data_1m2s_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 1m2s _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 ' 3' ' ' LEU . . . . . . . . . . . . . 2.3 pt? . . . . . 0 N--CA 1.449 -0.492 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -136.14 167.38 24.68 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.171 0 N-CA-C 106.563 -1.644 . . . . 0.0 106.563 -164.342 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -129.68 88.38 2.67 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 122.193 0.997 . . . . 0.0 108.718 162.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 99.1 t -133.23 137.9 52.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 159.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.4 mptt -41.04 107.66 0.08 Allowed 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 127.217 2.207 . . . . 0.0 112.746 178.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -68.16 133.57 49.11 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 167.231 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -93.62 -15.07 25.74 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 158.154 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 176.25 155.91 0.23 Allowed 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 125.902 1.681 . . . . 0.0 107.832 -175.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 40.6 m -51.46 -39.62 57.83 Favored 'General case' 0 C--O 1.227 -0.12 0 C-N-CA 123.006 0.522 . . . . 0.0 111.724 171.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.9 p -62.8 -20.21 64.79 Favored 'General case' 0 N--CA 1.445 -0.716 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -178.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.25 -49.2 36.87 Favored 'General case' 0 C--O 1.218 -0.569 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 175.107 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 20.3 m -46.63 -29.64 1.94 Allowed 'General case' 0 CA--C 1.503 -0.853 0 C-N-CA 126.106 1.762 . . . . 0.0 110.138 178.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 31.5 m0 -63.59 -66.06 0.59 Allowed 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 176.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -51.37 -35.95 40.98 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 118.455 -0.783 . . . . 0.0 111.75 174.776 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.08 -57.05 11.92 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 120.243 1.383 . . . . 0.0 111.376 177.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 17.7 m -58.8 -33.78 70.75 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 122.232 1.015 . . . . 0.0 110.895 -179.531 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.5 mtmt -69.23 -42.78 75.22 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-N 115.178 -0.919 . . . . 0.0 113.143 175.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 41.7 mttm -54.28 -53.8 48.83 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.519 0.328 . . . . 0.0 110.359 174.317 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -62.78 -57.14 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 178.339 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 60.2 p -116.4 -57.24 2.22 Favored 'General case' 0 CA--C 1.522 -0.117 0 CA-C-O 121.185 0.517 . . . . 0.0 110.897 -169.136 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 130.29 -15.19 5.57 Favored Glycine 0 CA--C 1.532 1.136 0 CA-C-N 114.874 -1.057 . . . . 0.0 112.07 -161.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 58.0 p -79.11 63.28 3.73 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 118.659 1.229 . . . . 0.0 111.049 -171.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -69.0 2.3 8.8 Favored Glycine 0 CA--C 1.533 1.187 0 O-C-N 121.517 -0.739 . . . . 0.0 114.916 -164.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 30.8 mt-30 -85.93 105.52 16.46 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 119.158 1.479 . . . . 0.0 107.375 -177.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -158.45 -172.81 26.06 Favored Glycine 0 CA--C 1.524 0.645 0 CA-C-O 121.148 0.304 . . . . 0.0 112.908 -172.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 4.4 ttmm -159.84 143.34 14.24 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 125.398 1.479 . . . . 0.0 107.658 -174.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.39 151.43 22.05 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 177.41 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 56.7 tp60 -125.31 116.9 22.66 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 105.079 -2.193 . . . . 0.0 105.079 172.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 66.04 -82.37 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 118.911 0.778 . . . . 0.0 111.481 168.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -157.9 43.29 0.31 Allowed 'General case' 0 N--CA 1.444 -0.727 0 C-N-CA 128.423 2.689 . . . . 0.0 109.649 171.214 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 26.5 mp0 -141.65 178.42 7.48 Favored 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 128.006 2.522 . . . . 0.0 105.091 172.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -159.27 152.47 22.31 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 119.185 0.902 . . . . 0.0 110.16 -164.444 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 8.8 mtt180 -146.29 132.87 19.81 Favored 'General case' 0 C--O 1.227 -0.09 0 CA-C-O 118.415 -0.802 . . . . 0.0 110.087 -167.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -102.91 164.17 11.78 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 123.712 0.805 . . . . 0.0 111.225 168.273 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 71.4 t80 . . . . . 0 N--CA 1.451 -0.392 0 C-N-CA 126.816 2.046 . . . . 0.0 109.384 177.98 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.5 pt? . . . . . 0 N--CA 1.448 -0.57 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -136.87 178.25 5.08 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.018 0 N-CA-C 107.429 -1.322 . . . . 