data_1mpv_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 1mpv _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 55.4 p-80 . . . . . 0 N--CA 1.455 -0.211 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.5 t-105 -75.96 112.47 12.42 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 122.77 0.428 . . . . 0.0 110.179 -179.145 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -89.64 98.31 11.69 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 170.014 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -67.62 -15.85 63.86 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.492 1.117 . . . . 0.0 113.487 178.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 57.9 mt -64.73 -52.44 57.07 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 118.522 0.601 . . . . 0.0 110.001 -178.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 76.3 t -89.48 -31.79 5.47 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 C-N-CA 124.306 1.042 . . . . 0.0 109.664 176.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 66.5 mtm180 85.86 58.17 0.01 OUTLIER 'General case' 0 C--N 1.344 0.331 0 C-N-CA 127.821 2.448 . . . . 0.0 109.854 178.22 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -151.0 167.29 28.07 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 124.093 0.957 . . . . 0.0 110.843 176.302 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 96.6 m95 -87.4 116.22 25.35 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 124.073 0.949 . . . . 0.0 109.242 174.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 94.1 t . . . . . 0 N--CA 1.453 -0.322 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 178.553 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 57.3 p-80 . . . . . 0 N--CA 1.455 -0.18 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 77.0 t-105 -75.91 117.93 18.16 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 122.967 0.507 . . . . 0.0 110.235 -177.353 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -89.66 110.22 21.12 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 173.106 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 41.6 mt -61.78 -37.33 83.94 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.915 1.286 . . . . 0.0 112.02 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 64.8 tp -54.83 -55.2 32.82 Favored 'General case' 0 C--N 1.341 0.235 0 C-N-CA 123.962 0.905 . . . . 0.0 111.523 -174.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 57.5 t -89.71 -28.03 5.14 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 C-N-CA 123.899 0.88 . . . . 0.0 110.557 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 75.0 mtp180 74.13 60.69 0.08 Allowed 'General case' 0 C--N 1.34 0.175 0 C-N-CA 125.414 1.486 . . . . 0.0 109.955 -174.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.7 162.96 39.69 Favored 'General case' 0 CA--C 1.528 0.114 0 C-N-CA 123.708 0.803 . . . . 0.0 110.774 173.531 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -82.19 118.34 23.01 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.946 0.898 . . . . 0.0 109.583 175.028 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 90.5 t . . . . . 0 N--CA 1.453 -0.306 0 N-CA-C 107.174 -1.417 . . . . 0.0 107.174 176.902 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 29.1 p-80 . . . . . 0 N--CA 1.455 -0.177 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 74.0 t-105 -79.44 114.45 18.38 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 178.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -89.54 97.82 11.41 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 107.289 -1.375 . . . . 0.0 107.289 170.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 6.6 tt -67.79 -23.0 65.16 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.738 1.215 . . . . 0.0 112.225 -178.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 9.5 mp -57.6 -55.52 33.79 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.568 0.747 . . . . 0.0 110.046 -178.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 60.5 t -89.53 -25.58 5.6 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 124.112 0.965 . . . . 0.0 110.339 178.058 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 71.6 mtt85 75.75 58.92 0.05 Allowed 'General case' 0 C--N 1.343 0.283 0 C-N-CA 126.577 1.951 . . . . 0.0 109.942 -177.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.6 165.12 34.31 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 124.305 1.042 . . . . 0.0 110.172 172.773 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -83.5 137.43 33.88 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 123.828 0.851 . . . . 0.0 109.801 175.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 90.8 t . . . . . 0 N--CA 1.455 -0.182 0 C-N-CA 124.954 1.302 . . . . 0.0 108.791 -176.963 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 32.2 p-80 . . . . . 0 N--CA 1.457 -0.09 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.5 t-105 -79.64 114.88 18.9 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 178.428 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -89.62 97.63 11.3 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 170.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 63.9 tp -63.6 -28.91 70.25 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 125.116 1.367 . . . . 0.0 111.814 178.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 66.6 mt -54.06 -51.92 62.56 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.099 0.96 . . . . 0.0 111.237 -176.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 76.9 t -89.52 -34.31 6.67 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 C-N-CA 123.732 0.813 . . . . 0.0 109.811 175.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 72.6 mtm180 87.63 56.28 0.01 OUTLIER 'General case' 0 C--N 1.343 0.307 0 C-N-CA 128.041 2.536 . . . . 0.0 109.307 -176.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.75 165.79 32.42 Favored 'General case' 0 C--N 1.34 0.171 0 C-N-CA 123.707 0.803 . . . . 0.0 110.752 175.438 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -80.6 139.81 36.07 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 123.693 0.797 . . . . 0.0 109.912 174.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 91.3 t . . . . . 0 N--CA 1.454 -0.227 0 C-N-CA 124.93 1.292 . . . . 0.0 108.597 -178.935 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 56.9 p-80 . . . . . 0 N--CA 1.455 -0.185 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.9 t-105 -74.24 121.85 21.91 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 123.165 0.586 . . . . 0.0 110.493 -177.179 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -91.87 115.79 28.36 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 170.315 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 7.0 mp -69.54 -29.21 66.76 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.283 1.033 . . . . 0.0 111.674 -177.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 75.1 mt -63.65 -56.4 16.05 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.356 0.662 . . . . 0.0 110.861 -174.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 59.8 t -89.6 -22.42 6.48 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 124.09 0.956 . . . . 0.0 110.519 -178.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 75.3 mtt85 70.8 59.91 0.2 Allowed 'General case' 0 C--N 1.341 0.228 0 C-N-CA 125.273 1.429 . . . . 0.0 110.018 179.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.59 163.31 38.79 Favored 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 124.248 1.019 . . . . 0.0 110.459 174.665 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 97.3 m95 -84.02 119.98 25.59 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 123.979 0.912 . . . . 0.0 109.4 174.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 88.8 t . . . . . 0 N--CA 1.453 -0.281 0 N-CA-C 106.977 -1.49 . . . . 0.0 106.977 178.439 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 30.0 p-80 . . . . . 0 N--CA 1.456 -0.166 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.5 t-105 -81.23 117.4 21.72 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 178.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -89.53 107.53 19.13 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 176.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 44.2 mt -67.86 -22.94 65.1 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.081 1.352 . . . . 0.0 112.573 -179.216 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 9.6 mp -63.66 -43.06 97.85 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.292 0.637 . . . . 0.0 110.826 -176.086 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 60.5 t -106.12 -23.36 4.48 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 C-N-CA 124.855 1.262 . . . . 0.0 111.096 -179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 13.5 mtm-85 71.05 59.43 0.18 Allowed 'General case' 0 C--N 1.342 0.258 0 C-N-CA 126.338 1.855 . . . . 0.0 109.77 -174.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.59 167.28 27.73 Favored 'General case' 0 C--N 1.339 0.12 0 C-N-CA 124.211 1.004 . . . . 0.0 110.351 173.097 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -78.13 139.09 39.01 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 123.639 0.776 . . . . 0.0 110.181 175.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 85.2 t . . . . . 0 N--CA 1.455 -0.195 0 C-N-CA 124.991 1.316 . . . . 0.0 108.599 179.246 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 56.7 p-80 . . . . . 0 N--CA 1.455 -0.182 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.4 t-105 -77.62 113.99 16.01 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 123.167 0.587 . . . . 0.0 109.981 -179.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -89.66 99.86 12.78 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 107.436 -1.32 . . . . 0.0 107.436 171.16 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.21 -13.51 62.45 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.468 1.107 . . . . 0.0 113.698 -179.529 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 66.9 tp -66.55 -55.64 14.53 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 118.535 0.607 . . . . 0.0 109.756 179.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 58.2 t -89.45 -23.31 6.24 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 C-N-CA 124.238 1.015 . . . . 0.0 110.054 178.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 74.9 mtt85 73.48 60.23 0.09 Allowed 'General case' 0 C--N 1.341 0.237 0 C-N-CA 126.359 1.864 . . . . 0.0 109.918 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.56 162.8 39.92 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.306 1.042 . . . . 0.0 110.45 173.847 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 91.2 m95 -84.0 119.82 25.38 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.779 0.832 . . . . 0.0 109.399 174.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 86.3 t . . . . . 0 N--CA 1.453 -0.303 0 N-CA-C 107.027 -1.472 . . . . 0.0 107.027 177.443 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 55.9 p-80 . . . . . 0 N--CA 1.456 -0.138 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 74.2 t-105 -78.77 110.44 13.94 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 123.197 0.599 . . . . 0.0 110.204 -177.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -89.8 96.0 10.49 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 170.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 8.3 tt -63.02 -33.26 75.04 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.705 1.202 . . . . 0.0 111.54 178.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -52.35 -50.07 63.06 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.029 1.331 . . . . 0.0 111.116 -175.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 73.7 t -89.28 -32.13 5.62 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 C-N-CA 123.567 0.747 . . . . 0.0 109.44 174.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 38.6 ttp180 90.63 51.71 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 126.154 1.782 . . . . 0.0 109.719 177.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.83 163.75 37.89 Favored 'General case' 0 C--N 1.34 0.184 0 C-N-CA 123.49 0.716 . . . . 0.0 111.455 178.139 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 88.8 m95 -83.81 122.18 28.33 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.984 0.914 . . . . 0.0 109.321 172.294 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 93.9 t . . . . . 0 N--CA 1.453 -0.287 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 175.735 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 57.3 p-80 . . . . . 0 N--CA 1.455 -0.188 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 77.0 t-105 -76.26 114.7 15.24 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.04 0.536 . . . . 0.0 110.426 -177.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -89.71 105.56 17.88 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 107.694 -1.224 . . . . 0.0 107.694 170.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -81.04 10.42 5.21 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.511 1.124 . . . . 0.0 113.381 -179.333 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 71.7 mt -85.55 -52.31 5.91 Favored 'General case' 0 C--N 1.34 0.185 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 174.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 61.9 t -89.77 -22.83 6.32 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 124.523 1.129 . . . . 0.0 110.337 176.075 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.3 mpt_? 68.58 62.74 0.34 Allowed 'General case' 0 C--N 1.342 0.249 0 C-N-CA 125.939 1.696 . . . . 0.0 109.419 -173.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.66 163.09 39.37 Favored 'General case' 0 C--N 1.339 0.114 0 C-N-CA 123.786 0.835 . . . . 0.0 110.875 172.813 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 96.9 m95 -84.56 118.68 24.49 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 124.027 0.931 . . . . 0.0 109.432 175.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 87.8 t . . . . . 0 N--CA 1.454 -0.274 0 N-CA-C 107.33 -1.359 . . . . 0.0 107.33 177.676 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 57.3 p-80 . . . . . 0 N--CA 1.455 -0.184 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.7 t-105 -75.06 116.59 15.97 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.106 0.562 . . . . 0.0 110.46 -177.255 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -89.75 104.05 16.65 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 107.526 -1.287 . . . . 0.0 107.526 169.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 59.4 tp -65.82 -25.06 67.05 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.852 1.261 . . . . 0.0 112.214 -179.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 69.8 mt -61.07 -56.24 23.3 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.232 0.613 . . . . 0.0 110.749 -177.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 57.9 t -89.55 -24.5 5.88 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 C-N-CA 124.242 1.017 . . . . 0.0 110.473 179.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 71.8 mtt85 74.03 60.57 0.08 Allowed 'General case' 0 C--N 1.342 0.262 0 C-N-CA 126.225 1.81 . . . . 0.0 110.11 -179.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.62 162.19 41.13 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 124.15 0.98 . . . . 0.0 110.477 173.309 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -83.94 118.94 24.33 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.946 0.899 . . . . 0.0 109.328 174.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 98.1 t . . . . . 0 N--CA 1.452 -0.366 0 N-CA-C 107.178 -1.416 . . . . 0.0 107.178 178.838 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 57.1 p-80 . . . . . 0 N--CA 1.456 -0.175 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 60.4 t-105 -80.47 121.76 26.15 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 122.424 0.289 . . . . 0.0 110.28 -178.21 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -89.85 111.93 23.12 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 171.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 51.4 mt -64.92 -32.04 73.56 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.791 1.236 . . . . 0.0 112.124 179.162 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 73.1 mt -59.53 -53.48 57.63 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.515 0.726 . . . . 0.0 111.139 -173.541 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 61.6 t -89.47 -24.78 5.81 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 C-N-CA 123.999 0.92 . . . . 0.0 110.364 178.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 86.6 mtm180 73.92 58.08 0.09 Allowed 'General case' 0 C--N 1.344 0.332 0 C-N-CA 126.078 1.751 . . . . 0.0 109.707 -179.042 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.84 167.51 27.27 Favored 'General case' 0 C--N 1.339 0.138 0 C-N-CA 124.009 0.924 . . . . 0.0 110.871 175.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -75.38 142.32 43.12 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 123.239 0.616 . . . . 0.0 109.838 170.203 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 79.4 t . . . . . 0 N--CA 1.453 -0.294 0 N-CA-C 106.947 -1.501 . . . . 0.0 106.947 175.585 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 57.2 p-80 . . . . . 0 N--CA 1.455 -0.179 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.5 t-105 -77.19 115.28 16.84 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 123.124 0.57 . . . . 0.0 110.106 -179.092 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -89.65 103.11 15.79 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 170.301 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 60.1 tp -65.59 -29.05 69.6 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.925 1.29 . . . . 0.0 112.045 -179.342 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -57.39 -53.07 62.27 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.607 0.763 . . . . 0.0 110.705 -176.721 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 59.1 t -89.39 -26.25 5.48 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 C-N-CA 123.879 0.872 . . . . 0.0 110.407 177.75 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 74.03 60.15 0.08 Allowed 'General case' 0 C--N 1.342 0.244 0 C-N-CA 126.36 1.864 . . . . 0.0 110.069 -175.75 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.61 162.58 40.37 Favored 'General case' 0 C--O 1.231 0.128 0 C-N-CA 123.696 0.798 . . . . 0.0 110.771 173.064 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 92.1 m95 -83.89 120.42 26.05 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 123.735 0.814 . . . . 0.0 109.371 174.292 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 84.8 t . . . . . 0 N--CA 1.453 -0.32 0 N-CA-C 106.933 -1.506 . . . . 0.0 106.933 176.999 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 51.1 p-80 . . . . . 0 N--CA 1.457 -0.094 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 75.8 t-105 -75.75 116.64 16.66 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.233 0.613 . . . . 0.0 110.353 -177.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -89.72 105.76 18.01 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 169.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 60.5 tp -67.97 -29.52 68.59 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.72 1.208 . . . . 0.0 112.103 -177.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -58.21 -51.84 68.06 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.541 0.736 . . . . 0.0 110.618 -176.175 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 81.1 t -89.69 -26.28 5.42 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 C-N-CA 124.303 1.041 . . . . 0.0 110.511 177.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 76.4 mtp180 75.1 59.79 0.06 Allowed 'General case' 0 C--N 1.341 0.219 0 C-N-CA 125.88 1.672 . . . . 0.0 110.491 -178.214 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -151.03 167.78 26.59 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 123.821 0.848 . . . . 0.0 110.693 174.124 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 96.5 m95 -86.77 120.33 27.96 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.96 0.904 . . . . 0.0 109.242 173.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 94.9 t . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 107.139 -1.43 . . . . 0.0 107.139 176.108 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 53.9 p-80 . . . . . 0 N--CA 1.455 -0.187 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 73.1 t-105 -80.7 110.69 16.44 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 123.167 0.587 . . . . 0.0 109.977 -179.605 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -89.62 91.98 8.89 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 171.574 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -61.52 -27.05 68.33 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.514 1.126 . . . . 0.0 113.126 177.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 65.3 tp -55.55 -52.95 62.0 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 124.739 1.216 . . . . 0.0 111.035 -177.22 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 58.3 t -89.16 -25.33 5.73 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 C-N-CA 123.617 0.767 . . . . 0.0 109.417 174.651 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 27.0 ttm180 83.37 52.46 0.01 OUTLIER 'General case' 0 C--N 1.342 0.243 0 C-N-CA 126.462 1.905 . . . . 0.0 109.822 175.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.76 166.89 29.06 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 124.34 1.056 . . . . 0.0 110.636 177.249 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 96.6 m95 -80.98 142.51 33.37 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 123.321 0.648 . . . . 0.0 109.654 171.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 97.8 t . . . . . 0 N--CA 1.454 -0.245 0 N-CA-C 107.422 -1.325 . . . . 0.0 107.422 178.926 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 56.5 p-80 . . . . . 0 N--CA 1.456 -0.164 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 75.1 t-105 -74.22 141.51 45.42 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 122.51 0.324 . . . . 0.0 110.626 -179.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -125.67 105.92 9.35 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 124.846 1.259 . . . . 0.0 107.723 170.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -67.24 -37.83 84.2 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.87 1.268 . . . . 0.0 110.806 178.125 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 65.6 mt -47.53 -49.16 26.93 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 125.372 1.469 . . . . 0.0 111.82 -173.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.647 ' O ' ' CB ' ' A' ' 30' ' ' ARG . 82.7 t -89.42 -45.9 15.28 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 171.402 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.647 ' CB ' ' O ' ' A' ' 29' ' ' VAL . 64.7 ttt180 103.41 52.4 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 177.4 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.91 166.85 29.36 Favored 'General case' 0 C--N 1.339 0.138 0 C-N-CA 124.211 1.004 . . . . 0.0 111.012 -179.933 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 87.4 m95 -86.66 125.19 33.69 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.939 0.896 . . . . 0.0 109.212 171.195 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 97.2 t . . . . . 0 N--CA 1.453 -0.293 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 177.222 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 53.3 p-80 . . . . . 0 N--CA 1.454 -0.264 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.0 t-105 -79.15 115.16 18.64 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 178.082 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -89.59 97.97 11.5 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 171.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.7 pp -68.47 -20.47 64.62 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.521 1.128 . . . . 0.0 113.043 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 66.2 tp -60.72 -54.2 48.13 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.525 0.73 . . . . 0.0 110.339 -178.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 85.6 t -89.46 -28.64 5.12 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 C-N-CA 123.967 0.907 . . . . 0.0 109.938 177.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 63.6 mtm180 84.88 55.93 0.01 OUTLIER 'General case' 0 C--N 1.343 0.295 0 C-N-CA 127.567 2.347 . . . . 0.0 110.004 176.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -151.01 173.63 14.09 Favored 'General case' 0 N--CA 1.457 -0.076 0 C-N-CA 124.368 1.067 . . . . 0.0 110.117 176.388 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -85.5 140.57 30.56 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 123.462 0.705 . . . . 0.0 109.557 172.099 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 84.2 t . . . . . 0 N--CA 1.454 -0.257 0 C-N-CA 125.213 1.405 . . . . 0.0 107.36 178.5 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 28.5 p-80 . . . . . 0 N--CA 1.456 -0.14 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 74.1 t-105 -79.92 113.8 18.36 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 178.403 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -89.59 96.58 10.76 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 107.432 -1.321 . . . . 0.0 107.432 171.624 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.14 -12.59 61.17 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.437 1.095 . . . . 0.0 113.545 178.624 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.8 tt -63.69 -57.66 9.33 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 179.493 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 57.7 t -89.24 -23.62 6.19 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 C-N-CA 124.131 0.972 . . . . 0.0 110.086 177.282 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 87.2 mtt-85 73.51 60.16 0.09 Allowed 'General case' 0 C--N 1.341 0.209 0 C-N-CA 126.306 1.842 . . . . 0.0 110.071 -176.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.6 165.83 32.12 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.468 1.107 . . . . 0.0 109.958 172.464 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -83.44 137.3 33.97 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 123.762 0.825 . . . . 0.0 109.783 176.124 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 86.9 t . . . . . 0 N--CA 1.455 -0.19 0 C-N-CA 124.951 1.3 . . . . 0.0 108.744 -176.96 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 57.3 p-80 . . . . . 0 N--CA 1.455 -0.211 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 73.7 t-105 -76.32 116.63 17.18 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 122.748 0.419 . . . . 0.0 110.542 -176.676 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -89.84 108.57 19.78 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 169.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -79.92 0.84 29.66 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.182 0.993 . . . . 0.0 113.647 -178.521 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 74.0 mt -77.73 -55.5 5.29 Favored 'General case' 0 C--N 1.34 0.183 0 N-CA-C 108.744 -0.835 . . . . 0.0 108.744 175.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 87.2 t -89.61 -17.75 8.0 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 125.134 1.374 . . . . 0.0 110.535 178.005 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 65.95 60.8 0.66 Allowed 'General case' 0 C--N 1.343 0.322 0 C-N-CA 125.626 1.571 . . . . 0.0 110.385 178.929 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -151.0 170.36 19.55 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.607 1.163 . . . . 0.0 110.413 175.041 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 98.0 m95 -87.17 120.82 28.85 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 124.033 0.933 . . . . 