6.1 t-160 . . . . . 0 C--O 1.252 1.216 0 CA-C-O 117.143 -1.408 . . . . 10.0 113.37 -179.907 . . . . . . . . 0 0 . 1 stop_ save_