0.0 107.429 -166.421 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 49.6 t0 -130.19 102.29 6.16 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 154.301 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -130.97 148.31 33.06 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 N-CA-C 105.995 -1.854 . . . . 0.0 105.995 148.79 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 42.7 mttm -64.57 115.46 5.21 Favored 'General case' 0 N--CA 1.444 -0.735 0 C-N-CA 123.828 0.851 . . . . 0.0 110.866 -170.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -73.22 119.55 17.62 Favored 'General case' 0 CA--C 1.511 -0.536 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 175.296 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -79.79 -22.88 42.57 Favored 'General case' 0 N--CA 1.449 -0.496 0 O-C-N 125.495 1.747 . . . . 0.0 109.078 156.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 178.97 154.17 0.41 Allowed 'General case' 0 C--N 1.344 0.344 0 C-N-CA 125.405 1.482 . . . . 0.0 108.751 -175.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.0 m -52.79 -38.71 61.52 Favored 'General case' 0 C--O 1.231 0.105 0 C-N-CA 123.321 0.649 . . . . 0.0 112.38 171.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.31 -22.28 64.75 Favored 'General case' 0 N--CA 1.445 -0.68 0 C-N-CA 122.721 0.408 . . . . 0.0 111.925 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.07 -51.11 34.51 Favored 'General case' 0 C--O 1.22 -0.489 0 CA-C-O 121.329 0.585 . . . . 0.0 109.506 176.063 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 20.8 m -47.6 -28.61 2.41 Favored 'General case' 0 CA--C 1.51 -0.579 0 C-N-CA 126.361 1.864 . . . . 0.0 110.444 -179.122 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 27.0 m0 -61.79 -68.55 0.31 Allowed 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 173.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -50.99 -32.47 21.25 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 117.945 -1.026 . . . . 0.0 112.308 174.852 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.01 -51.19 67.78 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 120.88 1.673 . . . . 0.0 110.831 173.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 2.0 t -60.79 -35.84 77.48 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 121.444 0.64 . . . . 0.0 109.813 178.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.3 mtpt -63.19 -50.61 69.66 Favored 'General case' 0 N--CA 1.44 -0.941 0 O-C-N 121.477 -0.765 . . . . 0.0 110.331 176.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 39.6 tptt -52.12 -45.3 64.87 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 124.452 1.101 . . . . 0.0 111.205 178.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 43.6 t -75.01 -63.14 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.428 -1.561 0 C-N-CA 124.646 1.178 . . . . 0.0 109.732 -178.328 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -110.3 -35.12 6.16 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.817 0.847 . . . . 0.0 112.421 -166.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 108.76 -23.21 24.49 Favored Glycine 0 CA--C 1.532 1.106 0 N-CA-C 110.6 -1.0 . . . . 0.0 110.6 -170.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 13.6 m -81.91 66.63 7.57 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 125.595 1.558 . . . . 0.0 110.046 -167.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -67.49 47.61 0.29 Allowed Glycine 0 CA--C 1.54 1.64 0 N-CA-C 117.98 1.952 . . . . 0.0 117.98 -160.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -132.38 98.61 4.43 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 119.951 1.875 . . . . 0.0 110.594 -163.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -159.17 -163.6 13.36 Favored Glycine 0 CA--C 1.525 0.702 0 CA-C-O 119.838 -0.423 . . . . 0.0 113.339 -172.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -158.65 160.17 36.2 Favored 'General case' 0 C--O 1.232 0.184 0 C-N-CA 126.997 2.119 . . . . 0.0 107.636 169.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -91.13 160.89 15.33 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 178.406 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -136.96 126.02 24.44 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 173.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 6.2 m120 64.43 -82.64 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.647 1.179 . . . . 0.0 110.616 174.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -163.63 43.89 0.11 Allowed 'General case' 0 N--CA 1.441 -0.899 0 C-N-CA 127.47 2.308 . . . . 0.0 106.155 172.093 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 7.8 mp0 -139.79 -177.82 5.14 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 129.911 3.285 . . . . 0.0 103.84 175.278 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.5 m -150.11 160.41 43.68 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 120.328 1.422 . . . . 0.0 111.897 -171.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 51.3 mtp180 -144.94 147.96 33.3 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 124.139 0.975 . . . . 0.0 108.385 -172.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 48.0 t -133.95 159.71 39.9 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.45 -0.474 0 CA-C-N 118.464 0.574 . . . . 0.0 110.858 -173.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.6 pt? . . . . . 0 N--CA 1.454 -0.257 0 N-CA-C 106.317 -1.735 . . . . 0.0 106.317 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.3 pt -145.35 151.47 15.04 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.48 0 N-CA-C 104.828 -2.286 . . . . 0.0 104.828 -152.024 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -108.65 86.91 2.37 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 170.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 19.6 m -121.16 135.84 60.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 114.052 -1.431 . . . . 0.0 108.249 157.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -73.03 95.44 2.01 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 124.082 0.953 . . . . 0.0 111.525 -167.