0.0 109.398 173.672 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 94.3 t . . . . . 0 N--CA 1.453 -0.292 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 175.256 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 57.1 p-80 . . . . . 0 N--CA 1.456 -0.154 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 74.6 t-105 -76.95 110.26 11.44 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 123.007 0.523 . . . . 0.0 110.41 -177.148 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -89.6 97.87 11.44 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 107.076 -1.454 . . . . 0.0 107.076 169.598 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 8.3 tt -65.41 -33.28 75.57 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.606 1.162 . . . . 0.0 111.322 178.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -50.15 -49.33 52.5 Favored 'General case' 0 C--N 1.342 0.242 0 C-N-CA 125.307 1.443 . . . . 0.0 111.238 -175.216 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.665 ' O ' ' CB ' ' A' ' 30' ' ' ARG . 90.3 t -89.22 -45.62 15.38 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 171.909 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.665 ' CB ' ' O ' ' A' ' 29' ' ' VAL . 62.3 ttt180 106.57 52.08 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 123.372 0.669 . . . . 0.0 109.244 175.433 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.98 162.52 40.67 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 123.959 0.903 . . . . 0.0 111.242 179.783 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 96.1 m95 -83.09 118.13 23.34 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 124.011 0.924 . . . . 0.0 109.331 173.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 89.1 t . . . . . 0 N--CA 1.454 -0.248 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 177.728 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 54.6 p-80 . . . . . 0 N--CA 1.454 -0.264 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.8 t-105 -75.35 115.17 14.72 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 179.701 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -89.42 102.23 14.9 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 170.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 61.6 tp -64.13 -34.03 77.14 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.821 1.249 . . . . 0.0 111.964 -177.302 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 65.2 tp -53.46 -54.79 31.87 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.04 0.936 . . . . 0.0 111.357 -177.01 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 88.2 t -89.85 -25.59 5.54 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 C-N-CA 124.087 0.955 . . . . 0.0 110.654 179.087 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 68.2 mtp85 74.72 60.45 0.07 Allowed 'General case' 0 C--N 1.341 0.198 0 C-N-CA 125.968 1.707 . . . . 0.0 110.668 -177.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -151.11 166.4 30.92 Favored 'General case' 0 N--CA 1.457 -0.108 0 C-N-CA 123.747 0.819 . . . . 0.0 110.615 173.04 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 96.9 m95 -87.4 114.67 24.22 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 124.048 0.939 . . . . 0.0 109.246 175.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 92.2 t . . . . . 0 N--CA 1.453 -0.303 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 178.98 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.075 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 72.5 m -68.32 95.72 0.62 Allowed 'General case' 0 C--N 1.339 0.122 0 C-N-CA 124.819 1.248 . . . . 0.0 110.392 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 55.4 p-80 -113.65 143.1 45.16 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 124.728 1.211 . . . . 0.0 109.14 176.076 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.5 t-105 -75.96 112.47 12.42 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 122.77 0.428 . . . . 0.0 110.179 -179.145 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -89.64 98.31 11.69 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 170.014 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -67.62 -15.85 63.86 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.492 1.117 . . . . 0.0 113.487 178.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 57.9 mt -64.73 -52.44 57.07 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 118.522 0.601 . . . . 0.0 110.001 -178.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 76.3 t -89.48 -31.79 5.47 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 C-N-CA 124.306 1.042 . . . . 0.0 109.664 176.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 66.5 mtm180 85.86 58.17 0.01 OUTLIER 'General case' 0 C--N 1.344 0.331 0 C-N-CA 127.821 2.448 . . . . 0.0 109.854 178.22 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -151.0 167.29 28.07 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 124.093 0.957 . . . . 0.0 110.843 176.302 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 96.6 m95 -87.4 116.22 25.35 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 124.073 0.949 . . . . 0.0 109.242 174.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 94.1 t -99.68 109.68 25.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 178.553 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 73.0 m -99.66 76.09 1.97 Allowed 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 124.567 1.147 . . . . 0.0 109.044 -177.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.336 0.006 0 CA-C-N 116.165 -0.471 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 -0.006 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 72.1 m -67.44 98.75 0.68 Allowed 'General case' 0 C--N 1.339 0.138 0 C-N-CA 124.596 1.158 . . . . 0.0 110.485 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 57.3 p-80 -116.15 139.25 50.52 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 124.614 1.165 . . . . 0.0 108.995 175.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 77.0 t-105 -75.91 117.93 18.16 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 122.967 0.507 . . . . 0.0 110.235 -177.353 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -89.66 110.22 21.12 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 173.106 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 41.6 mt -61.78 -37.33 83.94 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.915 1.286 . . . . 0.0 112.02 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 64.8 tp -54.83 -55.2 32.82 Favored 'General case' 0 C--N 1.341 0.235 0 C-N-CA 123.962 0.905 . . . . 0.0 111.523 -174.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 57.5 t -89.71 -28.03 5.14 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 C-N-CA 123.899 0.88 . . . . 0.0 110.557 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 75.0 mtp180 74.13 60.69 0.08 Allowed 'General case' 0 C--N 1.34 0.175 0 C-N-CA 125.414 1.486 . . . . 0.0 109.955 -174.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.7 162.96 39.69 Favored 'General case' 0 CA--C 1.528 0.114 0 C-N-CA 123.708 0.803 . . . . 0.0 110.774 173.531 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -82.19 118.34 23.01 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.946 0.898 . . . . 0.0 109.583 175.028 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 90.5 t -99.69 105.86 18.17 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.306 0 N-CA-C 107.174 -1.417 . . . . 0.0 107.174 176.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 68.7 m -99.61 74.56 1.88 Allowed 'General case' 0 N--CA 1.456 -0.132 0 C-N-CA 124.443 1.097 . . . . 0.0 109.032 -176.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.078 0 CA-C-N 116.19 -0.459 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.061 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 72.9 m -76.59 154.63 34.25 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 123.262 0.625 . . . . 0.0 110.323 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 29.1 p-80 -99.99 150.02 22.86 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 124.267 1.027 . . . . 0.0 108.877 172.068 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 74.0 t-105 -79.44 114.45 18.38 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 178.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -89.54 97.82 11.41 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 107.289 -1.375 . . . . 0.0 107.289 170.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 6.6 tt -67.79 -23.0 65.16 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.738 1.215 . . . . 0.0 112.225 -178.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 9.5 mp -57.6 -55.52 33.79 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.568 0.747 . . . . 0.0 110.046 -178.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 60.5 t -89.53 -25.58 5.6 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 124.112 0.965 . . . . 0.0 110.339 178.058 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 71.6 mtt85 75.75 58.92 0.05 Allowed 'General case' 0 C--N 1.343 0.283 0 C-N-CA 126.577 1.951 . . . . 0.0 109.942 -177.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.6 165.12 34.31 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 124.305 1.042 . . . . 0.0 110.172 172.773 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -83.5 137.43 33.88 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 123.828 0.851 . . . . 0.0 109.801 175.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 90.8 t -134.66 123.17 41.16 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.182 0 C-N-CA 124.954 1.302 . . . . 0.0 108.791 -176.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 7.4 m -99.35 81.41 2.53 Favored 'General case' 0 CA--C 1.529 0.152 0 N-CA-C 107.167 -1.42 . . . . 0.0 107.167 173.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.038 0 CA-C-N 116.428 -0.351 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.078 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 83.3 m -77.55 154.07 32.73 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 123.289 0.636 . . . . 0.0 110.238 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 32.2 p-80 -99.88 149.36 23.48 Favored 'General case' 0 C--N 1.339 0.121 0 C-N-CA 124.203 1.001 . . . . 0.0 108.781 172.017 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.5 t-105 -79.64 114.88 18.9 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 178.428 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -89.62 97.63 11.3 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 170.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 63.9 tp -63.6 -28.91 70.25 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 125.116 1.367 . . . . 0.0 111.814 178.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 66.6 mt -54.06 -51.92 62.56 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.099 0.96 . . . . 0.0 111.237 -176.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 76.9 t -89.52 -34.31 6.67 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 C-N-CA 123.732 0.813 . . . . 0.0 109.811 175.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 72.6 mtm180 87.63 56.28 0.01 OUTLIER 'General case' 0 C--N 1.343 0.307 0 C-N-CA 128.041 2.536 . . . . 0.0 109.307 -176.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.75 165.79 32.42 Favored 'General case' 0 C--N 1.34 0.171 0 C-N-CA 123.707 0.803 . . . . 0.0 110.752 175.438 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -80.6 139.81 36.07 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 123.693 0.797 . . . . 0.0 109.912 174.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 91.3 t -136.28 121.82 28.46 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.227 0 C-N-CA 124.93 1.292 . . . . 0.0 108.597 -178.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.3 m -99.54 148.27 24.46 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 124.215 1.006 . . . . 0.0 108.388 171.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.096 0 O-C-N 122.327 -0.233 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 -0.018 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 71.7 m -67.32 100.12 0.78 Allowed 'General case' 0 N--CA 1.457 -0.112 0 C-N-CA 124.598 1.159 . . . . 0.0 110.476 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 56.9 p-80 -117.04 137.0 52.54 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 124.663 1.185 . . . . 0.0 108.928 175.028 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.9 t-105 -74.24 121.85 21.91 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 123.165 0.586 . . . . 0.0 110.493 -177.179 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -91.87 115.79 28.36 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 170.315 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 7.0 mp -69.54 -29.21 66.76 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.283 1.033 . . . . 0.0 111.674 -177.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 75.1 mt -63.65 -56.4 16.05 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.356 0.662 . . . . 0.0 110.861 -174.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 59.8 t -89.6 -22.42 6.48 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 124.09 0.956 . . . . 0.0 110.519 -178.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 75.3 mtt85 70.8 59.91 0.2 Allowed 'General case' 0 C--N 1.341 0.228 0 C-N-CA 125.273 1.429 . . . . 0.0 110.018 179.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.59 163.31 38.79 Favored 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 124.248 1.019 . . . . 0.0 110.459 174.665 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 97.3 m95 -84.02 119.98 25.59 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 123.979 0.912 . . . . 0.0 109.4 174.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 88.8 t -99.46 103.84 15.27 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 N-CA-C 106.977 -1.49 . . . . 0.0 106.977 178.439 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 65.2 m -99.42 74.27 1.9 Allowed 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 124.46 1.104 . . . . 0.0 109.189 -176.309 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.088 0 CA-C-N 116.16 -0.473 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.064 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 73.8 m -76.6 154.63 34.23 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.321 0.648 . . . . 0.0 110.313 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 30.0 p-80 -99.96 149.82 23.05 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.271 1.028 . . . . 0.0 108.718 171.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.5 t-105 -81.23 117.4 21.72 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 178.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -89.53 107.53 19.13 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 176.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 44.2 mt -67.86 -22.94 65.1 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.081 1.352 . . . . 0.0 112.573 -179.216 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 9.6 mp -63.66 -43.06 97.85 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.292 0.637 . . . . 0.0 110.826 -176.086 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 60.5 t -106.12 -23.36 4.48 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 C-N-CA 124.855 1.262 . . . . 0.0 111.096 -179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 13.5 mtm-85 71.05 59.43 0.18 Allowed 'General case' 0 C--N 1.342 0.258 0 C-N-CA 126.338 1.855 . . . . 0.0 109.77 -174.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.59 167.28 27.73 Favored 'General case' 0 C--N 1.339 0.12 0 C-N-CA 124.211 1.004 . . . . 0.0 110.351 173.097 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -78.13 139.09 39.01 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 123.639 0.776 . . . . 0.0 110.181 175.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 85.2 t -137.15 121.72 24.07 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.195 0 C-N-CA 124.991 1.316 . . . . 0.0 108.599 179.246 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 6.6 m -99.27 81.62 2.58 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 107.214 -1.402 . . . . 0.0 107.214 173.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.048 0 CA-C-N 116.435 -0.348 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.092 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 9.3 m -139.89 157.67 45.32 Favored 'General case' 0 C--N 1.34 0.157 0 C-N-CA 124.079 0.952 . . . . 0.0 109.93 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 56.7 p-80 -133.41 142.78 48.52 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 124.246 1.019 . . . . 0.0 109.3 176.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.4 t-105 -77.62 113.99 16.01 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 123.167 0.587 . . . . 0.0 109.981 -179.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -89.66 99.86 12.78 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 107.436 -1.32 . . . . 0.0 107.436 171.16 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.21 -13.51 62.45 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.468 1.107 . . . . 0.0 113.698 -179.529 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 66.9 tp -66.55 -55.64 14.53 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 118.535 0.607 . . . . 0.0 109.756 179.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 58.2 t -89.45 -23.31 6.24 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 C-N-CA 124.238 1.015 . . . . 0.0 110.054 178.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 74.9 mtt85 73.48 60.23 0.09 Allowed 'General case' 0 C--N 1.341 0.237 0 C-N-CA 126.359 1.864 . . . . 0.0 109.918 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.56 162.8 39.92 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.306 1.042 . . . . 0.0 110.45 173.847 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 91.2 m95 -84.0 119.82 25.38 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.779 0.832 . . . . 0.0 109.399 174.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 86.3 t -99.52 111.67 29.77 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 N-CA-C 107.027 -1.472 . . . . 0.0 107.027 177.443 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 94.9 m -99.87 147.48 25.48 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 124.552 1.141 . . . . 0.0 110.824 -175.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.031 0 CA-C-N 116.57 -0.287 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.126 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 9.2 m -140.3 158.03 44.66 Favored 'General case' 0 C--N 1.34 0.175 0 C-N-CA 124.071 0.948 . . . . 0.0 109.891 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 55.9 p-80 -132.19 143.17 49.77 Favored 'General case' 0 N--CA 1.456 -0.138 0 C-N-CA 124.209 1.004 . . . . 0.0 109.226 175.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 74.2 t-105 -78.77 110.44 13.94 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 123.197 0.599 . . . . 0.0 110.204 -177.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -89.8 96.0 10.49 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 170.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 8.3 tt -63.02 -33.26 75.04 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.705 1.202 . . . . 0.0 111.54 178.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -52.35 -50.07 63.06 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.029 1.331 . . . . 0.0 111.116 -175.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 73.7 t -89.28 -32.13 5.62 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 C-N-CA 123.567 0.747 . . . . 0.0 109.44 174.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 38.6 ttp180 90.63 51.71 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 126.154 1.782 . . . . 0.0 109.719 177.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.83 163.75 37.89 Favored 'General case' 0 C--N 1.34 0.184 0 C-N-CA 123.49 0.716 . . . . 0.0 111.455 178.139 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 88.8 m95 -83.81 122.18 28.33 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.984 0.914 . . . . 0.0 109.321 172.294 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 93.9 t -99.84 110.93 28.08 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 175.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 99.5 m -99.8 147.57 25.34 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 124.574 1.15 . . . . 0.0 110.819 -175.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.336 0.008 0 CA-C-N 116.557 -0.292 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.228 -0.027 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 72.5 m -67.42 98.56 0.66 Allowed 'General case' 0 N--CA 1.457 -0.103 0 C-N-CA 124.664 1.185 . . . . 0.0 110.477 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 57.3 p-80 -115.92 140.32 49.36 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 124.559 1.143 . . . . 0.0 109.03 175.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 77.0 t-105 -76.26 114.7 15.24 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.04 0.536 . . . . 0.0 110.426 -177.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -89.71 105.56 17.88 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 107.694 -1.224 . . . . 0.0 107.694 170.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -81.04 10.42 5.21 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.511 1.124 . . . . 0.0 113.381 -179.333 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 71.7 mt -85.55 -52.31 5.91 Favored 'General case' 0 C--N 1.34 0.185 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 174.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 61.9 t -89.77 -22.83 6.32 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 124.523 1.129 . . . . 0.0 110.337 176.075 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.3 mpt_? 68.58 62.74 0.34 Allowed 'General case' 0 C--N 1.342 0.249 0 C-N-CA 125.939 1.696 . . . . 0.0 109.419 -173.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.66 163.09 39.37 Favored 'General case' 0 C--N 1.339 0.114 0 C-N-CA 123.786 0.835 . . . . 0.0 110.875 172.813 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 96.9 m95 -84.56 118.68 24.49 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 124.027 0.931 . . . . 0.0 109.432 175.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 87.8 t -99.6 106.39 18.97 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 N-CA-C 107.33 -1.359 . . . . 0.0 107.33 177.676 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 69.6 m -99.5 74.46 1.9 Allowed 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 124.518 1.127 . . . . 0.0 109.126 -177.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.336 -0.016 0 CA-C-N 116.151 -0.477 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 -0.025 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 72.2 m -67.36 99.27 0.71 Allowed 'General case' 0 C--N 1.34 0.153 0 C-N-CA 124.663 1.185 . . . . 0.0 110.351 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 57.3 p-80 -116.36 138.97 50.91 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 124.587 1.155 . . . . 0.0 109.024 175.219 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.7 t-105 -75.06 116.59 15.97 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.106 0.562 . . . . 0.0 110.46 -177.255 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -89.75 104.05 16.65 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 107.526 -1.287 . . . . 0.0 107.526 169.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 59.4 tp -65.82 -25.06 67.05 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.852 1.261 . . . . 0.0 112.214 -179.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 69.8 mt -61.07 -56.24 23.3 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.232 0.613 . . . . 0.0 110.749 -177.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 57.9 t -89.55 -24.5 5.88 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 C-N-CA 124.242 1.017 . . . . 0.0 110.473 179.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 71.8 mtt85 74.03 60.57 0.08 Allowed 'General case' 0 C--N 1.342 0.262 0 C-N-CA 126.225 1.81 . . . . 0.0 110.11 -179.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.62 162.19 41.13 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 124.15 0.98 . . . . 0.0 110.477 173.309 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -83.94 118.94 24.33 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.946 0.899 . . . . 0.0 109.328 174.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 98.1 t -99.53 105.44 17.49 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 N-CA-C 107.178 -1.416 . . . . 0.0 107.178 178.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 67.1 m -99.5 74.37 1.89 Allowed 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 124.476 1.111 . . . . 0.0 109.152 -176.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.051 0 CA-C-N 116.167 -0.469 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.065 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 72.4 m -68.9 96.23 0.75 Allowed 'General case' 0 N--CA 1.457 -0.108 0 C-N-CA 124.761 1.224 . . . . 0.0 110.396 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 57.1 p-80 -114.67 142.42 46.5 Favored 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 125.01 1.324 . . . . 0.0 108.516 174.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 60.4 t-105 -80.47 121.76 26.15 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 122.424 0.289 . . . . 0.0 110.28 -178.21 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -89.85 111.93 23.12 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 171.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 51.4 mt -64.92 -32.04 73.56 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.791 1.236 . . . . 0.0 112.124 179.162 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 73.1 mt -59.53 -53.48 57.63 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.515 0.726 . . . . 0.0 111.139 -173.541 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 61.6 t -89.47 -24.78 5.81 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 C-N-CA 123.999 0.92 . . . . 0.0 110.364 178.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 86.6 mtm180 73.92 58.08 0.09 Allowed 'General case' 0 C--N 1.344 0.332 0 C-N-CA 126.078 1.751 . . . . 0.0 109.707 -179.042 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.84 167.51 27.27 Favored 'General case' 0 C--N 1.339 0.138 0 C-N-CA 124.009 0.924 . . . . 0.0 110.871 175.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -75.38 142.32 43.12 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 123.239 0.616 . . . . 0.0 109.838 170.203 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 79.4 t -127.92 105.6 13.72 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 N-CA-C 106.947 -1.501 . . . . 0.0 106.947 175.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 68.7 m -99.59 75.59 1.95 Allowed 'General case' 0 N--CA 1.457 -0.12 0 C-N-CA 124.527 1.131 . . . . 0.0 109.079 -176.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.058 0 CA-C-N 116.251 -0.432 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.083 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 9.0 m -140.08 157.6 45.38 Favored 'General case' 0 C--N 1.34 0.162 0 C-N-CA 124.08 0.952 . . . . 0.0 109.95 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 57.2 p-80 -132.75 142.23 48.92 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 124.253 1.021 . . . . 0.0 109.217 176.413 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.5 t-105 -77.19 115.28 16.84 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 123.124 0.57 . . . . 0.0 110.106 -179.092 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -89.65 103.11 15.79 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 170.301 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 60.1 tp -65.59 -29.05 69.6 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.925 1.29 . . . . 0.0 112.045 -179.342 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -57.39 -53.07 62.27 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.607 0.763 . . . . 0.0 110.705 -176.721 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 59.1 t -89.39 -26.25 5.48 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 C-N-CA 123.879 0.872 . . . . 0.0 110.407 177.75 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 74.03 60.15 0.08 Allowed 'General case' 0 C--N 1.342 0.244 0 C-N-CA 126.36 1.864 . . . . 0.0 110.069 -175.75 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.61 162.58 40.37 Favored 'General case' 0 C--O 1.231 0.128 0 C-N-CA 123.696 0.798 . . . . 0.0 110.771 173.064 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 92.1 m95 -83.89 120.42 26.05 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 123.735 0.814 . . . . 0.0 109.371 174.292 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 84.8 t -99.51 111.18 28.42 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 N-CA-C 106.933 -1.506 . . . . 0.0 106.933 176.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 92.7 m -99.82 147.56 25.36 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 124.608 1.163 . . . . 0.0 110.921 -174.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.068 0 CA-C-N 116.651 -0.25 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.048 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 18.8 m -78.43 151.48 32.68 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 123.105 0.562 . . . . 0.0 109.644 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 51.1 p-80 -121.23 137.66 54.58 Favored 'General case' 0 N--CA 1.457 -0.094 0 C-N-CA 124.271 1.028 . . . . 0.0 109.655 -179.648 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 75.8 t-105 -75.75 116.64 16.66 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.233 0.613 . . . . 0.0 110.353 -177.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -89.72 105.76 18.01 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 169.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 60.5 tp -67.97 -29.52 68.59 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.72 1.208 . . . . 0.0 112.103 -177.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -58.21 -51.84 68.06 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.541 0.736 . . . . 0.0 110.618 -176.175 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 81.1 t -89.69 -26.28 5.42 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 C-N-CA 124.303 1.041 . . . . 0.0 110.511 177.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 76.4 mtp180 75.1 59.79 0.06 Allowed 'General case' 0 C--N 1.341 0.219 0 C-N-CA 125.88 1.672 . . . . 0.0 110.491 -178.214 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -151.03 167.78 26.59 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 123.821 0.848 . . . . 0.0 110.693 174.124 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 96.5 m95 -86.77 120.33 27.96 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.96 0.904 . . . . 0.0 109.242 173.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 94.9 t -99.68 113.45 34.99 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 N-CA-C 107.139 -1.43 . . . . 0.0 107.139 176.108 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 75.4 m -99.81 153.16 19.35 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.576 1.15 . . . . 0.0 110.025 -177.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.336 -0.02 0 O-C-N 122.273 -0.267 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 0.023 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 72.1 m -70.61 90.97 0.77 Allowed 'General case' 0 C--N 1.339 0.135 0 C-N-CA 124.989 1.316 . . . . 0.0 110.34 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 53.9 p-80 -108.9 148.62 30.37 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 124.868 1.267 . . . . 0.0 109.391 177.022 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 73.1 t-105 -80.7 110.69 16.44 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 123.167 0.587 . . . . 0.0 109.977 -179.605 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -89.62 91.98 8.89 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 171.574 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -61.52 -27.05 68.33 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.514 1.126 . . . . 0.0 113.126 177.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 65.3 tp -55.55 -52.95 62.0 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 124.739 1.216 . . . . 0.0 111.035 -177.22 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 58.3 t -89.16 -25.33 5.73 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 C-N-CA 123.617 0.767 . . . . 0.0 109.417 174.651 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 27.0 ttm180 83.37 52.46 0.01 OUTLIER 'General case' 0 C--N 1.342 0.243 0 C-N-CA 126.462 1.905 . . . . 0.0 109.822 175.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.76 166.89 29.06 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 124.34 1.056 . . . . 0.0 110.636 177.249 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 96.6 m95 -80.98 142.51 33.37 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 123.321 0.648 . . . . 0.0 109.654 171.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 97.8 t -130.18 112.03 22.55 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.245 0 N-CA-C 107.422 -1.325 . . . . 0.0 107.422 178.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 83.1 m -99.56 81.93 2.57 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 124.592 1.157 . . . . 0.0 109.097 -178.614 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.037 0 CA-C-N 116.213 -0.449 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.129 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 10.0 m -140.55 158.03 44.6 Favored 'General case' 0 C--N 1.34 0.163 0 C-N-CA 124.015 0.926 . . . . 0.0 109.98 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 56.5 p-80 -133.54 144.6 49.46 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 124.346 1.058 . . . . 0.0 108.855 174.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 75.1 t-105 -74.22 141.51 45.42 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 122.51 0.324 . . . . 0.0 110.626 -179.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -125.67 105.92 9.35 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 124.846 1.259 . . . . 0.0 107.723 170.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -67.24 -37.83 84.2 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.87 1.268 . . . . 0.0 110.806 178.125 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 65.6 mt -47.53 -49.16 26.93 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 125.372 1.469 . . . . 0.0 111.82 -173.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.647 ' O ' ' CB ' ' A' ' 30' ' ' ARG . 82.7 t -89.42 -45.9 15.28 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 171.402 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.647 ' CB ' ' O ' ' A' ' 29' ' ' VAL . 64.7 ttt180 103.41 52.4 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 177.4 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.91 166.85 29.36 Favored 'General case' 0 C--N 1.339 0.138 0 C-N-CA 124.211 1.004 . . . . 0.0 111.012 -179.933 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 87.4 m95 -86.66 125.19 33.69 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.939 0.896 . . . . 0.0 109.212 171.195 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 97.2 t -99.69 109.03 23.77 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 177.222 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 95.6 m -99.88 147.62 25.34 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 124.427 1.091 . . . . 0.0 110.752 -175.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.336 -0.01 0 CA-C-N 116.579 -0.282 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.092 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 73.1 m -71.83 88.51 1.02 Allowed 'General case' 0 C--N 1.34 0.161 0 C-N-CA 125.15 1.38 . . . . 0.0 110.288 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 53.3 p-80 -106.87 150.04 26.8 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 124.944 1.297 . . . . 0.0 109.3 177.108 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.0 t-105 -79.15 115.16 18.64 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 178.082 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -89.59 97.97 11.5 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 171.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.7 pp -68.47 -20.47 64.62 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.521 1.128 . . . . 0.0 113.043 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 66.2 tp -60.72 -54.2 48.13 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.525 0.73 . . . . 0.0 110.339 -178.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 85.6 t -89.46 -28.64 5.12 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 C-N-CA 123.967 0.907 . . . . 0.0 109.938 177.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 63.6 mtm180 84.88 55.93 0.01 OUTLIER 'General case' 0 C--N 1.343 0.295 0 C-N-CA 127.567 2.347 . . . . 0.0 110.004 176.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -151.01 173.63 14.09 Favored 'General case' 0 N--CA 1.457 -0.076 0 C-N-CA 124.368 1.067 . . . . 0.0 110.117 176.388 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -85.5 140.57 30.56 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 123.462 0.705 . . . . 0.0 109.557 172.099 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 84.2 t -129.66 114.01 29.22 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 C-N-CA 125.213 1.405 . . . . 0.0 107.36 178.5 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 80.9 m -99.56 85.92 3.24 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.611 1.165 . . . . 0.0 109.225 -178.179 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.336 -0.011 0 CA-C-N 116.223 -0.444 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.034 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 73.0 m -76.5 154.68 34.42 Favored 'General case' 0 CA--C 1.528 0.119 0 C-N-CA 123.218 0.607 . . . . 0.0 110.368 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 28.5 p-80 -99.92 150.18 22.66 Favored 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 124.3 1.04 . . . . 0.0 108.857 172.112 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 74.1 t-105 -79.92 113.8 18.36 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 178.403 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -89.59 96.58 10.76 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 107.432 -1.321 . . . . 0.0 107.432 171.624 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.14 -12.59 61.17 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.437 1.095 . . . . 0.0 113.545 178.624 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.8 tt -63.69 -57.66 9.33 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 179.493 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 57.7 t -89.24 -23.62 6.19 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 C-N-CA 124.131 0.972 . . . . 0.0 110.086 177.282 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 87.2 mtt-85 73.51 60.16 0.09 Allowed 'General case' 0 C--N 1.341 0.209 0 C-N-CA 126.306 1.842 . . . . 0.0 110.071 -176.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.6 165.83 32.12 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.468 1.107 . . . . 0.0 109.958 172.464 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -83.44 137.3 33.97 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 123.762 0.825 . . . . 0.0 109.783 176.124 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 86.9 t -134.8 123.24 40.77 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.19 0 C-N-CA 124.951 1.3 . . . . 0.0 108.744 -176.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 7.4 m -99.24 81.34 2.54 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 107.243 -1.392 . . . . 0.0 107.243 173.195 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.336 -0.003 0 CA-C-N 116.455 -0.339 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 0.005 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 71.6 m -67.73 98.55 0.72 Allowed 'General case' 0 C--N 1.34 0.165 0 C-N-CA 124.7 1.2 . . . . 0.0 110.42 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 57.3 p-80 -115.71 139.31 50.27 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 124.727 1.211 . . . . 0.0 108.737 174.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 73.7 t-105 -76.32 116.63 17.18 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 122.748 0.419 . . . . 0.0 110.542 -176.676 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -89.84 108.57 19.78 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 169.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -79.92 0.84 29.66 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.182 0.993 . . . . 0.0 113.647 -178.521 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 74.0 mt -77.73 -55.5 5.29 Favored 'General case' 0 C--N 1.34 0.183 0 N-CA-C 108.744 -0.835 . . . . 0.0 108.744 175.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 87.2 t -89.61 -17.75 8.0 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 125.134 1.374 . . . . 0.0 110.535 178.005 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 65.95 60.8 0.66 Allowed 'General case' 0 C--N 1.343 0.322 0 C-N-CA 125.626 1.571 . . . . 0.0 110.385 178.929 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -151.0 170.36 19.55 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.607 1.163 . . . . 0.0 110.413 175.041 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 98.0 m95 -87.17 120.82 28.85 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 124.033 0.933 . . . . 0.0 109.398 173.672 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 94.3 t -99.75 105.2 17.15 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 175.256 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 69.0 m -99.6 74.62 1.89 Allowed 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 124.504 1.122 . . . . 0.0 109.107 -177.283 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.037 0 CA-C-N 116.221 -0.445 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 -0.012 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 72.5 m -67.7 97.25 0.61 Allowed 'General case' 0 C--N 1.339 0.139 0 C-N-CA 124.779 1.231 . . . . 0.0 110.462 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 57.1 p-80 -114.77 141.85 47.31 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 124.659 1.183 . . . . 0.0 108.952 175.598 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 74.6 t-105 -76.95 110.26 11.44 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 123.007 0.523 . . . . 0.0 110.41 -177.148 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -89.6 97.87 11.44 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 107.076 -1.454 . . . . 0.0 107.076 169.598 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 8.3 tt -65.41 -33.28 75.57 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.606 1.162 . . . . 0.0 111.322 178.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -50.15 -49.33 52.5 Favored 'General case' 0 C--N 1.342 0.242 0 C-N-CA 125.307 1.443 . . . . 0.0 111.238 -175.216 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.665 ' O ' ' CB ' ' A' ' 30' ' ' ARG . 90.3 t -89.22 -45.62 15.38 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 171.909 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.665 ' CB ' ' O ' ' A' ' 29' ' ' VAL . 62.3 ttt180 106.57 52.08 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 123.372 0.669 . . . . 0.0 109.244 175.433 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.98 162.52 40.67 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 123.959 0.903 . . . . 0.0 111.242 179.783 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 96.1 m95 -83.09 118.13 23.34 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 124.011 0.924 . . . . 0.0 109.331 173.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 89.1 t -99.77 108.09 22.03 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.248 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 177.728 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 77.4 m -99.56 75.69 1.96 Allowed 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 124.537 1.135 . . . . 0.0 109.023 -178.054 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.03 0 CA-C-N 116.201 -0.454 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 0.015 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 72.3 m -68.93 94.13 0.61 Allowed 'General case' 0 C--N 1.338 0.101 0 C-N-CA 124.898 1.279 . . . . 0.0 110.317 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 54.6 p-80 -112.36 144.45 41.77 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 124.755 1.222 . . . . 0.0 109.236 176.535 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.8 t-105 -75.35 115.17 14.72 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 179.701 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -89.42 102.23 14.9 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 170.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 61.6 tp -64.13 -34.03 77.14 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.821 1.249 . . . . 0.0 111.964 -177.302 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 65.2 tp -53.46 -54.79 31.87 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.04 0.936 . . . . 0.0 111.357 -177.01 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 88.2 t -89.85 -25.59 5.54 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 C-N-CA 124.087 0.955 . . . . 0.0 110.654 179.087 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 68.2 mtp85 74.72 60.45 0.07 Allowed 'General case' 0 C--N 1.341 0.198 0 C-N-CA 125.968 1.707 . . . . 0.0 110.668 -177.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -151.11 166.4 30.92 Favored 'General case' 0 N--CA 1.457 -0.108 0 C-N-CA 123.747 0.819 . . . . 0.0 110.615 173.04 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 96.9 m95 -87.4 114.67 24.22 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 124.048 0.939 . . . . 0.0 109.246 175.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 92.2 t -99.66 110.76 27.54 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 178.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 71.4 m -99.58 76.62 2.02 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 124.585 1.154 . . . . 0.0 109.069 -177.667 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.056 0 CA-C-N 116.144 -0.48 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 55.4 p-80 . . . . . 0 N--CA 1.455 -0.211 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.5 t-105 -75.96 112.47 12.42 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 122.77 0.428 . . . . 0.0 110.179 -179.145 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -89.64 98.31 11.69 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 170.014 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -67.62 -15.85 63.86 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.492 1.117 . . . . 0.0 113.487 178.945 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 57.9 mt -64.73 -52.44 57.07 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 118.522 0.601 . . . . 0.0 110.001 -178.76 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 76.3 t -89.48 -31.79 5.47 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 C-N-CA 124.306 1.042 . . . . 0.0 109.664 176.833 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 66.5 mtm180 85.86 58.17 0.01 OUTLIER 'General case' 0 C--N 1.344 0.331 0 C-N-CA 127.821 2.448 . . . . 0.0 109.854 178.22 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -151.0 167.29 28.07 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 124.093 0.957 . . . . 0.0 110.843 176.302 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 96.6 m95 -87.4 116.22 25.35 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 124.073 0.949 . . . . 0.0 109.242 174.711 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 94.1 t . . . . . 0 N--CA 1.453 -0.322 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 178.553 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 57.3 p-80 . . . . . 0 N--CA 1.455 -0.18 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 77.0 t-105 -75.91 117.93 18.16 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 122.967 0.507 . . . . 0.0 110.235 -177.353 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -89.66 110.22 21.12 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 173.106 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 41.6 mt -61.78 -37.33 83.94 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.915 1.286 . . . . 0.0 112.02 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 64.8 tp -54.83 -55.2 32.82 Favored 'General case' 0 C--N 1.341 0.235 0 C-N-CA 123.962 0.905 . . . . 0.0 111.523 -174.19 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 57.5 t -89.71 -28.03 5.14 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 C-N-CA 123.899 0.88 . . . . 0.0 110.557 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 75.0 mtp180 74.13 60.69 0.08 Allowed 'General case' 0 C--N 1.34 0.175 0 C-N-CA 125.414 1.486 . . . . 0.0 109.955 -174.749 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.7 162.96 39.69 Favored 'General case' 0 CA--C 1.528 0.114 0 C-N-CA 123.708 0.803 . . . . 0.0 110.774 173.531 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -82.19 118.34 23.01 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.946 0.898 . . . . 0.0 109.583 175.028 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 90.5 t . . . . . 0 N--CA 1.453 -0.306 0 N-CA-C 107.174 -1.417 . . . . 0.0 107.174 176.902 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 29.1 p-80 . . . . . 0 N--CA 1.455 -0.177 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 74.0 t-105 -79.44 114.45 18.38 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 178.33 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -89.54 97.82 11.41 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 107.289 -1.375 . . . . 0.0 107.289 170.904 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 6.6 tt -67.79 -23.0 65.16 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.738 1.215 . . . . 0.0 112.225 -178.768 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 9.5 mp -57.6 -55.52 33.79 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.568 0.747 . . . . 0.0 110.046 -178.98 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 60.5 t -89.53 -25.58 5.6 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 124.112 0.965 . . . . 0.0 110.339 178.058 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 71.6 mtt85 75.75 58.92 0.05 Allowed 'General case' 0 C--N 1.343 0.283 0 C-N-CA 126.577 1.951 . . . . 0.0 109.942 -177.601 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.6 165.12 34.31 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 124.305 1.042 . . . . 0.0 110.172 172.773 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -83.5 137.43 33.88 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 123.828 0.851 . . . . 0.0 109.801 175.769 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 90.8 t . . . . . 0 N--CA 1.455 -0.182 0 C-N-CA 124.954 1.302 . . . . 0.0 108.791 -176.963 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 32.2 p-80 . . . . . 0 N--CA 1.457 -0.09 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.5 t-105 -79.64 114.88 18.9 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 178.428 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -89.62 97.63 11.3 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 170.822 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 63.9 tp -63.6 -28.91 70.25 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 125.116 1.367 . . . . 0.0 111.814 178.578 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 66.6 mt -54.06 -51.92 62.56 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.099 0.96 . . . . 0.0 111.237 -176.687 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 76.9 t -89.52 -34.31 6.67 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 C-N-CA 123.732 0.813 . . . . 0.0 109.811 175.993 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 72.6 mtm180 87.63 56.28 0.01 OUTLIER 'General case' 0 C--N 1.343 0.307 0 C-N-CA 128.041 2.536 . . . . 0.0 109.307 -176.943 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.75 165.79 32.42 Favored 'General case' 0 C--N 1.34 0.171 0 C-N-CA 123.707 0.803 . . . . 0.0 110.752 175.438 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -80.6 139.81 36.07 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 123.693 0.797 . . . . 0.0 109.912 174.518 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 91.3 t . . . . . 0 N--CA 1.454 -0.227 0 C-N-CA 124.93 1.292 . . . . 0.0 108.597 -178.935 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 56.9 p-80 . . . . . 0 N--CA 1.455 -0.185 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.9 t-105 -74.24 121.85 21.91 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 123.165 0.586 . . . . 0.0 110.493 -177.179 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -91.87 115.79 28.36 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 170.315 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 7.0 mp -69.54 -29.21 66.76 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.283 1.033 . . . . 0.0 111.674 -177.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 75.1 mt -63.65 -56.4 16.05 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.356 0.662 . . . . 0.0 110.861 -174.112 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 59.8 t -89.6 -22.42 6.48 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 124.09 0.956 . . . . 0.0 110.519 -178.827 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 75.3 mtt85 70.8 59.91 0.2 Allowed 'General case' 0 C--N 1.341 0.228 0 C-N-CA 125.273 1.429 . . . . 0.0 110.018 179.43 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.59 163.31 38.79 Favored 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 124.248 1.019 . . . . 0.0 110.459 174.665 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 97.3 m95 -84.02 119.98 25.59 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 123.979 0.912 . . . . 0.0 109.4 174.843 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 88.8 t . . . . . 0 N--CA 1.453 -0.281 0 N-CA-C 106.977 -1.49 . . . . 0.0 106.977 178.439 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 30.0 p-80 . . . . . 0 N--CA 1.456 -0.166 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.5 t-105 -81.23 117.4 21.72 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 178.652 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -89.53 107.53 19.13 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 176.653 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 44.2 mt -67.86 -22.94 65.1 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.081 1.352 . . . . 0.0 112.573 -179.216 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 9.6 mp -63.66 -43.06 97.85 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.292 0.637 . . . . 0.0 110.826 -176.086 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 60.5 t -106.12 -23.36 4.48 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 C-N-CA 124.855 1.262 . . . . 0.0 111.096 -179.931 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 13.5 mtm-85 71.05 59.43 0.18 Allowed 'General case' 0 C--N 1.342 0.258 0 C-N-CA 126.338 1.855 . . . . 0.0 109.77 -174.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.59 167.28 27.73 Favored 'General case' 0 C--N 1.339 0.12 0 C-N-CA 124.211 1.004 . . . . 0.0 110.351 173.097 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -78.13 139.09 39.01 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 123.639 0.776 . . . . 0.0 110.181 175.302 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 85.2 t . . . . . 0 N--CA 1.455 -0.195 0 C-N-CA 124.991 1.316 . . . . 0.0 108.599 179.246 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 56.7 p-80 . . . . . 0 N--CA 1.455 -0.182 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.4 t-105 -77.62 113.99 16.01 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 123.167 0.587 . . . . 