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.6 p -64.92 131.04 45.6 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.706 -177.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -87.15 -25.72 23.95 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 124.26 0.975 . . . . 0.0 109.468 151.151 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -164.09 167.62 20.07 Favored 'General case' 0 C--O 1.223 -0.291 0 C-N-CA 123.748 0.819 . . . . 0.0 109.186 -178.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.7 p -59.13 -37.48 77.32 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 125.15 1.38 . . . . 0.0 112.179 174.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.5 p -56.25 -36.33 68.42 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 121.287 0.565 . . . . 0.0 111.581 -176.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -39.59 -53.37 2.13 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 125.37 1.468 . . . . 0.0 111.947 168.002 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.7 m -67.94 -31.07 70.56 Favored 'General case' 0 N--CA 1.439 -0.996 0 C-N-CA 127.76 2.424 . . . . 0.0 108.813 -173.365 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 33.3 m0 -65.1 -63.36 1.12 Allowed 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 106.227 -1.768 . . . . 0.0 106.227 176.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 1.3 p -53.69 -31.02 46.31 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 119.026 -0.512 . . . . 0.0 111.573 177.062 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.8 -57.54 10.52 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 119.371 0.987 . . . . 0.0 110.72 174.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -58.85 -34.77 71.97 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 122.171 0.986 . . . . 0.0 110.583 -178.739 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.9 mtpm? -62.54 -55.46 27.16 Favored 'General case' 0 N--CA 1.438 -1.037 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.912 176.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 85.1 mttt -48.22 -50.25 30.11 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 124.175 0.99 . . . . 0.0 111.481 -179.475 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -68.65 -71.34 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 118.58 0.627 . . . . 0.0 110.907 174.618 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 88.3 m -104.43 -35.79 7.79 Favored 'General case' 0 N--CA 1.435 -1.223 0 C-N-CA 123.96 0.904 . . . . 0.0 110.74 -159.191 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 112.02 -16.4 25.36 Favored Glycine 0 CA--C 1.532 1.126 0 C-N-CA 123.374 0.512 . . . . 0.0 111.982 -175.08 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.7 p -80.84 63.91 5.41 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 126.557 1.943 . . . . 0.0 110.031 -166.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -72.54 41.64 0.82 Allowed Glycine 0 CA--C 1.537 1.44 0 N-CA-C 117.57 1.788 . . . . 0.0 117.57 -155.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -120.87 135.17 55.25 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 119.955 1.877 . . . . 0.0 109.214 -177.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 175.52 -166.42 37.82 Favored Glycine 0 CA--C 1.524 0.633 0 N-CA-C 111.189 -0.764 . . . . 0.0 111.189 -177.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 4.3 mptt -157.89 156.2 30.94 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 125.363 1.465 . . . . 0.0 108.676 171.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -90.53 160.84 15.76 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -137.88 131.2 30.64 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 105.518 -2.03 . . . . 0.0 105.518 170.543 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 31.4 t30 67.58 -93.05 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 118.984 0.811 . . . . 0.0 110.089 165.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 24.3 m120 -154.95 58.51 0.67 Allowed 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 127.888 2.475 . . . . 0.0 105.367 160.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 17.1 mp0 -149.25 178.37 8.81 Favored 'General case' 0 N--CA 1.444 -0.733 0 C-N-CA 129.762 3.225 . . . . 0.0 103.711 177.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.3 m -155.4 165.22 37.29 Favored 'General case' 0 CA--C 1.506 -0.726 0 O-C-N 120.899 -1.126 . . . . 0.0 110.055 -171.24 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -141.9 146.34 35.61 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 175.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 20.2 m -84.35 -129.65 0.03 OUTLIER 'General case' 0 N--CA 1.439 -1.0 0 N-CA-C 108.058 -1.09 . . . . 0.0 108.058 164.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 3.8 p90 . . . . . 0 N--CA 1.449 -0.508 0 C-N-CA 124.01 0.924 . . . . 0.0 108.853 -173.998 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.5 pp . . . . . 0 N--CA 1.456 -0.163 0 N-CA-C 111.818 0.303 . . . . 0.0 111.818 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -130.09 -168.76 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.903 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 -174.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.5 t0 -135.5 105.44 6.22 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-O 120.745 0.307 . . . . 0.0 110.599 156.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -142.7 136.65 27.38 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.21 0 N-CA-C 109.295 -0.632 . . . . 0.0 109.295 152.235 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 55.1 pttt -46.31 114.52 0.82 Allowed 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 125.648 1.579 . . . . 0.0 112.001 176.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 5.2 p -88.39 134.73 33.75 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 118.004 0.365 . . . . 0.0 111.838 177.156 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -90.39 -21.33 22.01 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 153.