0.0 109.981 -179.456 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -89.66 99.86 12.78 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 107.436 -1.32 . . . . 0.0 107.436 171.16 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.21 -13.51 62.45 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.468 1.107 . . . . 0.0 113.698 -179.529 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 66.9 tp -66.55 -55.64 14.53 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 118.535 0.607 . . . . 0.0 109.756 179.315 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 58.2 t -89.45 -23.31 6.24 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 C-N-CA 124.238 1.015 . . . . 0.0 110.054 178.173 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 74.9 mtt85 73.48 60.23 0.09 Allowed 'General case' 0 C--N 1.341 0.237 0 C-N-CA 126.359 1.864 . . . . 0.0 109.918 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.56 162.8 39.92 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.306 1.042 . . . . 0.0 110.45 173.847 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 91.2 m95 -84.0 119.82 25.38 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.779 0.832 . . . . 0.0 109.399 174.39 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 86.3 t . . . . . 0 N--CA 1.453 -0.303 0 N-CA-C 107.027 -1.472 . . . . 0.0 107.027 177.443 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 55.9 p-80 . . . . . 0 N--CA 1.456 -0.138 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 74.2 t-105 -78.77 110.44 13.94 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 123.197 0.599 . . . . 0.0 110.204 -177.673 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -89.8 96.0 10.49 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 170.053 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 8.3 tt -63.02 -33.26 75.04 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.705 1.202 . . . . 0.0 111.54 178.744 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -52.35 -50.07 63.06 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.029 1.331 . . . . 0.0 111.116 -175.479 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 73.7 t -89.28 -32.13 5.62 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 C-N-CA 123.567 0.747 . . . . 0.0 109.44 174.982 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 38.6 ttp180 90.63 51.71 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 126.154 1.782 . . . . 0.0 109.719 177.633 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.83 163.75 37.89 Favored 'General case' 0 C--N 1.34 0.184 0 C-N-CA 123.49 0.716 . . . . 0.0 111.455 178.139 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 88.8 m95 -83.81 122.18 28.33 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.984 0.914 . . . . 0.0 109.321 172.294 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 93.9 t . . . . . 0 N--CA 1.453 -0.287 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 175.735 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 57.3 p-80 . . . . . 0 N--CA 1.455 -0.188 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 77.0 t-105 -76.26 114.7 15.24 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.04 0.536 . . . . 0.0 110.426 -177.001 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -89.71 105.56 17.88 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 107.694 -1.224 . . . . 0.0 107.694 170.872 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -81.04 10.42 5.21 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.511 1.124 . . . . 0.0 113.381 -179.333 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 71.7 mt -85.55 -52.31 5.91 Favored 'General case' 0 C--N 1.34 0.185 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 174.463 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 61.9 t -89.77 -22.83 6.32 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 124.523 1.129 . . . . 0.0 110.337 176.075 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.3 mpt_? 68.58 62.74 0.34 Allowed 'General case' 0 C--N 1.342 0.249 0 C-N-CA 125.939 1.696 . . . . 0.0 109.419 -173.476 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.66 163.09 39.37 Favored 'General case' 0 C--N 1.339 0.114 0 C-N-CA 123.786 0.835 . . . . 0.0 110.875 172.813 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 96.9 m95 -84.56 118.68 24.49 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 124.027 0.931 . . . . 0.0 109.432 175.342 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 87.8 t . . . . . 0 N--CA 1.454 -0.274 0 N-CA-C 107.33 -1.359 . . . . 0.0 107.33 177.676 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 57.3 p-80 . . . . . 0 N--CA 1.455 -0.184 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.7 t-105 -75.06 116.59 15.97 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.106 0.562 . . . . 0.0 110.46 -177.255 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -89.75 104.05 16.65 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 107.526 -1.287 . . . . 0.0 107.526 169.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 59.4 tp -65.82 -25.06 67.05 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.852 1.261 . . . . 0.0 112.214 -179.366 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 69.8 mt -61.07 -56.24 23.3 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.232 0.613 . . . . 0.0 110.749 -177.435 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 57.9 t -89.55 -24.5 5.88 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 C-N-CA 124.242 1.017 . . . . 0.0 110.473 179.653 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 71.8 mtt85 74.03 60.57 0.08 Allowed 'General case' 0 C--N 1.342 0.262 0 C-N-CA 126.225 1.81 . . . . 0.0 110.11 -179.627 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.62 162.19 41.13 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 124.15 0.98 . . . . 0.0 110.477 173.309 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -83.94 118.94 24.33 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.946 0.899 . . . . 0.0 109.328 174.834 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 98.1 t . . . . . 0 N--CA 1.452 -0.366 0 N-CA-C 107.178 -1.416 . . . . 0.0 107.178 178.838 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 57.1 p-80 . . . . . 0 N--CA 1.456 -0.175 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 60.4 t-105 -80.47 121.76 26.15 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 122.424 0.289 . . . . 0.0 110.28 -178.21 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -89.85 111.93 23.12 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 171.759 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 51.4 mt -64.92 -32.04 73.56 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.791 1.236 . . . . 0.0 112.124 179.162 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 73.1 mt -59.53 -53.48 57.63 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.515 0.726 . . . . 0.0 111.139 -173.541 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 61.6 t -89.47 -24.78 5.81 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 C-N-CA 123.999 0.92 . . . . 0.0 110.364 178.372 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 86.6 mtm180 73.92 58.08 0.09 Allowed 'General case' 0 C--N 1.344 0.332 0 C-N-CA 126.078 1.751 . . . . 0.0 109.707 -179.042 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.84 167.51 27.27 Favored 'General case' 0 C--N 1.339 0.138 0 C-N-CA 124.009 0.924 . . . . 0.0 110.871 175.875 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -75.38 142.32 43.12 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 123.239 0.616 . . . . 0.0 109.838 170.203 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 79.4 t . . . . . 0 N--CA 1.453 -0.294 0 N-CA-C 106.947 -1.501 . . . . 0.0 106.947 175.585 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 57.2 p-80 . . . . . 0 N--CA 1.455 -0.179 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.5 t-105 -77.19 115.28 16.84 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 123.124 0.57 . . . . 0.0 110.106 -179.092 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -89.65 103.11 15.79 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 170.301 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 60.1 tp -65.59 -29.05 69.6 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.925 1.29 . . . . 0.0 112.045 -179.342 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -57.39 -53.07 62.27 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.607 0.763 . . . . 0.0 110.705 -176.721 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 59.1 t -89.39 -26.25 5.48 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 C-N-CA 123.879 0.872 . . . . 0.0 110.407 177.75 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 74.03 60.15 0.08 Allowed 'General case' 0 C--N 1.342 0.244 0 C-N-CA 126.36 1.864 . . . . 0.0 110.069 -175.75 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.61 162.58 40.37 Favored 'General case' 0 C--O 1.231 0.128 0 C-N-CA 123.696 0.798 . . . . 0.0 110.771 173.064 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 92.1 m95 -83.89 120.42 26.05 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 123.735 0.814 . . . . 0.0 109.371 174.292 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 84.8 t . . . . . 0 N--CA 1.453 -0.32 0 N-CA-C 106.933 -1.506 . . . . 0.0 106.933 176.999 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 51.1 p-80 . . . . . 0 N--CA 1.457 -0.094 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 75.8 t-105 -75.75 116.64 16.66 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.233 0.613 . . . . 0.0 110.353 -177.801 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -89.72 105.76 18.01 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 169.958 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 60.5 tp -67.97 -29.52 68.59 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.72 1.208 . . . . 0.0 112.103 -177.955 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -58.21 -51.84 68.06 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.541 0.736 . . . . 0.0 110.618 -176.175 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 81.1 t -89.69 -26.28 5.42 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 C-N-CA 124.303 1.041 . . . . 0.0 110.511 177.77 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 76.4 mtp180 75.1 59.79 0.06 Allowed 'General case' 0 C--N 1.341 0.219 0 C-N-CA 125.88 1.672 . . . . 0.0 110.491 -178.214 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -151.03 167.78 26.59 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 123.821 0.848 . . . . 0.0 110.693 174.124 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 96.5 m95 -86.77 120.33 27.96 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.96 0.904 . . . . 0.0 109.242 173.863 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 94.9 t . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 107.139 -1.43 . . . . 0.0 107.139 176.108 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 53.9 p-80 . . . . . 0 N--CA 1.455 -0.187 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 73.1 t-105 -80.7 110.69 16.44 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 123.167 0.587 . . . . 0.0 109.977 -179.605 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -89.62 91.98 8.89 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 171.574 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -61.52 -27.05 68.33 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.514 1.126 . . . . 0.0 113.126 177.641 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 65.3 tp -55.55 -52.95 62.0 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 124.739 1.216 . . . . 0.0 111.035 -177.22 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 58.3 t -89.16 -25.33 5.73 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 C-N-CA 123.617 0.767 . . . . 0.0 109.417 174.651 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 27.0 ttm180 83.37 52.46 0.01 OUTLIER 'General case' 0 C--N 1.342 0.243 0 C-N-CA 126.462 1.905 . . . . 0.0 109.822 175.894 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.76 166.89 29.06 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 124.34 1.056 . . . . 0.0 110.636 177.249 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 96.6 m95 -80.98 142.51 33.37 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 123.321 0.648 . . . . 0.0 109.654 171.896 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 97.8 t . . . . . 0 N--CA 1.454 -0.245 0 N-CA-C 107.422 -1.325 . . . . 0.0 107.422 178.926 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 56.5 p-80 . . . . . 0 N--CA 1.456 -0.164 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 75.1 t-105 -74.22 141.51 45.42 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 122.51 0.324 . . . . 0.0 110.626 -179.121 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -125.67 105.92 9.35 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 124.846 1.259 . . . . 0.0 107.723 170.503 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -67.24 -37.83 84.2 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.87 1.268 . . . . 0.0 110.806 178.125 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 65.6 mt -47.53 -49.16 26.93 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 125.372 1.469 . . . . 0.0 111.82 -173.741 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.647 ' O ' ' CB ' ' A' ' 30' ' ' ARG . 82.7 t -89.42 -45.9 15.28 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 171.402 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.647 ' CB ' ' O ' ' A' ' 29' ' ' VAL . 64.7 ttt180 103.41 52.4 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 177.4 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.91 166.85 29.36 Favored 'General case' 0 C--N 1.339 0.138 0 C-N-CA 124.211 1.004 . . . . 0.0 111.012 -179.933 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 87.4 m95 -86.66 125.19 33.69 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.939 0.896 . . . . 0.0 109.212 171.195 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 97.2 t . . . . . 0 N--CA 1.453 -0.293 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 177.222 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 53.3 p-80 . . . . . 0 N--CA 1.454 -0.264 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.0 t-105 -79.15 115.16 18.64 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 178.082 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -89.59 97.97 11.5 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 171.688 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.7 pp -68.47 -20.47 64.62 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.521 1.128 . . . . 0.0 113.043 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 66.2 tp -60.72 -54.2 48.13 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.525 0.73 . . . . 0.0 110.339 -178.952 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 85.6 t -89.46 -28.64 5.12 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 C-N-CA 123.967 0.907 . . . . 0.0 109.938 177.896 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 63.6 mtm180 84.88 55.93 0.01 OUTLIER 'General case' 0 C--N 1.343 0.295 0 C-N-CA 127.567 2.347 . . . . 0.0 110.004 176.586 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -151.01 173.63 14.09 Favored 'General case' 0 N--CA 1.457 -0.076 0 C-N-CA 124.368 1.067 . . . . 0.0 110.117 176.388 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -85.5 140.57 30.56 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 123.462 0.705 . . . . 0.0 109.557 172.099 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 84.2 t . . . . . 0 N--CA 1.454 -0.257 0 C-N-CA 125.213 1.405 . . . . 0.0 107.36 178.5 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 28.5 p-80 . . . . . 0 N--CA 1.456 -0.14 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 74.1 t-105 -79.92 113.8 18.36 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 178.403 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -89.59 96.58 10.76 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 107.432 -1.321 . . . . 0.0 107.432 171.624 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.14 -12.59 61.17 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.437 1.095 . . . . 0.0 113.545 178.624 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.8 tt -63.69 -57.66 9.33 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 179.493 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 57.7 t -89.24 -23.62 6.19 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 C-N-CA 124.131 0.972 . . . . 0.0 110.086 177.282 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 87.2 mtt-85 73.51 60.16 0.09 Allowed 'General case' 0 C--N 1.341 0.209 0 C-N-CA 126.306 1.842 . . . . 0.0 110.071 -176.73 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.6 165.83 32.12 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.468 1.107 . . . . 0.0 109.958 172.464 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -83.44 137.3 33.97 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 123.762 0.825 . . . . 0.0 109.783 176.124 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 86.9 t . . . . . 0 N--CA 1.455 -0.19 0 C-N-CA 124.951 1.3 . . . . 0.0 108.744 -176.96 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 57.3 p-80 . . . . . 0 N--CA 1.455 -0.211 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 73.7 t-105 -76.32 116.63 17.18 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 122.748 0.419 . . . . 0.0 110.542 -176.676 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -89.84 108.57 19.78 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 169.962 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -79.92 0.84 29.66 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.182 0.993 . . . . 0.0 113.647 -178.521 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 74.0 mt -77.73 -55.5 5.29 Favored 'General case' 0 C--N 1.34 0.183 0 N-CA-C 108.744 -0.835 . . . . 0.0 108.744 175.755 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 87.2 t -89.61 -17.75 8.0 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 125.134 1.374 . . . . 0.0 110.535 178.005 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 65.95 60.8 0.66 Allowed 'General case' 0 C--N 1.343 0.322 0 C-N-CA 125.626 1.571 . . . . 0.0 110.385 178.929 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -151.0 170.36 19.55 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.607 1.163 . . . . 0.0 110.413 175.041 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 98.0 m95 -87.17 120.82 28.85 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 124.033 0.933 . . . . 0.0 109.398 173.672 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 94.3 t . . . . . 0 N--CA 1.453 -0.292 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 175.256 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 57.1 p-80 . . . . . 0 N--CA 1.456 -0.154 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 74.6 t-105 -76.95 110.26 11.44 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 123.007 0.523 . . . . 0.0 110.41 -177.148 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -89.6 97.87 11.44 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 107.076 -1.454 . . . . 0.0 107.076 169.598 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 8.3 tt -65.41 -33.28 75.57 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.606 1.162 . . . . 0.0 111.322 178.908 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -50.15 -49.33 52.5 Favored 'General case' 0 C--N 1.342 0.242 0 C-N-CA 125.307 1.443 . . . . 0.0 111.238 -175.216 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.665 ' O ' ' CB ' ' A' ' 30' ' ' ARG . 90.3 t -89.22 -45.62 15.38 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 171.909 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.665 ' CB ' ' O ' ' A' ' 29' ' ' VAL . 62.3 ttt180 106.57 52.08 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 123.372 0.669 . . . . 0.0 109.244 175.433 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.98 162.52 40.67 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 123.959 0.903 . . . . 0.0 111.242 179.783 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 96.1 m95 -83.09 118.13 23.34 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 124.011 0.924 . . . . 0.0 109.331 173.579 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 89.1 t . . . . . 0 N--CA 1.454 -0.248 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 177.728 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 54.6 p-80 . . . . . 0 N--CA 1.454 -0.264 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.8 t-105 -75.35 115.17 14.72 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 179.701 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -89.42 102.23 14.9 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 170.792 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 61.6 tp -64.13 -34.03 77.14 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.821 1.249 . . . . 0.0 111.964 -177.302 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 65.2 tp -53.46 -54.79 31.87 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.04 0.936 . . . . 0.0 111.357 -177.01 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 88.2 t -89.85 -25.59 5.54 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 C-N-CA 124.087 0.955 . . . . 0.0 110.654 179.087 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 68.2 mtp85 74.72 60.45 0.07 Allowed 'General case' 0 C--N 1.341 0.198 0 C-N-CA 125.968 1.707 . . . . 0.0 110.668 -177.795 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -151.11 166.4 30.92 Favored 'General case' 0 N--CA 1.457 -0.108 0 C-N-CA 123.747 0.819 . . . . 0.0 110.615 173.04 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 96.9 m95 -87.4 114.67 24.22 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 124.048 0.939 . . . . 0.0 109.246 175.576 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 92.2 t . . . . . 0 N--CA 1.453 -0.303 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 178.98 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.075 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 72.5 m -68.32 95.72 0.62 Allowed 'General case' 0 C--N 1.339 0.122 0 C-N-CA 124.819 1.248 . . . . 0.0 110.392 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 55.4 p-80 -113.65 143.1 45.16 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 124.728 1.211 . . . . 0.0 109.14 176.076 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.5 t-105 -75.96 112.47 12.42 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 122.77 0.428 . . . . 0.0 110.179 -179.145 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -89.64 98.31 11.69 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 170.014 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -67.62 -15.85 63.86 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.492 1.117 . . . . 0.0 113.487 178.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 57.9 mt -64.73 -52.44 57.07 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 118.522 0.601 . . . . 0.0 110.001 -178.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 76.3 t -89.48 -31.79 5.47 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 C-N-CA 124.306 1.042 . . . . 0.0 109.664 176.833 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 66.5 mtm180 85.86 58.17 0.01 OUTLIER 'General case' 0 C--N 1.344 0.331 0 C-N-CA 127.821 2.448 . . . . 0.0 109.854 178.22 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -151.0 167.29 28.07 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 124.093 0.957 . . . . 0.0 110.843 176.302 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 96.6 m95 -87.4 116.22 25.35 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 124.073 0.949 . . . . 0.0 109.242 174.711 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 94.1 t -99.68 109.68 25.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 178.553 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 73.0 m -99.66 76.09 1.97 Allowed 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 124.567 1.147 . . . . 0.0 109.044 -177.737 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.336 0.006 0 CA-C-N 116.165 -0.471 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 -0.006 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 72.1 m -67.44 98.75 0.68 Allowed 'General case' 0 C--N 1.339 0.138 0 C-N-CA 124.596 1.158 . . . . 0.0 110.485 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 57.3 p-80 -116.15 139.25 50.52 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 124.614 1.165 . . . . 0.0 108.995 175.105 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 77.0 t-105 -75.91 117.93 18.16 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 122.967 0.507 . . . . 0.0 110.235 -177.353 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -89.66 110.22 21.12 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 173.106 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 41.6 mt -61.78 -37.33 83.94 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.915 1.286 . . . . 0.0 112.02 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 64.8 tp -54.83 -55.2 32.82 Favored 'General case' 0 C--N 1.341 0.235 0 C-N-CA 123.962 0.905 . . . . 0.0 111.523 -174.19 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 57.5 t -89.71 -28.03 5.14 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 C-N-CA 123.899 0.88 . . . . 0.0 110.557 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 75.0 mtp180 74.13 60.69 0.08 Allowed 'General case' 0 C--N 1.34 0.175 0 C-N-CA 125.414 1.486 . . . . 0.0 109.955 -174.749 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.7 162.96 39.69 Favored 'General case' 0 CA--C 1.528 0.114 0 C-N-CA 123.708 0.803 . . . . 0.0 110.774 173.531 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -82.19 118.34 23.01 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.946 0.898 . . . . 0.0 109.583 175.028 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 90.5 t -99.69 105.86 18.17 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.306 0 N-CA-C 107.174 -1.417 . . . . 0.0 107.174 176.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 68.7 m -99.61 74.56 1.88 Allowed 'General case' 0 N--CA 1.456 -0.132 0 C-N-CA 124.443 1.097 . . . . 0.0 109.032 -176.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.078 0 CA-C-N 116.19 -0.459 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.061 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 72.9 m -76.59 154.63 34.25 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 123.262 0.625 . . . . 0.0 110.323 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 29.1 p-80 -99.99 150.02 22.86 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 124.267 1.027 . . . . 0.0 108.877 172.068 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 74.0 t-105 -79.44 114.45 18.38 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 178.33 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -89.54 97.82 11.41 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 107.289 -1.375 . . . . 0.0 107.289 170.904 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 6.6 tt -67.79 -23.0 65.16 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.738 1.215 . . . . 0.0 112.225 -178.768 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 9.5 mp -57.6 -55.52 33.79 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.568 0.747 . . . . 0.0 110.046 -178.98 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 60.5 t -89.53 -25.58 5.6 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 124.112 0.965 . . . . 0.0 110.339 178.058 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 71.6 mtt85 75.75 58.92 0.05 Allowed 'General case' 0 C--N 1.343 0.283 0 C-N-CA 126.577 1.951 . . . . 0.0 109.942 -177.601 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.6 165.12 34.31 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 124.305 1.042 . . . . 0.0 110.172 172.773 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -83.5 137.43 33.88 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 123.828 0.851 . . . . 0.0 109.801 175.769 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 90.8 t -134.66 123.17 41.16 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.182 0 C-N-CA 124.954 1.302 . . . . 0.0 108.791 -176.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 7.4 m -99.35 81.41 2.53 Favored 'General case' 0 CA--C 1.529 0.152 0 N-CA-C 107.167 -1.42 . . . . 0.0 107.167 173.212 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.038 0 CA-C-N 116.428 -0.351 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.078 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 83.3 m -77.55 154.07 32.73 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 123.289 0.636 . . . . 0.0 110.238 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 32.2 p-80 -99.88 149.36 23.48 Favored 'General case' 0 C--N 1.339 0.121 0 C-N-CA 124.203 1.001 . . . . 0.0 108.781 172.017 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.5 t-105 -79.64 114.88 18.9 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 178.428 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -89.62 97.63 11.3 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 170.822 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 63.9 tp -63.6 -28.91 70.25 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 125.116 1.367 . . . . 0.0 111.814 178.578 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 66.6 mt -54.06 -51.92 62.56 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.099 0.96 . . . . 0.0 111.237 -176.687 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 76.9 t -89.52 -34.31 6.67 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 C-N-CA 123.732 0.813 . . . . 0.0 109.811 175.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 72.6 mtm180 87.63 56.28 0.01 OUTLIER 'General case' 0 C--N 1.343 0.307 0 C-N-CA 128.041 2.536 . . . . 0.0 109.307 -176.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.75 165.79 32.42 Favored 'General case' 0 C--N 1.34 0.171 0 C-N-CA 123.707 0.803 . . . . 0.0 110.752 175.438 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -80.6 139.81 36.07 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 123.693 0.797 . . . . 0.0 109.912 174.518 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 91.3 t -136.28 121.82 28.46 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.227 0 C-N-CA 124.93 1.292 . . . . 0.0 108.597 -178.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.3 m -99.54 148.27 24.46 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 124.215 1.006 . . . . 0.0 108.388 171.751 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.096 0 O-C-N 122.327 -0.233 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 -0.018 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 71.7 m -67.32 100.12 0.78 Allowed 'General case' 0 N--CA 1.457 -0.112 0 C-N-CA 124.598 1.159 . . . . 0.0 110.476 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 56.9 p-80 -117.04 137.0 52.54 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 124.663 1.185 . . . . 0.0 108.928 175.028 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.9 t-105 -74.24 121.85 21.91 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 123.165 0.586 . . . . 0.0 110.493 -177.179 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -91.87 115.79 28.36 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 170.315 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 7.0 mp -69.54 -29.21 66.76 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.283 1.033 . . . . 0.0 111.674 -177.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 75.1 mt -63.65 -56.4 16.05 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.356 0.662 . . . . 0.0 110.861 -174.112 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 59.8 t -89.6 -22.42 6.48 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 124.09 0.956 . . . . 0.0 110.519 -178.827 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 75.3 mtt85 70.8 59.91 0.2 Allowed 'General case' 0 C--N 1.341 0.228 0 C-N-CA 125.273 1.429 . . . . 0.0 110.018 179.43 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.59 163.31 38.79 Favored 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 124.248 1.019 . . . . 0.0 110.459 174.665 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 97.3 m95 -84.02 119.98 25.59 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 123.979 0.912 . . . . 0.0 109.4 174.843 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 88.8 t -99.46 103.84 15.27 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 N-CA-C 106.977 -1.49 . . . . 0.0 106.977 178.439 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 65.2 m -99.42 74.27 1.9 Allowed 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 124.46 1.104 . . . . 0.0 109.189 -176.309 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.088 0 CA-C-N 116.16 -0.473 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.064 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 73.8 m -76.6 154.63 34.23 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.321 0.648 . . . . 0.0 110.313 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 30.0 p-80 -99.96 149.82 23.05 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.271 1.028 . . . . 0.0 108.718 171.456 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.5 t-105 -81.23 117.4 21.72 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 178.652 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -89.53 107.53 19.13 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 176.653 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 44.2 mt -67.86 -22.94 65.1 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.081 1.352 . . . . 0.0 112.573 -179.216 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 9.6 mp -63.66 -43.06 97.85 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.292 0.637 . . . . 0.0 110.826 -176.086 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 60.5 t -106.12 -23.36 4.48 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 C-N-CA 124.855 1.262 . . . . 0.0 111.096 -179.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 13.5 mtm-85 71.05 59.43 0.18 Allowed 'General case' 0 C--N 1.342 0.258 0 C-N-CA 126.338 1.855 . . . . 0.0 109.77 -174.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.59 167.28 27.73 Favored 'General case' 0 C--N 1.339 0.12 0 C-N-CA 124.211 1.004 . . . . 0.0 110.351 173.097 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -78.13 139.09 39.01 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 123.639 0.776 . . . . 0.0 110.181 175.302 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 85.2 t -137.15 121.72 24.07 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.195 0 C-N-CA 124.991 1.316 . . . . 0.0 108.599 179.246 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 6.6 m -99.27 81.62 2.58 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 107.214 -1.402 . . . . 0.0 107.214 173.058 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.048 0 CA-C-N 116.435 -0.348 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.092 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 9.3 m -139.89 157.67 45.32 Favored 'General case' 0 C--N 1.34 0.157 0 C-N-CA 124.079 0.952 . . . . 0.0 109.93 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 56.7 p-80 -133.41 142.78 48.52 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 124.246 1.019 . . . . 0.0 109.3 176.684 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.4 t-105 -77.62 113.99 16.01 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 123.167 0.587 . . . . 0.0 109.981 -179.456 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -89.66 99.86 12.78 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 107.436 -1.32 . . . . 0.0 107.436 171.16 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.21 -13.51 62.45 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.468 1.107 . . . . 0.0 113.698 -179.529 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 66.9 tp -66.55 -55.64 14.53 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 118.535 0.607 . . . . 0.0 109.756 179.315 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 58.2 t -89.45 -23.31 6.24 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 C-N-CA 124.238 1.015 . . . . 0.0 110.054 178.173 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 74.9 mtt85 73.48 60.23 0.09 Allowed 'General case' 0 C--N 1.341 0.237 0 C-N-CA 126.359 1.864 . . . . 0.0 109.918 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.56 162.8 39.92 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.306 1.042 . . . . 0.0 110.45 173.847 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 91.2 m95 -84.0 119.82 25.38 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.779 0.832 . . . . 0.0 109.399 174.39 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 86.3 t -99.52 111.67 29.77 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 N-CA-C 107.027 -1.472 . . . . 0.0 107.027 177.443 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 94.9 m -99.87 147.48 25.48 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 124.552 1.141 . . . . 0.0 110.824 -175.084 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.031 0 CA-C-N 116.57 -0.287 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.126 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 9.2 m -140.3 158.03 44.66 Favored 'General case' 0 C--N 1.34 0.175 0 C-N-CA 124.071 0.948 . . . . 0.0 109.891 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 55.9 p-80 -132.19 143.17 49.77 Favored 'General case' 0 N--CA 1.456 -0.138 0 C-N-CA 124.209 1.004 . . . . 0.0 109.226 175.594 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 74.2 t-105 -78.77 110.44 13.94 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 123.197 0.599 . . . . 0.0 110.204 -177.673 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -89.8 96.0 10.49 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 170.053 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 8.3 tt -63.02 -33.26 75.04 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.705 1.202 . . . . 0.0 111.54 178.744 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -52.35 -50.07 63.06 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.029 1.331 . . . . 0.0 111.116 -175.479 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 73.7 t -89.28 -32.13 5.62 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 C-N-CA 123.567 0.747 . . . . 0.0 109.44 174.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 38.6 ttp180 90.63 51.71 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 126.154 1.782 . . . . 0.0 109.719 177.633 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.83 163.75 37.89 Favored 'General case' 0 C--N 1.34 0.184 0 C-N-CA 123.49 0.716 . . . . 0.0 111.455 178.139 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 88.8 m95 -83.81 122.18 28.33 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.984 0.914 . . . . 0.0 109.321 172.294 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 93.9 t -99.84 110.93 28.08 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 175.735 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 99.5 m -99.8 147.57 25.34 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 124.574 1.15 . . . . 0.0 110.819 -175.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.336 0.008 0 CA-C-N 116.557 -0.292 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.228 -0.027 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 72.5 m -67.42 98.56 0.66 Allowed 'General case' 0 N--CA 1.457 -0.103 0 C-N-CA 124.664 1.185 . . . . 0.0 110.477 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 57.3 p-80 -115.92 140.32 49.36 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 124.559 1.143 . . . . 0.0 109.03 175.454 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 77.0 t-105 -76.26 114.7 15.24 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.04 0.536 . . . . 0.0 110.426 -177.001 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -89.71 105.56 17.88 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 107.694 -1.224 . . . . 0.0 107.694 170.872 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -81.04 10.42 5.21 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.511 1.124 . . . . 0.0 113.381 -179.333 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 71.7 mt -85.55 -52.31 5.91 Favored 'General case' 0 C--N 1.34 0.185 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 174.463 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 61.9 t -89.77 -22.83 6.32 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 124.523 1.129 . . . . 0.0 110.337 176.075 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.3 mpt_? 68.58 62.74 0.34 Allowed 'General case' 0 C--N 1.342 0.249 0 C-N-CA 125.939 1.696 . . . . 0.0 109.419 -173.476 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.66 163.09 39.37 Favored 'General case' 0 C--N 1.339 0.114 0 C-N-CA 123.786 0.835 . . . . 0.0 110.875 172.813 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 96.9 m95 -84.56 118.68 24.49 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 124.027 0.931 . . . . 0.0 109.432 175.342 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 87.8 t -99.6 106.39 18.97 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 N-CA-C 107.33 -1.359 . . . . 0.0 107.33 177.676 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 69.6 m -99.5 74.46 1.9 Allowed 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 124.518 1.127 . . . . 0.0 109.126 -177.291 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.336 -0.016 0 CA-C-N 116.151 -0.477 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 -0.025 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 72.2 m -67.36 99.27 0.71 Allowed 'General case' 0 C--N 1.34 0.153 0 C-N-CA 124.663 1.185 . . . . 0.0 110.351 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 57.3 p-80 -116.36 138.97 50.91 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 124.587 1.155 . . . . 0.0 109.024 175.219 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.7 t-105 -75.06 116.59 15.97 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.106 0.562 . . . . 0.0 110.46 -177.255 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -89.75 104.05 16.65 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 107.526 -1.287 . . . . 0.0 107.526 169.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 59.4 tp -65.82 -25.06 67.05 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.852 1.261 . . . . 0.0 112.214 -179.366 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 69.8 mt -61.07 -56.24 23.3 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.232 0.613 . . . . 0.0 110.749 -177.435 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 57.9 t -89.55 -24.5 5.88 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 C-N-CA 124.242 1.017 . . . . 0.0 110.473 179.653 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 71.8 mtt85 74.03 60.57 0.08 Allowed 'General case' 0 C--N 1.342 0.262 0 C-N-CA 126.225 1.81 . . . . 0.0 110.11 -179.627 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.62 162.19 41.13 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 124.15 0.98 . . . . 0.0 110.477 173.309 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -83.94 118.94 24.33 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.946 0.899 . . . . 0.0 109.328 174.834 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 98.1 t -99.53 105.44 17.49 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 N-CA-C 107.178 -1.416 . . . . 0.0 107.178 178.838 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 67.1 m -99.5 74.37 1.89 Allowed 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 124.476 1.111 . . . . 0.0 109.152 -176.641 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.051 0 CA-C-N 116.167 -0.469 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.065 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 72.4 m -68.9 96.23 0.75 Allowed 'General case' 0 N--CA 1.457 -0.108 0 C-N-CA 124.761 1.224 . . . . 0.0 110.396 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 57.1 p-80 -114.67 142.42 46.5 Favored 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 125.01 1.324 . . . . 0.0 108.516 174.638 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 60.4 t-105 -80.47 121.76 26.15 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 122.424 0.289 . . . . 0.0 110.28 -178.21 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -89.85 111.93 23.12 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 171.759 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 51.4 mt -64.92 -32.04 73.56 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.791 1.236 . . . . 0.0 112.124 179.162 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 73.1 mt -59.53 -53.48 57.63 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.515 0.726 . . . . 0.0 111.139 -173.541 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 61.6 t -89.47 -24.78 5.81 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 C-N-CA 123.999 0.92 . . . . 0.0 110.364 178.372 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 86.6 mtm180 73.92 58.08 0.09 Allowed 'General case' 0 C--N 1.344 0.332 0 C-N-CA 126.078 1.751 . . . . 0.0 109.707 -179.042 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.84 167.51 27.27 Favored 'General case' 0 C--N 1.339 0.138 0 C-N-CA 124.009 0.924 . . . . 0.0 110.871 175.875 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -75.38 142.32 43.12 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 123.239 0.616 . . . . 0.0 109.838 170.203 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 79.4 t -127.92 105.6 13.72 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 N-CA-C 106.947 -1.501 . . . . 0.0 106.947 175.585 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 68.7 m -99.59 75.59 1.95 Allowed 'General case' 0 N--CA 1.457 -0.12 0 C-N-CA 124.527 1.131 . . . . 0.0 109.079 -176.801 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.058 0 CA-C-N 116.251 -0.432 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.083 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 9.0 m -140.08 157.6 45.38 Favored 'General case' 0 C--N 1.34 0.162 0 C-N-CA 124.08 0.952 . . . . 0.0 109.95 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 57.2 p-80 -132.75 142.23 48.92 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 124.253 1.021 . . . . 0.0 109.217 176.413 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.5 t-105 -77.19 115.28 16.84 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 123.124 0.57 . . . . 0.0 110.106 -179.092 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -89.65 103.11 15.79 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 170.301 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 60.1 tp -65.59 -29.05 69.6 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.925 1.29 . . . . 0.0 112.045 -179.342 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -57.39 -53.07 62.27 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.607 0.763 . . . . 0.0 110.705 -176.721 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 59.1 t -89.39 -26.25 5.48 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 C-N-CA 123.879 0.872 . . . . 0.0 110.407 177.75 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 74.03 60.15 0.08 Allowed 'General case' 0 C--N 1.342 0.244 0 C-N-CA 126.36 1.864 . . . . 0.0 110.069 -175.75 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.61 162.58 40.37 Favored 'General case' 0 C--O 1.231 0.128 0 C-N-CA 123.696 0.798 . . . . 0.0 110.771 173.064 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 92.1 m95 -83.89 120.42 26.05 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 123.735 0.814 . . . . 0.0 109.371 174.292 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 84.8 t -99.51 111.18 28.42 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 N-CA-C 106.933 -1.506 . . . . 0.0 106.933 176.999 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 92.7 m -99.82 147.56 25.36 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 124.608 1.163 . . . . 0.0 110.921 -174.57 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.068 0 CA-C-N 116.651 -0.25 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.048 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 18.8 m -78.43 151.48 32.68 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 123.105 0.562 . . . . 0.0 109.644 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 51.1 p-80 -121.23 137.66 54.58 Favored 'General case' 0 N--CA 1.457 -0.094 0 C-N-CA 124.271 1.028 . . . . 0.0 109.655 -179.648 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 75.8 t-105 -75.75 116.64 16.66 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.233 0.613 . . . . 0.0 110.353 -177.801 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -89.72 105.76 18.01 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 169.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 60.5 tp -67.97 -29.52 68.59 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.72 1.208 . . . . 0.0 112.103 -177.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -58.21 -51.84 68.06 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.541 0.736 . . . . 0.0 110.618 -176.175 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 81.1 t -89.69 -26.28 5.42 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 C-N-CA 124.303 1.041 . . . . 0.0 110.511 177.77 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 76.4 mtp180 75.1 59.79 0.06 Allowed 'General case' 0 C--N 1.341 0.219 0 C-N-CA 125.88 1.672 . . . . 0.0 110.491 -178.214 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -151.03 167.78 26.59 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 123.821 0.848 . . . . 0.0 110.693 174.124 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 96.5 m95 -86.77 120.33 27.96 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.96 0.904 . . . . 0.0 109.242 173.863 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 94.9 t -99.68 113.45 34.99 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 N-CA-C 107.139 -1.43 . . . . 0.0 107.139 176.108 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 75.4 m -99.81 153.16 19.35 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.576 1.15 . . . . 0.0 110.025 -177.769 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.336 -0.02 0 O-C-N 122.273 -0.267 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 0.023 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 72.1 m -70.61 90.97 0.77 Allowed 'General case' 0 C--N 1.339 0.135 0 C-N-CA 124.989 1.316 . . . . 0.0 110.34 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 53.9 p-80 -108.9 148.62 30.37 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 124.868 1.267 . . . . 0.0 109.391 177.022 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 73.1 t-105 -80.7 110.69 16.44 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 123.167 0.587 . . . . 0.0 109.977 -179.605 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -89.62 91.98 8.89 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 171.574 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -61.52 -27.05 68.33 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.514 1.126 . . . . 0.0 113.126 177.641 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 65.3 tp -55.55 -52.95 62.0 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 124.739 1.216 . . . . 0.0 111.035 -177.22 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 58.3 t -89.16 -25.33 5.73 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 C-N-CA 123.617 0.767 . . . . 0.0 109.417 174.651 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 27.0 ttm180 83.37 52.46 0.01 OUTLIER 'General case' 0 C--N 1.342 0.243 0 C-N-CA 126.462 1.905 . . . . 0.0 109.822 175.894 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.76 166.89 29.06 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 124.34 1.056 . . . . 0.0 110.636 177.249 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 96.6 m95 -80.98 142.51 33.37 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 123.321 0.648 . . . . 0.0 109.654 171.896 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 97.8 t -130.18 112.03 22.55 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.245 0 N-CA-C 107.422 -1.325 . . . . 0.0 107.422 178.926 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 83.1 m -99.56 81.93 2.57 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 124.592 1.157 . . . . 0.0 109.097 -178.614 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.037 0 CA-C-N 116.213 -0.449 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.129 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 10.0 m -140.55 158.03 44.6 Favored 'General case' 0 C--N 1.34 0.163 0 C-N-CA 124.015 0.926 . . . . 0.0 109.98 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 56.5 p-80 -133.54 144.6 49.46 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 124.346 1.058 . . . . 0.0 108.855 174.628 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 75.1 t-105 -74.22 141.51 45.42 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 122.51 0.324 . . . . 0.0 110.626 -179.121 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -125.67 105.92 9.35 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 124.846 1.259 . . . . 0.0 107.723 170.503 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -67.24 -37.83 84.2 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.87 1.268 . . . . 0.0 110.806 178.125 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 65.6 mt -47.53 -49.16 26.93 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 125.372 1.469 . . . . 0.0 111.82 -173.741 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.647 ' O ' ' CB ' ' A' ' 30' ' ' ARG . 82.7 t -89.42 -45.9 15.28 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 171.402 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.647 ' CB ' ' O ' ' A' ' 29' ' ' VAL . 64.7 ttt180 103.41 52.4 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 177.4 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.91 166.85 29.36 Favored 'General case' 0 C--N 1.339 0.138 0 C-N-CA 124.211 1.004 . . . . 0.0 111.012 -179.933 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 87.4 m95 -86.66 125.19 33.69 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.939 0.896 . . . . 0.0 109.212 171.195 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 97.2 t -99.69 109.03 23.77 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 177.222 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 95.6 m -99.88 147.62 25.34 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 124.427 1.091 . . . . 0.0 110.752 -175.627 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.336 -0.01 0 CA-C-N 116.579 -0.282 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.092 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 73.1 m -71.83 88.51 1.02 Allowed 'General case' 0 C--N 1.34 0.161 0 C-N-CA 125.15 1.38 . . . . 0.0 110.288 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 53.3 p-80 -106.87 150.04 26.8 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 124.944 1.297 . . . . 0.0 109.3 177.108 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.0 t-105 -79.15 115.16 18.64 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 178.082 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -89.59 97.97 11.5 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 171.688 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.7 pp -68.47 -20.47 64.62 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.521 1.128 . . . . 0.0 113.043 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 66.2 tp -60.72 -54.2 48.13 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.525 0.73 . . . . 0.0 110.339 -178.952 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 85.6 t -89.46 -28.64 5.12 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 C-N-CA 123.967 0.907 . . . . 0.0 109.938 177.896 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 63.6 mtm180 84.88 55.93 0.01 OUTLIER 'General case' 0 C--N 1.343 0.295 0 C-N-CA 127.567 2.347 . . . . 0.0 110.004 176.586 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -151.01 173.63 14.09 Favored 'General case' 0 N--CA 1.457 -0.076 0 C-N-CA 124.368 1.067 . . . . 0.0 110.117 176.388 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -85.5 140.57 30.56 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 123.462 0.705 . . . . 0.0 109.557 172.099 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 84.2 t -129.66 114.01 29.22 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 C-N-CA 125.213 1.405 . . . . 0.0 107.36 178.5 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 80.9 m -99.56 85.92 3.24 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.611 1.165 . . . . 0.0 109.225 -178.179 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.336 -0.011 0 CA-C-N 116.223 -0.444 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.034 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 73.0 m -76.5 154.68 34.42 Favored 'General case' 0 CA--C 1.528 0.119 0 C-N-CA 123.218 0.607 . . . . 0.0 110.368 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 28.5 p-80 -99.92 150.18 22.66 Favored 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 124.3 1.04 . . . . 0.0 108.857 172.112 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 74.1 t-105 -79.92 113.8 18.36 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 178.403 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -89.59 96.58 10.76 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 107.432 -1.321 . . . . 0.0 107.432 171.624 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.14 -12.59 61.17 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.437 1.095 . . . . 0.0 113.545 178.624 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.8 tt -63.69 -57.66 9.33 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 179.493 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 57.7 t -89.24 -23.62 6.19 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 C-N-CA 124.131 0.972 . . . . 0.0 110.086 177.282 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 87.2 mtt-85 73.51 60.16 0.09 Allowed 'General case' 0 C--N 1.341 0.209 0 C-N-CA 126.306 1.842 . . . . 0.0 110.071 -176.73 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.6 165.83 32.12 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.468 1.107 . . . . 0.0 109.958 172.464 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -83.44 137.3 33.97 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 123.762 0.825 . . . . 0.0 109.783 176.124 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 86.9 t -134.8 123.24 40.77 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.19 0 C-N-CA 124.951 1.3 . . . . 0.0 108.744 -176.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 7.4 m -99.24 81.34 2.54 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 107.243 -1.392 . . . . 0.0 107.243 173.195 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.336 -0.003 0 CA-C-N 116.455 -0.339 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 0.005 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 71.6 m -67.73 98.55 0.72 Allowed 'General case' 0 C--N 1.34 0.165 0 C-N-CA 124.7 1.2 . . . . 0.0 110.42 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 57.3 p-80 -115.71 139.31 50.27 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 124.727 1.211 . . . . 0.0 108.737 174.449 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 73.7 t-105 -76.32 116.63 17.18 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 122.748 0.419 . . . . 0.0 110.542 -176.676 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -89.84 108.57 19.78 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 169.962 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -79.92 0.84 29.66 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.182 0.993 . . . . 0.0 113.647 -178.521 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 74.0 mt -77.73 -55.5 5.29 Favored 'General case' 0 C--N 1.34 0.183 0 N-CA-C 108.744 -0.835 . . . . 0.0 108.744 175.755 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 87.2 t -89.61 -17.75 8.0 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 125.134 1.374 . . . . 0.0 110.535 178.005 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 65.95 60.8 0.66 Allowed 'General case' 0 C--N 1.343 0.322 0 C-N-CA 125.626 1.571 . . . . 0.0 110.385 178.929 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -151.0 170.36 19.55 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.607 1.163 . . . . 0.0 110.413 175.041 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 98.0 m95 -87.17 120.82 28.85 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 124.033 0.933 . . . . 0.0 109.398 173.672 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 94.3 t -99.75 105.2 17.15 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 175.256 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 69.0 m -99.6 74.62 1.89 Allowed 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 124.504 1.122 . . . . 0.0 109.107 -177.283 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.037 0 CA-C-N 116.221 -0.445 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 -0.012 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 72.5 m -67.7 97.25 0.61 Allowed 'General case' 0 C--N 1.339 0.139 0 C-N-CA 124.779 1.231 . . . . 0.0 110.462 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 57.1 p-80 -114.77 141.85 47.31 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 124.659 1.183 . . . . 0.0 108.952 175.598 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 74.6 t-105 -76.95 110.26 11.44 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 123.007 0.523 . . . . 0.0 110.41 -177.148 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -89.6 97.87 11.44 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 107.076 -1.454 . . . . 0.0 107.076 169.598 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 8.3 tt -65.41 -33.28 75.57 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.606 1.162 . . . . 0.0 111.322 178.908 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -50.15 -49.33 52.5 Favored 'General case' 0 C--N 1.342 0.242 0 C-N-CA 125.307 1.443 . . . . 0.0 111.238 -175.216 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.665 ' O ' ' CB ' ' A' ' 30' ' ' ARG . 90.3 t -89.22 -45.62 15.38 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 171.909 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.665 ' CB ' ' O ' ' A' ' 29' ' ' VAL . 62.3 ttt180 106.57 52.08 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 123.372 0.669 . . . . 0.0 109.244 175.433 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.98 162.52 40.67 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 123.959 0.903 . . . . 0.0 111.242 179.783 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 96.1 m95 -83.09 118.13 23.34 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 124.011 0.924 . . . . 0.0 109.331 173.579 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 89.1 t -99.77 108.09 22.03 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.248 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 177.728 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 77.4 m -99.56 75.69 1.96 Allowed 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 124.537 1.135 . . . . 0.0 109.023 -178.054 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.03 0 CA-C-N 116.201 -0.454 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 0.015 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 72.3 m -68.93 94.13 0.61 Allowed 'General case' 0 C--N 1.338 0.101 0 C-N-CA 124.898 1.279 . . . . 0.0 110.317 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 54.6 p-80 -112.36 144.45 41.77 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 124.755 1.222 . . . . 0.0 109.236 176.535 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.8 t-105 -75.35 115.17 14.72 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 179.701 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -89.42 102.23 14.9 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 170.792 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 61.6 tp -64.13 -34.03 77.14 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.821 1.249 . . . . 0.0 111.964 -177.302 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 65.2 tp -53.46 -54.79 31.87 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.04 0.936 . . . . 0.0 111.357 -177.01 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 88.2 t -89.85 -25.59 5.54 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 C-N-CA 124.087 0.955 . . . . 0.0 110.654 179.087 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 68.2 mtp85 74.72 60.45 0.07 Allowed 'General case' 0 C--N 1.341 0.198 0 C-N-CA 125.968 1.707 . . . . 0.0 110.668 -177.795 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -151.11 166.4 30.92 Favored 'General case' 0 N--CA 1.457 -0.108 0 C-N-CA 123.747 0.819 . . . . 0.0 110.615 173.04 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 96.9 m95 -87.4 114.67 24.22 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 124.048 0.939 . . . . 0.0 109.246 175.576 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 92.2 t -99.66 110.76 27.54 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 178.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 71.4 m -99.58 76.62 2.02 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 124.585 1.154 . . . . 0.0 109.069 -177.667 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.056 0 CA-C-N 116.144 -0.48 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 55.4 p-80 . . . . . 0 N--CA 1.455 -0.211 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.5 t-105 -75.96 112.47 12.42 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 122.77 0.428 . . . . 0.0 110.179 -179.145 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -89.64 98.31 11.69 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 170.014 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -67.62 -15.85 63.86 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.492 1.117 . . . . 0.0 113.487 178.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 57.9 mt -64.73 -52.44 57.07 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 118.522 0.601 . . . . 0.0 110.001 -178.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 76.3 t -89.48 -31.79 5.47 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 C-N-CA 124.306 1.042 . . . . 0.0 109.664 176.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 66.5 mtm180 85.86 58.17 0.01 OUTLIER 'General case' 0 C--N 1.344 0.331 0 C-N-CA 127.821 2.448 . . . . 0.0 109.854 178.22 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -151.0 167.29 28.07 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 124.093 0.957 . . . . 0.0 110.843 176.302 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 96.6 m95 -87.4 116.22 25.35 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 124.073 0.949 . . . . 0.0 109.242 174.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 94.1 t . . . . . 0 N--CA 1.453 -0.322 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 178.553 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 57.3 p-80 . . . . . 0 N--CA 1.455 -0.18 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 77.0 t-105 -75.91 117.93 18.16 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 122.967 0.507 . . . . 0.0 110.235 -177.353 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -89.66 110.22 21.12 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 173.106 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 41.6 mt -61.78 -37.33 83.94 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.915 1.286 . . . . 0.0 112.02 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 64.8 tp -54.83 -55.2 32.82 Favored 'General case' 0 C--N 1.341 0.235 0 C-N-CA 123.962 0.905 . . . . 0.0 111.523 -174.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 57.5 t -89.71 -28.03 5.14 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 C-N-CA 123.899 0.88 . . . . 0.0 110.557 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 75.0 mtp180 74.13 60.69 0.08 Allowed 'General case' 0 C--N 1.34 0.175 0 C-N-CA 125.414 1.486 . . . . 0.0 109.955 -174.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.7 162.96 39.69 Favored 'General case' 0 CA--C 1.528 0.114 0 C-N-CA 123.708 0.803 . . . . 0.0 110.774 173.531 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -82.19 118.34 23.01 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.946 0.898 . . . . 0.0 109.583 175.028 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 90.5 t . . . . . 0 N--CA 1.453 -0.306 0 N-CA-C 107.174 -1.417 . . . . 0.0 107.174 176.902 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 29.1 p-80 . . . . . 0 N--CA 1.455 -0.177 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 74.0 t-105 -79.44 114.45 18.38 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 178.33 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -89.54 97.82 11.41 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 107.289 -1.375 . . . . 0.0 107.289 170.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 6.6 tt -67.79 -23.0 65.16 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.738 1.215 . . . . 0.0 112.225 -178.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 9.5 mp -57.6 -55.52 33.79 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.568 0.747 . . . . 0.0 110.046 -178.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 60.5 t -89.53 -25.58 5.6 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 124.112 0.965 . . . . 0.0 110.339 178.058 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 71.6 mtt85 75.75 58.92 0.05 Allowed 'General case' 0 C--N 1.343 0.283 0 C-N-CA 126.577 1.951 . . . . 0.0 109.942 -177.601 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.6 165.12 34.31 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 124.305 1.042 . . . . 0.0 110.172 172.773 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -83.5 137.43 33.88 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 123.828 0.851 . . . . 0.0 109.801 175.769 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 90.8 t . . . . . 0 N--CA 1.455 -0.182 0 C-N-CA 124.954 1.302 . . . . 0.0 108.791 -176.963 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 32.2 p-80 . . . . . 0 N--CA 1.457 -0.09 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.5 t-105 -79.64 114.88 18.9 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 178.428 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -89.62 97.63 11.3 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 170.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 63.9 tp -63.6 -28.91 70.25 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 125.116 1.367 . . . . 0.0 111.814 178.578 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 66.6 mt -54.06 -51.92 62.56 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.099 0.96 . . . . 0.0 111.237 -176.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 76.9 t -89.52 -34.31 6.67 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 C-N-CA 123.732 0.813 . . . . 0.0 109.811 175.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 72.6 mtm180 87.63 56.28 0.01 OUTLIER 'General case' 0 C--N 1.343 0.307 0 C-N-CA 128.041 2.536 . . . . 0.0 109.307 -176.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.75 165.79 32.42 Favored 'General case' 0 C--N 1.34 0.171 0 C-N-CA 123.707 0.803 . . . . 0.0 110.752 175.438 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -80.6 139.81 36.07 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 123.693 0.797 . . . . 0.0 109.912 174.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 91.3 t . . . . . 0 N--CA 1.454 -0.227 0 C-N-CA 124.93 1.292 . . . . 0.0 108.597 -178.935 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 56.9 p-80 . . . . . 0 N--CA 1.455 -0.185 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.9 t-105 -74.24 121.85 21.91 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 123.165 0.586 . . . . 0.0 110.493 -177.179 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -91.87 115.79 28.36 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 170.315 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 7.0 mp -69.54 -29.21 66.76 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.283 1.033 . . . . 0.0 111.674 -177.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 75.1 mt -63.65 -56.4 16.05 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.356 0.662 . . . . 0.0 110.861 -174.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 59.8 t -89.6 -22.42 6.48 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 124.09 0.956 . . . . 0.0 110.519 -178.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 75.3 mtt85 70.8 59.91 0.2 Allowed 'General case' 0 C--N 1.341 0.228 0 C-N-CA 125.273 1.429 . . . . 0.0 110.018 179.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.59 163.31 38.79 Favored 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 124.248 1.019 . . . . 0.0 110.459 174.665 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 97.3 m95 -84.02 119.98 25.59 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 123.979 0.912 . . . . 0.0 109.4 174.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 88.8 t . . . . . 0 N--CA 1.453 -0.281 0 N-CA-C 106.977 -1.49 . . . . 0.0 106.977 178.439 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 30.0 p-80 . . . . . 0 N--CA 1.456 -0.166 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.5 t-105 -81.23 117.4 21.72 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 178.652 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -89.53 107.53 19.13 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 176.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 44.2 mt -67.86 -22.94 65.1 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.081 1.352 . . . . 0.0 112.573 -179.216 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 9.6 mp -63.66 -43.06 97.85 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.292 0.637 . . . . 0.0 110.826 -176.086 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 60.5 t -106.12 -23.36 4.48 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 C-N-CA 124.855 1.262 . . . . 0.0 111.096 -179.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 13.5 mtm-85 71.05 59.43 0.18 Allowed 'General case' 0 C--N 1.342 0.258 0 C-N-CA 126.338 1.855 . . . . 0.0 109.77 -174.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.59 167.28 27.73 Favored 'General case' 0 C--N 1.339 0.12 0 C-N-CA 124.211 1.004 . . . . 0.0 110.351 173.097 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -78.13 139.09 39.01 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 123.639 0.776 . . . . 0.0 110.181 175.302 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 85.2 t . . . . . 0 N--CA 1.455 -0.195 0 C-N-CA 124.991 1.316 . . . . 0.0 108.599 179.246 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 56.7 p-80 . . . . . 0 N--CA 1.455 -0.182 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.4 t-105 -77.62 113.99 16.01 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 123.167 0.587 . . . . 0.0 109.981 -179.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -89.66 99.86 12.78 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 107.436 -1.32 . . . . 0.0 107.436 171.16 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.21 -13.51 62.45 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.468 1.107 . . . . 0.0 113.698 -179.529 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 66.9 tp -66.55 -55.64 14.53 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 118.535 0.607 . . . . 0.0 109.756 179.315 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 58.2 t -89.45 -23.31 6.24 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 C-N-CA 124.238 1.015 . . . . 0.0 110.054 178.173 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 74.9 mtt85 73.48 60.23 0.09 Allowed 'General case' 0 C--N 1.341 0.237 0 C-N-CA 126.359 1.864 . . . . 0.0 109.918 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.56 162.8 39.92 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.306 1.042 . . . . 0.0 110.45 173.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 91.2 m95 -84.0 119.82 25.38 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.779 0.832 . . . . 0.0 109.399 174.39 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 86.3 t . . . . . 0 N--CA 1.453 -0.303 0 N-CA-C 107.027 -1.472 . . . . 0.0 107.027 177.443 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 55.9 p-80 . . . . . 0 N--CA 1.456 -0.138 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 74.2 t-105 -78.77 110.44 13.94 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 123.197 0.599 . . . . 0.0 110.204 -177.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -89.8 96.0 10.49 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 170.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 8.3 tt -63.02 -33.26 75.04 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.705 1.202 . . . . 0.0 111.54 178.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -52.35 -50.07 63.06 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.029 1.331 . . . . 0.0 111.116 -175.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 73.7 t -89.28 -32.13 5.62 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 C-N-CA 123.567 0.747 . . . . 0.0 109.44 174.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 38.6 ttp180 90.63 51.71 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 126.154 1.782 . . . . 0.0 109.719 177.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.83 163.75 37.89 Favored 'General case' 0 C--N 1.34 0.184 0 C-N-CA 123.49 0.716 . . . . 0.0 111.455 178.139 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 88.8 m95 -83.81 122.18 28.33 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.984 0.914 . . . . 0.0 109.321 172.294 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 93.9 t . . . . . 0 N--CA 1.453 -0.287 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 175.735 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 57.3 p-80 . . . . . 0 N--CA 1.455 -0.188 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 77.0 t-105 -76.26 114.7 15.24 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.04 0.536 . . . . 0.0 110.426 -177.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -89.71 105.56 17.88 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 107.694 -1.224 . . . . 0.0 107.694 170.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -81.04 10.42 5.21 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.511 1.124 . . . . 0.0 113.381 -179.333 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 71.7 mt -85.55 -52.31 5.91 Favored 'General case' 0 C--N 1.34 0.185 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 174.463 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 61.9 t -89.77 -22.83 6.32 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 124.523 1.129 . . . . 0.0 110.337 176.075 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.3 mpt_? 68.58 62.74 0.34 Allowed 'General case' 0 C--N 1.342 0.249 0 C-N-CA 125.939 1.696 . . . . 0.0 109.419 -173.476 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.66 163.09 39.37 Favored 'General case' 0 C--N 1.339 0.114 0 C-N-CA 123.786 0.835 . . . . 0.0 110.875 172.813 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 96.9 m95 -84.56 118.68 24.49 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 124.027 0.931 . . . . 0.0 109.432 175.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 87.8 t . . . . . 0 N--CA 1.454 -0.274 0 N-CA-C 107.33 -1.359 . . . . 0.0 107.33 177.676 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 57.3 p-80 . . . . . 0 N--CA 1.455 -0.184 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.7 t-105 -75.06 116.59 15.97 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.106 0.562 . . . . 0.0 110.46 -177.255 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -89.75 104.05 16.65 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 107.526 -1.287 . . . . 0.0 107.526 169.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 59.4 tp -65.82 -25.06 67.05 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.852 1.261 . . . . 0.0 112.214 -179.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 69.8 mt -61.07 -56.24 23.3 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.232 0.613 . . . . 0.0 110.749 -177.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 57.9 t -89.55 -24.5 5.88 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 C-N-CA 124.242 1.017 . . . . 0.0 110.473 179.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 71.8 mtt85 74.03 60.57 0.08 Allowed 'General case' 0 C--N 1.342 0.262 0 C-N-CA 126.225 1.81 . . . . 0.0 110.11 -179.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.62 162.19 41.13 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 124.15 0.98 . . . . 0.0 110.477 173.309 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -83.94 118.94 24.33 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.946 0.899 . . . . 0.0 109.328 174.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 98.1 t . . . . . 0 N--CA 1.452 -0.366 0 N-CA-C 107.178 -1.416 . . . . 0.0 107.178 178.838 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 57.1 p-80 . . . . . 0 N--CA 1.456 -0.175 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 60.4 t-105 -80.47 121.76 26.15 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 122.424 0.289 . . . . 0.0 110.28 -178.21 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -89.85 111.93 23.12 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 171.759 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 51.4 mt -64.92 -32.04 73.56 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.791 1.236 . . . . 0.0 112.124 179.162 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 73.1 mt -59.53 -53.48 57.63 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.515 0.726 . . . . 0.0 111.139 -173.541 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 61.6 t -89.47 -24.78 5.81 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 C-N-CA 123.999 0.92 . . . . 0.0 110.364 178.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 86.6 mtm180 73.92 58.08 0.09 Allowed 'General case' 0 C--N 1.344 0.332 0 C-N-CA 126.078 1.751 . . . . 0.0 109.707 -179.042 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.84 167.51 27.27 Favored 'General case' 0 C--N 1.339 0.138 0 C-N-CA 124.009 0.924 . . . . 0.0 110.871 175.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -75.38 142.32 43.12 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 123.239 0.616 . . . . 0.0 109.838 170.203 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 79.4 t . . . . . 0 N--CA 1.453 -0.294 0 N-CA-C 106.947 -1.501 . . . . 0.0 106.947 175.585 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 57.2 p-80 . . . . . 0 N--CA 1.455 -0.179 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.5 t-105 -77.19 115.28 16.84 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 123.124 0.57 . . . . 0.0 110.106 -179.092 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -89.65 103.11 15.79 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 170.301 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 60.1 tp -65.59 -29.05 69.6 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.925 1.29 . . . . 0.0 112.045 -179.342 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -57.39 -53.07 62.27 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.607 0.763 . . . . 0.0 110.705 -176.721 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 59.1 t -89.39 -26.25 5.48 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 C-N-CA 123.879 0.872 . . . . 0.0 110.407 177.75 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 74.03 60.15 0.08 Allowed 'General case' 0 C--N 1.342 0.244 0 C-N-CA 126.36 1.864 . . . . 0.0 110.069 -175.75 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.61 162.58 40.37 Favored 'General case' 0 C--O 1.231 0.128 0 C-N-CA 123.696 0.798 . . . . 0.0 110.771 173.064 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 92.1 m95 -83.89 120.42 26.05 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 123.735 0.814 . . . . 0.0 109.371 174.292 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 84.8 t . . . . . 0 N--CA 1.453 -0.32 0 N-CA-C 106.933 -1.506 . . . . 0.0 106.933 176.999 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 51.1 p-80 . . . . . 0 N--CA 1.457 -0.094 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 75.8 t-105 -75.75 116.64 16.66 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.233 0.613 . . . . 0.0 110.353 -177.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -89.72 105.76 18.01 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 169.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 60.5 tp -67.97 -29.52 68.59 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.72 1.208 . . . . 0.0 112.103 -177.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -58.21 -51.84 68.06 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.541 0.736 . . . . 0.0 110.618 -176.175 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 81.1 t -89.69 -26.28 5.42 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 C-N-CA 124.303 1.041 . . . . 0.0 110.511 177.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 76.4 mtp180 75.1 59.79 0.06 Allowed 'General case' 0 C--N 1.341 0.219 0 C-N-CA 125.88 1.672 . . . . 0.0 110.491 -178.214 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -151.03 167.78 26.59 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 123.821 0.848 . . . . 0.0 110.693 174.124 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 96.5 m95 -86.77 120.33 27.96 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.96 0.904 . . . . 0.0 109.242 173.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 94.9 t . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 107.139 -1.43 . . . . 0.0 107.139 176.108 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 53.9 p-80 . . . . . 0 N--CA 1.455 -0.187 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 73.1 t-105 -80.7 110.69 16.44 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 123.167 0.587 . . . . 0.0 109.977 -179.605 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -89.62 91.98 8.89 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 171.574 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -61.52 -27.05 68.33 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.514 1.126 . . . . 0.0 113.126 177.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 65.3 tp -55.55 -52.95 62.0 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 124.739 1.216 . . . . 0.0 111.035 -177.22 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 58.3 t -89.16 -25.33 5.73 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 C-N-CA 123.617 0.767 . . . . 0.0 109.417 174.651 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 27.0 ttm180 83.37 52.46 0.01 OUTLIER 'General case' 0 C--N 1.342 0.243 0 C-N-CA 126.462 1.905 . . . . 0.0 109.822 175.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.76 166.89 29.06 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 124.34 1.056 . . . . 0.0 110.636 177.249 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 96.6 m95 -80.98 142.51 33.37 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 123.321 0.648 . . . . 0.0 109.654 171.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 97.8 t . . . . . 0 N--CA 1.454 -0.245 0 N-CA-C 107.422 -1.325 . . . . 0.0 107.422 178.926 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 56.5 p-80 . . . . . 0 N--CA 1.456 -0.164 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 75.1 t-105 -74.22 141.51 45.42 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 122.51 0.324 . . . . 0.0 110.626 -179.121 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -125.67 105.92 9.35 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 124.846 1.259 . . . . 0.0 107.723 170.503 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -67.24 -37.83 84.2 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.87 1.268 . . . . 0.0 110.806 178.125 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 65.6 mt -47.53 -49.16 26.93 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 125.372 1.469 . . . . 0.0 111.82 -173.741 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.647 ' O ' ' CB ' ' A' ' 30' ' ' ARG . 82.7 t -89.42 -45.9 15.28 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 171.402 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.647 ' CB ' ' O ' ' A' ' 29' ' ' VAL . 64.7 ttt180 103.41 52.4 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 177.4 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.91 166.85 29.36 Favored 'General case' 0 C--N 1.339 0.138 0 C-N-CA 124.211 1.004 . . . . 0.0 111.012 -179.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 87.4 m95 -86.66 125.19 33.69 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.939 0.896 . . . . 0.0 109.212 171.195 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 97.2 t . . . . . 0 N--CA 1.453 -0.293 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 177.222 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 53.3 p-80 . . . . . 0 N--CA 1.454 -0.264 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.0 t-105 -79.15 115.16 18.64 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 178.082 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -89.59 97.97 11.5 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 171.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.7 pp -68.47 -20.47 64.62 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.521 1.128 . . . . 0.0 113.043 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 66.2 tp -60.72 -54.2 48.13 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.525 0.73 . . . . 0.0 110.339 -178.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 85.6 t -89.46 -28.64 5.12 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 C-N-CA 123.967 0.907 . . . . 0.0 109.938 177.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 63.6 mtm180 84.88 55.93 0.01 OUTLIER 'General case' 0 C--N 1.343 0.295 0 C-N-CA 127.567 2.347 . . . . 0.0 110.004 176.586 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -151.01 173.63 14.09 Favored 'General case' 0 N--CA 1.457 -0.076 0 C-N-CA 124.368 1.067 . . . . 0.0 110.117 176.388 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -85.5 140.57 30.56 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 123.462 0.705 . . . . 0.0 109.557 172.099 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 84.2 t . . . . . 0 N--CA 1.454 -0.257 0 C-N-CA 125.213 1.405 . . . . 0.0 107.36 178.5 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 28.5 p-80 . . . . . 0 N--CA 1.456 -0.14 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 74.1 t-105 -79.92 113.8 18.36 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 178.403 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -89.59 96.58 10.76 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 107.432 -1.321 . . . . 0.0 107.432 171.624 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.14 -12.59 61.17 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.437 1.095 . . . . 0.0 113.545 178.624 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.8 tt -63.69 -57.66 9.33 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 179.493 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 57.7 t -89.24 -23.62 6.19 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 C-N-CA 124.131 0.972 . . . . 0.0 110.086 177.282 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 87.2 mtt-85 73.51 60.16 0.09 Allowed 'General case' 0 C--N 1.341 0.209 0 C-N-CA 126.306 1.842 . . . . 0.0 110.071 -176.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.6 165.83 32.12 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.468 1.107 . . . . 0.0 109.958 172.464 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -83.44 137.3 33.97 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 123.762 0.825 . . . . 0.0 109.783 176.124 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 86.9 t . . . . . 0 N--CA 1.455 -0.19 0 C-N-CA 124.951 1.3 . . . . 0.0 108.744 -176.96 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 57.3 p-80 . . . . . 0 N--CA 1.455 -0.211 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 73.7 t-105 -76.32 116.63 17.18 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 122.748 0.419 . . . . 0.0 110.542 -176.676 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -89.84 108.57 19.78 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 169.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -79.92 0.84 29.66 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.182 0.993 . . . . 0.0 113.647 -178.521 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 74.0 mt -77.73 -55.5 5.29 Favored 'General case' 0 C--N 1.34 0.183 0 N-CA-C 108.744 -0.835 . . . . 0.0 108.744 175.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 87.2 t -89.61 -17.75 8.0 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 125.134 1.374 . . . . 0.0 110.535 178.005 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 65.95 60.8 0.66 Allowed 'General case' 0 C--N 1.343 0.322 0 C-N-CA 125.626 1.571 . . . . 0.0 110.385 178.929 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -151.0 170.36 19.55 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.607 1.163 . . . . 0.0 110.413 175.041 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 98.0 m95 -87.17 120.82 28.85 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 124.033 0.933 . . . . 0.0 109.398 173.672 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 94.3 t . . . . . 0 N--CA 1.453 -0.292 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 175.256 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 57.1 p-80 . . . . . 0 N--CA 1.456 -0.154 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 74.6 t-105 -76.95 110.26 11.44 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 123.007 0.523 . . . . 0.0 110.41 -177.148 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -89.6 97.87 11.44 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 107.076 -1.454 . . . . 0.0 107.076 169.598 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 8.3 tt -65.41 -33.28 75.57 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.606 1.162 . . . . 0.0 111.322 178.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -50.15 -49.33 52.5 Favored 'General case' 0 C--N 1.342 0.242 0 C-N-CA 125.307 1.443 . . . . 0.0 111.238 -175.216 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.665 ' O ' ' CB ' ' A' ' 30' ' ' ARG . 90.3 t -89.22 -45.62 15.38 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 171.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.665 ' CB ' ' O ' ' A' ' 29' ' ' VAL . 62.3 ttt180 106.57 52.08 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 123.372 0.669 . . . . 0.0 109.244 175.433 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.98 162.52 40.67 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 123.959 0.903 . . . . 0.0 111.242 179.783 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 96.1 m95 -83.09 118.13 23.34 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 124.011 0.924 . . . . 0.0 109.331 173.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 89.1 t . . . . . 0 N--CA 1.454 -0.248 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 177.728 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 54.6 p-80 . . . . . 0 N--CA 1.454 -0.264 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.8 t-105 -75.35 115.17 14.72 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 179.701 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -89.42 102.23 14.9 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 170.792 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 61.6 tp -64.13 -34.03 77.14 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.821 1.249 . . . . 0.0 111.964 -177.302 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 65.2 tp -53.46 -54.79 31.87 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.04 0.936 . . . . 0.0 111.357 -177.01 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 88.2 t -89.85 -25.59 5.54 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 C-N-CA 124.087 0.955 . . . . 0.0 110.654 179.087 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 68.2 mtp85 74.72 60.45 0.07 Allowed 'General case' 0 C--N 1.341 0.198 0 C-N-CA 125.968 1.707 . . . . 0.0 110.668 -177.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -151.11 166.4 30.92 Favored 'General case' 0 N--CA 1.457 -0.108 0 C-N-CA 123.747 0.819 . . . . 0.0 110.615 173.04 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 96.9 m95 -87.4 114.67 24.22 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 124.048 0.939 . . . . 0.0 109.246 175.576 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 92.2 t . . . . . 0 N--CA 1.453 -0.303 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 178.98 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.075 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 72.5 m -68.32 95.72 0.62 Allowed 'General case' 0 C--N 1.339 0.122 0 C-N-CA 124.819 1.248 . . . . 0.0 110.392 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 55.4 p-80 -113.65 143.1 45.16 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 124.728 1.211 . . . . 0.0 109.14 176.076 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.5 t-105 -75.96 112.47 12.42 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 122.77 0.428 . . . . 0.0 110.179 -179.145 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -89.64 98.31 11.69 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 170.014 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -67.62 -15.85 63.86 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.492 1.117 . . . . 0.0 113.487 178.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 57.9 mt -64.73 -52.44 57.07 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 118.522 0.601 . . . . 0.0 110.001 -178.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 76.3 t -89.48 -31.79 5.47 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 C-N-CA 124.306 1.042 . . . . 0.0 109.664 176.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 66.5 mtm180 85.86 58.17 0.01 OUTLIER 'General case' 0 C--N 1.344 0.331 0 C-N-CA 127.821 2.448 . . . . 0.0 109.854 178.22 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -151.0 167.29 28.07 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 124.093 0.957 . . . . 0.0 110.843 176.302 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 96.6 m95 -87.4 116.22 25.35 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 124.073 0.949 . . . . 0.0 109.242 174.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 94.1 t -99.68 109.68 25.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 178.553 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 73.0 m -99.66 76.09 1.97 Allowed 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 124.567 1.147 . . . . 0.0 109.044 -177.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.336 0.006 0 CA-C-N 116.165 -0.471 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 -0.006 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 72.1 m -67.44 98.75 0.68 Allowed 'General case' 0 C--N 1.339 0.138 0 C-N-CA 124.596 1.158 . . . . 0.0 110.485 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 57.3 p-80 -116.15 139.25 50.52 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 124.614 1.165 . . . . 0.0 108.995 175.105 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 77.0 t-105 -75.91 117.93 18.16 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 122.967 0.507 . . . . 0.0 110.235 -177.353 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -89.66 110.22 21.12 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 173.106 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 41.6 mt -61.78 -37.33 83.94 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.915 1.286 . . . . 0.0 112.02 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 64.8 tp -54.83 -55.2 32.82 Favored 'General case' 0 C--N 1.341 0.235 0 C-N-CA 123.962 0.905 . . . . 0.0 111.523 -174.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 57.5 t -89.71 -28.03 5.14 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 C-N-CA 123.899 0.88 . . . . 0.0 110.557 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 75.0 mtp180 74.13 60.69 0.08 Allowed 'General case' 0 C--N 1.34 0.175 0 C-N-CA 125.414 1.486 . . . . 0.0 109.955 -174.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.7 162.96 39.69 Favored 'General case' 0 CA--C 1.528 0.114 0 C-N-CA 123.708 0.803 . . . . 0.0 110.774 173.531 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -82.19 118.34 23.01 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.946 0.898 . . . . 0.0 109.583 175.028 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 90.5 t -99.69 105.86 18.17 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.306 0 N-CA-C 107.174 -1.417 . . . . 0.0 107.174 176.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 68.7 m -99.61 74.56 1.88 Allowed 'General case' 0 N--CA 1.456 -0.132 0 C-N-CA 124.443 1.097 . . . . 0.0 109.032 -176.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.078 0 CA-C-N 116.19 -0.459 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.061 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 72.9 m -76.59 154.63 34.25 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 123.262 0.625 . . . . 0.0 110.323 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 29.1 p-80 -99.99 150.02 22.86 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 124.267 1.027 . . . . 0.0 108.877 172.068 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 74.0 t-105 -79.44 114.45 18.38 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 178.33 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -89.54 97.82 11.41 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 107.289 -1.375 . . . . 0.0 107.289 170.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 6.6 tt -67.79 -23.0 65.16 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.738 1.215 . . . . 0.0 112.225 -178.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 9.5 mp -57.6 -55.52 33.79 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.568 0.747 . . . . 0.0 110.046 -178.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 60.5 t -89.53 -25.58 5.6 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 124.112 0.965 . . . . 0.0 110.339 178.058 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 71.6 mtt85 75.75 58.92 0.05 Allowed 'General case' 0 C--N 1.343 0.283 0 C-N-CA 126.577 1.951 . . . . 0.0 109.942 -177.601 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.6 165.12 34.31 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 124.305 1.042 . . . . 0.0 110.172 172.773 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -83.5 137.43 33.88 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 123.828 0.851 . . . . 0.0 109.801 175.769 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 90.8 t -134.66 123.17 41.16 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.182 0 C-N-CA 124.954 1.302 . . . . 0.0 108.791 -176.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 7.4 m -99.35 81.41 2.53 Favored 'General case' 0 CA--C 1.529 0.152 0 N-CA-C 107.167 -1.42 . . . . 0.0 107.167 173.212 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.038 0 CA-C-N 116.428 -0.351 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.078 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 83.3 m -77.55 154.07 32.73 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 123.289 0.636 . . . . 0.0 110.238 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 32.2 p-80 -99.88 149.36 23.48 Favored 'General case' 0 C--N 1.339 0.121 0 C-N-CA 124.203 1.001 . . . . 0.0 108.781 172.017 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.5 t-105 -79.64 114.88 18.9 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 178.428 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -89.62 97.63 11.3 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 170.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 63.9 tp -63.6 -28.91 70.25 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 125.116 1.367 . . . . 0.0 111.814 178.578 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 66.6 mt -54.06 -51.92 62.56 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.099 0.96 . . . . 0.0 111.237 -176.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 76.9 t -89.52 -34.31 6.67 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 C-N-CA 123.732 0.813 . . . . 0.0 109.811 175.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 72.6 mtm180 87.63 56.28 0.01 OUTLIER 'General case' 0 C--N 1.343 0.307 0 C-N-CA 128.041 2.536 . . . . 0.0 109.307 -176.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.75 165.79 32.42 Favored 'General case' 0 C--N 1.34 0.171 0 C-N-CA 123.707 0.803 . . . . 0.0 110.752 175.438 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -80.6 139.81 36.07 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 123.693 0.797 . . . . 0.0 109.912 174.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 91.3 t -136.28 121.82 28.46 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.227 0 C-N-CA 124.93 1.292 . . . . 0.0 108.597 -178.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.3 m -99.54 148.27 24.46 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 124.215 1.006 . . . . 0.0 108.388 171.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.096 0 O-C-N 122.327 -0.233 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 -0.018 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 71.7 m -67.32 100.12 0.78 Allowed 'General case' 0 N--CA 1.457 -0.112 0 C-N-CA 124.598 1.159 . . . . 0.0 110.476 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 56.9 p-80 -117.04 137.0 52.54 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 124.663 1.185 . . . . 0.0 108.928 175.028 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.9 t-105 -74.24 121.85 21.91 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 123.165 0.586 . . . . 0.0 110.493 -177.179 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -91.87 115.79 28.36 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 170.315 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 7.0 mp -69.54 -29.21 66.76 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.283 1.033 . . . . 0.0 111.674 -177.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 75.1 mt -63.65 -56.4 16.05 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.356 0.662 . . . . 0.0 110.861 -174.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 59.8 t -89.6 -22.42 6.48 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 124.09 0.956 . . . . 0.0 110.519 -178.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 75.3 mtt85 70.8 59.91 0.2 Allowed 'General case' 0 C--N 1.341 0.228 0 C-N-CA 125.273 1.429 . . . . 0.0 110.018 179.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.59 163.31 38.79 Favored 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 124.248 1.019 . . . . 0.0 110.459 174.665 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 97.3 m95 -84.02 119.98 25.59 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 123.979 0.912 . . . . 0.0 109.4 174.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 88.8 t -99.46 103.84 15.27 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 N-CA-C 106.977 -1.49 . . . . 0.0 106.977 178.439 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 65.2 m -99.42 74.27 1.9 Allowed 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 124.46 1.104 . . . . 0.0 109.189 -176.309 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.088 0 CA-C-N 116.16 -0.473 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.064 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 73.8 m -76.6 154.63 34.23 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.321 0.648 . . . . 0.0 110.313 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 30.0 p-80 -99.96 149.82 23.05 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.271 1.028 . . . . 0.0 108.718 171.456 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.5 t-105 -81.23 117.4 21.72 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 178.652 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -89.53 107.53 19.13 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 176.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 44.2 mt -67.86 -22.94 65.1 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.081 1.352 . . . . 0.0 112.573 -179.216 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 9.6 mp -63.66 -43.06 97.85 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.292 0.637 . . . . 0.0 110.826 -176.086 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 60.5 t -106.12 -23.36 4.48 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 C-N-CA 124.855 1.262 . . . . 0.0 111.096 -179.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 13.5 mtm-85 71.05 59.43 0.18 Allowed 'General case' 0 C--N 1.342 0.258 0 C-N-CA 126.338 1.855 . . . . 0.0 109.77 -174.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.59 167.28 27.73 Favored 'General case' 0 C--N 1.339 0.12 0 C-N-CA 124.211 1.004 . . . . 0.0 110.351 173.097 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -78.13 139.09 39.01 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 123.639 0.776 . . . . 0.0 110.181 175.302 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 85.2 t -137.15 121.72 24.07 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.195 0 C-N-CA 124.991 1.316 . . . . 0.0 108.599 179.246 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 6.6 m -99.27 81.62 2.58 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 107.214 -1.402 . . . . 0.0 107.214 173.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.048 0 CA-C-N 116.435 -0.348 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.092 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 9.3 m -139.89 157.67 45.32 Favored 'General case' 0 C--N 1.34 0.157 0 C-N-CA 124.079 0.952 . . . . 0.0 109.93 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 56.7 p-80 -133.41 142.78 48.52 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 124.246 1.019 . . . . 0.0 109.3 176.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.4 t-105 -77.62 113.99 16.01 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 123.167 0.587 . . . . 0.0 109.981 -179.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -89.66 99.86 12.78 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 107.436 -1.32 . . . . 0.0 107.436 171.16 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.21 -13.51 62.45 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.468 1.107 . . . . 0.0 113.698 -179.529 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 66.9 tp -66.55 -55.64 14.53 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 118.535 0.607 . . . . 0.0 109.756 179.315 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 58.2 t -89.45 -23.31 6.24 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 C-N-CA 124.238 1.015 . . . . 0.0 110.054 178.173 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 74.9 mtt85 73.48 60.23 0.09 Allowed 'General case' 0 C--N 1.341 0.237 0 C-N-CA 126.359 1.864 . . . . 0.0 109.918 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.56 162.8 39.92 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.306 1.042 . . . . 0.0 110.45 173.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 91.2 m95 -84.0 119.82 25.38 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.779 0.832 . . . . 0.0 109.399 174.39 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 86.3 t -99.52 111.67 29.77 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 N-CA-C 107.027 -1.472 . . . . 0.0 107.027 177.443 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 94.9 m -99.87 147.48 25.48 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 124.552 1.141 . . . . 0.0 110.824 -175.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.031 0 CA-C-N 116.57 -0.287 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.126 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 9.2 m -140.3 158.03 44.66 Favored 'General case' 0 C--N 1.34 0.175 0 C-N-CA 124.071 0.948 . . . . 0.0 109.891 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 55.9 p-80 -132.19 143.17 49.77 Favored 'General case' 0 N--CA 1.456 -0.138 0 C-N-CA 124.209 1.004 . . . . 0.0 109.226 175.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 74.2 t-105 -78.77 110.44 13.94 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 123.197 0.599 . . . . 0.0 110.204 -177.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -89.8 96.0 10.49 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 170.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 8.3 tt -63.02 -33.26 75.04 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.705 1.202 . . . . 0.0 111.54 178.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -52.35 -50.07 63.06 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.029 1.331 . . . . 0.0 111.116 -175.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 73.7 t -89.28 -32.13 5.62 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 C-N-CA 123.567 0.747 . . . . 0.0 109.44 174.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 38.6 ttp180 90.63 51.71 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 126.154 1.782 . . . . 0.0 109.719 177.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.83 163.75 37.89 Favored 'General case' 0 C--N 1.34 0.184 0 C-N-CA 123.49 0.716 . . . . 0.0 111.455 178.139 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 88.8 m95 -83.81 122.18 28.33 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.984 0.914 . . . . 0.0 109.321 172.294 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 93.9 t -99.84 110.93 28.08 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 175.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 99.5 m -99.8 147.57 25.34 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 124.574 1.15 . . . . 0.0 110.819 -175.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.336 0.008 0 CA-C-N 116.557 -0.292 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.228 -0.027 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 72.5 m -67.42 98.56 0.66 Allowed 'General case' 0 N--CA 1.457 -0.103 0 C-N-CA 124.664 1.185 . . . . 0.0 110.477 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 57.3 p-80 -115.92 140.32 49.36 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 124.559 1.143 . . . . 0.0 109.03 175.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 77.0 t-105 -76.26 114.7 15.24 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.04 0.536 . . . . 0.0 110.426 -177.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -89.71 105.56 17.88 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 107.694 -1.224 . . . . 0.0 107.694 170.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -81.04 10.42 5.21 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.511 1.124 . . . . 0.0 113.381 -179.333 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 71.7 mt -85.55 -52.31 5.91 Favored 'General case' 0 C--N 1.34 0.185 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 174.463 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 61.9 t -89.77 -22.83 6.32 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 124.523 1.129 . . . . 0.0 110.337 176.075 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.3 mpt_? 68.58 62.74 0.34 Allowed 'General case' 0 C--N 1.342 0.249 0 C-N-CA 125.939 1.696 . . . . 0.0 109.419 -173.476 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.66 163.09 39.37 Favored 'General case' 0 C--N 1.339 0.114 0 C-N-CA 123.786 0.835 . . . . 0.0 110.875 172.813 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 96.9 m95 -84.56 118.68 24.49 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 124.027 0.931 . . . . 0.0 109.432 175.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 87.8 t -99.6 106.39 18.97 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 N-CA-C 107.33 -1.359 . . . . 0.0 107.33 177.676 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 69.6 m -99.5 74.46 1.9 Allowed 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 124.518 1.127 . . . . 0.0 109.126 -177.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.336 -0.016 0 CA-C-N 116.151 -0.477 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 -0.025 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 72.2 m -67.36 99.27 0.71 Allowed 'General case' 0 C--N 1.34 0.153 0 C-N-CA 124.663 1.185 . . . . 0.0 110.351 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 57.3 p-80 -116.36 138.97 50.91 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 124.587 1.155 . . . . 0.0 109.024 175.219 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.7 t-105 -75.06 116.59 15.97 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.106 0.562 . . . . 0.0 110.46 -177.255 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -89.75 104.05 16.65 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 107.526 -1.287 . . . . 0.0 107.526 169.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 59.4 tp -65.82 -25.06 67.05 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.852 1.261 . . . . 0.0 112.214 -179.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 69.8 mt -61.07 -56.24 23.3 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.232 0.613 . . . . 0.0 110.749 -177.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 57.9 t -89.55 -24.5 5.88 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 C-N-CA 124.242 1.017 . . . . 0.0 110.473 179.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 71.8 mtt85 74.03 60.57 0.08 Allowed 'General case' 0 C--N 1.342 0.262 0 C-N-CA 126.225 1.81 . . . . 0.0 110.11 -179.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.62 162.19 41.13 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 124.15 0.98 . . . . 0.0 110.477 173.309 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -83.94 118.94 24.33 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.946 0.899 . . . . 0.0 109.328 174.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 98.1 t -99.53 105.44 17.49 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 N-CA-C 107.178 -1.416 . . . . 0.0 107.178 178.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 67.1 m -99.5 74.37 1.89 Allowed 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 124.476 1.111 . . . . 0.0 109.152 -176.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.051 0 CA-C-N 116.167 -0.469 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.065 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 72.4 m -68.9 96.23 0.75 Allowed 'General case' 0 N--CA 1.457 -0.108 0 C-N-CA 124.761 1.224 . . . . 0.0 110.396 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 57.1 p-80 -114.67 142.42 46.5 Favored 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 125.01 1.324 . . . . 0.0 108.516 174.638 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 60.4 t-105 -80.47 121.76 26.15 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 122.424 0.289 . . . . 0.0 110.28 -178.21 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -89.85 111.93 23.12 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 171.759 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 51.4 mt -64.92 -32.04 73.56 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.791 1.236 . . . . 0.0 112.124 179.162 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 73.1 mt -59.53 -53.48 57.63 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.515 0.726 . . . . 0.0 111.139 -173.541 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 61.6 t -89.47 -24.78 5.81 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 C-N-CA 123.999 0.92 . . . . 0.0 110.364 178.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 86.6 mtm180 73.92 58.08 0.09 Allowed 'General case' 0 C--N 1.344 0.332 0 C-N-CA 126.078 1.751 . . . . 0.0 109.707 -179.042 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.84 167.51 27.27 Favored 'General case' 0 C--N 1.339 0.138 0 C-N-CA 124.009 0.924 . . . . 0.0 110.871 175.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -75.38 142.32 43.12 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 123.239 0.616 . . . . 0.0 109.838 170.203 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 79.4 t -127.92 105.6 13.72 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 N-CA-C 106.947 -1.501 . . . . 0.0 106.947 175.585 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 68.7 m -99.59 75.59 1.95 Allowed 'General case' 0 N--CA 1.457 -0.12 0 C-N-CA 124.527 1.131 . . . . 0.0 109.079 -176.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.058 0 CA-C-N 116.251 -0.432 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.083 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 9.0 m -140.08 157.6 45.38 Favored 'General case' 0 C--N 1.34 0.162 0 C-N-CA 124.08 0.952 . . . . 0.0 109.95 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 57.2 p-80 -132.75 142.23 48.92 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 124.253 1.021 . . . . 0.0 109.217 176.413 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.5 t-105 -77.19 115.28 16.84 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 123.124 0.57 . . . . 0.0 110.106 -179.092 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -89.65 103.11 15.79 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 170.301 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 60.1 tp -65.59 -29.05 69.6 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.925 1.29 . . . . 0.0 112.045 -179.342 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -57.39 -53.07 62.27 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.607 0.763 . . . . 0.0 110.705 -176.721 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 59.1 t -89.39 -26.25 5.48 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 C-N-CA 123.879 0.872 . . . . 0.0 110.407 177.75 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 74.03 60.15 0.08 Allowed 'General case' 0 C--N 1.342 0.244 0 C-N-CA 126.36 1.864 . . . . 0.0 110.069 -175.75 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.61 162.58 40.37 Favored 'General case' 0 C--O 1.231 0.128 0 C-N-CA 123.696 0.798 . . . . 0.0 110.771 173.064 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 92.1 m95 -83.89 120.42 26.05 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 123.735 0.814 . . . . 0.0 109.371 174.292 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 84.8 t -99.51 111.18 28.42 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 N-CA-C 106.933 -1.506 . . . . 0.0 106.933 176.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 92.7 m -99.82 147.56 25.36 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 124.608 1.163 . . . . 0.0 110.921 -174.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.068 0 CA-C-N 116.651 -0.25 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.048 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 18.8 m -78.43 151.48 32.68 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 123.105 0.562 . . . . 0.0 109.644 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 51.1 p-80 -121.23 137.66 54.58 Favored 'General case' 0 N--CA 1.457 -0.094 0 C-N-CA 124.271 1.028 . . . . 0.0 109.655 -179.648 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 75.8 t-105 -75.75 116.64 16.66 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.233 0.613 . . . . 0.0 110.353 -177.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -89.72 105.76 18.01 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 169.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 60.5 tp -67.97 -29.52 68.59 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.72 1.208 . . . . 0.0 112.103 -177.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -58.21 -51.84 68.06 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.541 0.736 . . . . 0.0 110.618 -176.175 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 81.1 t -89.69 -26.28 5.42 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 C-N-CA 124.303 1.041 . . . . 0.0 110.511 177.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 76.4 mtp180 75.1 59.79 0.06 Allowed 'General case' 0 C--N 1.341 0.219 0 C-N-CA 125.88 1.672 . . . . 0.0 110.491 -178.214 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -151.03 167.78 26.59 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 123.821 0.848 . . . . 0.0 110.693 174.124 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 96.5 m95 -86.77 120.33 27.96 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.96 0.904 . . . . 0.0 109.242 173.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 94.9 t -99.68 113.45 34.99 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 N-CA-C 107.139 -1.43 . . . . 0.0 107.139 176.108 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 75.4 m -99.81 153.16 19.35 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.576 1.15 . . . . 0.0 110.025 -177.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.336 -0.02 0 O-C-N 122.273 -0.267 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 0.023 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 72.1 m -70.61 90.97 0.77 Allowed 'General case' 0 C--N 1.339 0.135 0 C-N-CA 124.989 1.316 . . . . 0.0 110.34 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 53.9 p-80 -108.9 148.62 30.37 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 124.868 1.267 . . . . 0.0 109.391 177.022 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 73.1 t-105 -80.7 110.69 16.44 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 123.167 0.587 . . . . 0.0 109.977 -179.605 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -89.62 91.98 8.89 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 171.574 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -61.52 -27.05 68.33 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.514 1.126 . . . . 0.0 113.126 177.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 65.3 tp -55.55 -52.95 62.0 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 124.739 1.216 . . . . 0.0 111.035 -177.22 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 58.3 t -89.16 -25.33 5.73 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 C-N-CA 123.617 0.767 . . . . 0.0 109.417 174.651 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 27.0 ttm180 83.37 52.46 0.01 OUTLIER 'General case' 0 C--N 1.342 0.243 0 C-N-CA 126.462 1.905 . . . . 0.0 109.822 175.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.76 166.89 29.06 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 124.34 1.056 . . . . 0.0 110.636 177.249 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 96.6 m95 -80.98 142.51 33.37 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 123.321 0.648 . . . . 0.0 109.654 171.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 97.8 t -130.18 112.03 22.55 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.245 0 N-CA-C 107.422 -1.325 . . . . 0.0 107.422 178.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 83.1 m -99.56 81.93 2.57 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 124.592 1.157 . . . . 0.0 109.097 -178.614 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.037 0 CA-C-N 116.213 -0.449 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.129 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 10.0 m -140.55 158.03 44.6 Favored 'General case' 0 C--N 1.34 0.163 0 C-N-CA 124.015 0.926 . . . . 0.0 109.98 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 56.5 p-80 -133.54 144.6 49.46 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 124.346 1.058 . . . . 0.0 108.855 174.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 75.1 t-105 -74.22 141.51 45.42 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 122.51 0.324 . . . . 0.0 110.626 -179.121 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -125.67 105.92 9.35 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 124.846 1.259 . . . . 0.0 107.723 170.503 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -67.24 -37.83 84.2 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.87 1.268 . . . . 0.0 110.806 178.125 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 65.6 mt -47.53 -49.16 26.93 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 125.372 1.469 . . . . 0.0 111.82 -173.741 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.647 ' O ' ' CB ' ' A' ' 30' ' ' ARG . 82.7 t -89.42 -45.9 15.28 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 171.402 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.647 ' CB ' ' O ' ' A' ' 29' ' ' VAL . 64.7 ttt180 103.41 52.4 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 177.4 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.91 166.85 29.36 Favored 'General case' 0 C--N 1.339 0.138 0 C-N-CA 124.211 1.004 . . . . 0.0 111.012 -179.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 87.4 m95 -86.66 125.19 33.69 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.939 0.896 . . . . 0.0 109.212 171.195 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 97.2 t -99.69 109.03 23.77 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 177.222 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 95.6 m -99.88 147.62 25.34 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 124.427 1.091 . . . . 0.0 110.752 -175.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.336 -0.01 0 CA-C-N 116.579 -0.282 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.092 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 73.1 m -71.83 88.51 1.02 Allowed 'General case' 0 C--N 1.34 0.161 0 C-N-CA 125.15 1.38 . . . . 0.0 110.288 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 53.3 p-80 -106.87 150.04 26.8 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 124.944 1.297 . . . . 0.0 109.3 177.108 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.0 t-105 -79.15 115.16 18.64 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 178.082 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -89.59 97.97 11.5 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 171.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.7 pp -68.47 -20.47 64.62 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.521 1.128 . . . . 0.0 113.043 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 66.2 tp -60.72 -54.2 48.13 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.525 0.73 . . . . 0.0 110.339 -178.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 85.6 t -89.46 -28.64 5.12 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 C-N-CA 123.967 0.907 . . . . 0.0 109.938 177.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 63.6 mtm180 84.88 55.93 0.01 OUTLIER 'General case' 0 C--N 1.343 0.295 0 C-N-CA 127.567 2.347 . . . . 0.0 110.004 176.586 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -151.01 173.63 14.09 Favored 'General case' 0 N--CA 1.457 -0.076 0 C-N-CA 124.368 1.067 . . . . 0.0 110.117 176.388 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -85.5 140.57 30.56 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 123.462 0.705 . . . . 0.0 109.557 172.099 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 84.2 t -129.66 114.01 29.22 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 C-N-CA 125.213 1.405 . . . . 0.0 107.36 178.5 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 80.9 m -99.56 85.92 3.24 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.611 1.165 . . . . 0.0 109.225 -178.179 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.336 -0.011 0 CA-C-N 116.223 -0.444 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.034 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 73.0 m -76.5 154.68 34.42 Favored 'General case' 0 CA--C 1.528 0.119 0 C-N-CA 123.218 0.607 . . . . 0.0 110.368 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 28.5 p-80 -99.92 150.18 22.66 Favored 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 124.3 1.04 . . . . 0.0 108.857 172.112 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 74.1 t-105 -79.92 113.8 18.36 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 178.403 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -89.59 96.58 10.76 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 107.432 -1.321 . . . . 0.0 107.432 171.624 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.14 -12.59 61.17 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.437 1.095 . . . . 0.0 113.545 178.624 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.8 tt -63.69 -57.66 9.33 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 179.493 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 57.7 t -89.24 -23.62 6.19 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 C-N-CA 124.131 0.972 . . . . 0.0 110.086 177.282 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 87.2 mtt-85 73.51 60.16 0.09 Allowed 'General case' 0 C--N 1.341 0.209 0 C-N-CA 126.306 1.842 . . . . 0.0 110.071 -176.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.6 165.83 32.12 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.468 1.107 . . . . 0.0 109.958 172.464 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -83.44 137.3 33.97 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 123.762 0.825 . . . . 0.0 109.783 176.124 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 86.9 t -134.8 123.24 40.77 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.19 0 C-N-CA 124.951 1.3 . . . . 0.0 108.744 -176.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 7.4 m -99.24 81.34 2.54 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 107.243 -1.392 . . . . 0.0 107.243 173.195 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.336 -0.003 0 CA-C-N 116.455 -0.339 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 0.005 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 71.6 m -67.73 98.55 0.72 Allowed 'General case' 0 C--N 1.34 0.165 0 C-N-CA 124.7 1.2 . . . . 0.0 110.42 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 57.3 p-80 -115.71 139.31 50.27 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 124.727 1.211 . . . . 0.0 108.737 174.449 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 73.7 t-105 -76.32 116.63 17.18 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 122.748 0.419 . . . . 0.0 110.542 -176.676 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -89.84 108.57 19.78 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 169.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -79.92 0.84 29.66 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.182 0.993 . . . . 0.0 113.647 -178.521 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 74.0 mt -77.73 -55.5 5.29 Favored 'General case' 0 C--N 1.34 0.183 0 N-CA-C 108.744 -0.835 . . . . 0.0 108.744 175.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 87.2 t -89.61 -17.75 8.0 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 125.134 1.374 . . . . 0.0 110.535 178.005 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 65.95 60.8 0.66 Allowed 'General case' 0 C--N 1.343 0.322 0 C-N-CA 125.626 1.571 . . . . 0.0 110.385 178.929 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -151.0 170.36 19.55 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.607 1.163 . . . . 0.0 110.413 175.041 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 98.0 m95 -87.17 120.82 28.85 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 124.033 0.933 . . . . 0.0 109.398 173.672 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 94.3 t -99.75 105.2 17.15 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 175.256 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 69.0 m -99.6 74.62 1.89 Allowed 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 124.504 1.122 . . . . 0.0 109.107 -177.283 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.037 0 CA-C-N 116.221 -0.445 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 -0.012 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 72.5 m -67.7 97.25 0.61 Allowed 'General case' 0 C--N 1.339 0.139 0 C-N-CA 124.779 1.231 . . . . 0.0 110.462 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 57.1 p-80 -114.77 141.85 47.31 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 124.659 1.183 . . . . 0.0 108.952 175.598 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 74.6 t-105 -76.95 110.26 11.44 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 123.007 0.523 . . . . 0.0 110.41 -177.148 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -89.6 97.87 11.44 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 107.076 -1.454 . . . . 0.0 107.076 169.598 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 8.3 tt -65.41 -33.28 75.57 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.606 1.162 . . . . 0.0 111.322 178.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -50.15 -49.33 52.5 Favored 'General case' 0 C--N 1.342 0.242 0 C-N-CA 125.307 1.443 . . . . 0.0 111.238 -175.216 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.665 ' O ' ' CB ' ' A' ' 30' ' ' ARG . 90.3 t -89.22 -45.62 15.38 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 171.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.665 ' CB ' ' O ' ' A' ' 29' ' ' VAL . 62.3 ttt180 106.57 52.08 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 123.372 0.669 . . . . 0.0 109.244 175.433 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.98 162.52 40.67 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 123.959 0.903 . . . . 0.0 111.242 179.783 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 96.1 m95 -83.09 118.13 23.34 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 124.011 0.924 . . . . 0.0 109.331 173.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 89.1 t -99.77 108.09 22.03 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.248 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 177.728 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 77.4 m -99.56 75.69 1.96 Allowed 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 124.537 1.135 . . . . 0.0 109.023 -178.054 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.03 0 CA-C-N 116.201 -0.454 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 0.015 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 72.3 m -68.93 94.13 0.61 Allowed 'General case' 0 C--N 1.338 0.101 0 C-N-CA 124.898 1.279 . . . . 0.0 110.317 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 54.6 p-80 -112.36 144.45 41.77 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 124.755 1.222 . . . . 0.0 109.236 176.535 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 76.8 t-105 -75.35 115.17 14.72 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 179.701 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -89.42 102.23 14.9 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 170.792 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 61.6 tp -64.13 -34.03 77.14 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.821 1.249 . . . . 0.0 111.964 -177.302 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 65.2 tp -53.46 -54.79 31.87 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.04 0.936 . . . . 0.0 111.357 -177.01 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 88.2 t -89.85 -25.59 5.54 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 C-N-CA 124.087 0.955 . . . . 0.0 110.654 179.087 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 68.2 mtp85 74.72 60.45 0.07 Allowed 'General case' 0 C--N 1.341 0.198 0 C-N-CA 125.968 1.707 . . . . 0.0 110.668 -177.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -151.11 166.4 30.92 Favored 'General case' 0 N--CA 1.457 -0.108 0 C-N-CA 123.747 0.819 . . . . 0.0 110.615 173.04 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 96.9 m95 -87.4 114.67 24.22 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 124.048 0.939 . . . . 0.0 109.246 175.576 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 92.2 t -99.66 110.76 27.54 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 178.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 71.4 m -99.58 76.62 2.02 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 124.585 1.154 . . . . 0.0 109.069 -177.667 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.056 0 CA-C-N 116.144 -0.48 . . . . 0.0 . . . . . . . . . . 0 0 . 1 stop_ save_