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -164.89 166.68 19.37 Favored 'General case' 0 C--O 1.223 -0.303 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 -178.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.9 p -59.75 -39.24 84.14 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 124.519 1.127 . . . . 0.0 111.737 172.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.5 p -56.06 -36.29 67.9 Favored 'General case' 0 N--CA 1.451 -0.381 0 O-C-N 121.969 -0.457 . . . . 0.0 111.448 -176.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -39.18 -55.25 1.68 Allowed 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.159 1.384 . . . . 0.0 111.486 167.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 13.8 m -64.97 -31.45 72.69 Favored 'General case' 0 N--CA 1.438 -1.025 0 C-N-CA 128.186 2.595 . . . . 0.0 108.824 -173.268 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 33.2 m0 -64.02 -67.0 0.47 Allowed 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 105.837 -1.912 . . . . 0.0 105.837 178.501 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -52.44 -32.84 41.34 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 123.265 0.626 . . . . 0.0 111.843 177.732 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.95 -54.88 35.67 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 119.519 1.054 . . . . 0.0 110.147 175.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.7 t -59.94 -34.74 73.66 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-O 120.865 0.364 . . . . 0.0 110.643 179.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 4.8 mtpm? -63.36 -55.14 26.96 Favored 'General case' 0 N--CA 1.438 -1.046 0 O-C-N 122.314 -0.241 . . . . 0.0 110.833 176.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -53.22 -48.29 68.27 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 123.311 0.645 . . . . 0.0 111.079 178.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 40.8 t -70.79 -51.23 38.0 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.485 0 C-N-CA 123.997 0.919 . . . . 0.0 110.191 -176.355 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -129.03 -34.16 1.93 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.778 0.831 . . . . 0.0 112.341 -157.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 118.16 -31.94 5.46 Favored Glycine 0 CA--C 1.533 1.156 0 C-N-CA 124.588 1.09 . . . . 0.0 112.342 176.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 49.5 m -85.53 81.69 8.58 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 126.254 1.822 . . . . 0.0 110.253 -166.268 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -76.53 47.46 2.42 Favored Glycine 0 CA--C 1.536 1.363 0 CA-C-O 118.72 -1.045 . . . . 0.0 115.355 -164.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -119.52 122.57 41.94 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 119.341 1.571 . . . . 0.0 108.739 -178.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -173.35 -169.14 35.42 Favored Glycine 0 CA--C 1.522 0.522 0 CA-C-N 119.162 0.892 . . . . 0.0 112.233 -174.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -161.8 145.34 12.34 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 177.2 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -88.37 152.27 22.03 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 179.265 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 31.0 tp60 -127.59 108.69 10.99 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 105.67 -1.974 . . . . 0.0 105.67 -179.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 65.64 -79.69 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 119.233 0.924 . . . . 0.0 111.44 172.279 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -159.31 43.08 0.23 Allowed 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 129.327 3.051 . . . . 0.0 110.758 169.178 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -133.9 -171.56 2.76 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 105.97 -1.863 . . . . 0.0 105.97 157.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.2 m -145.03 162.35 37.16 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 119.254 0.934 . . . . 0.0 111.079 -172.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 41.3 mtp180 -142.9 153.36 43.03 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 -174.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 49.1 t -135.3 148.39 49.49 Favored 'General case' 0 C--N 1.33 -0.267 0 O-C-N 124.437 1.086 . . . . 0.0 110.891 -175.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 88.3 t80 . . . . . 0 C--O 1.234 0.276 0 C-N-CA 126.837 2.055 . . . . 0.0 109.433 -172.11 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.4 pt? . . . . . 0 N--CA 1.447 -0.618 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -132.9 166.05 30.57 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.878 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 -161.465 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 22.0 p-10 -117.53 24.96 10.75 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 125.52 1.528 . . . . 0.0 112.115 -169.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 21.3 t -117.02 133.35 64.04 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 C-N-CA 123.811 0.844 . . . . 0.0 110.127 -179.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt -46.31 146.14 1.48 Allowed 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 126.853 2.061 . . . . 0.0 114.491 -176.416 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -104.56 129.49 52.64 Favored 'General case' 0 CA--C 1.511 -0.539 0 C-N-CA 123.034 0.533 . . . . 0.0 110.221 167.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -94.66 -10.74 30.9 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 157.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -174.98 168.75 3.47 Favored 'General case' 0 C--N 1.342 0.264 0 C-N-CA 126.154 1.782 . . . . 0.0 107.499 -179.436 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.6 p -64.82 -42.99 94.53 Favored 'General case' 0 C--N 1.333 -0.122 0 C-N-CA 125.81 1.644 . . . . 0.0 111.462 169.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.4 p -55.11 -38.88 68.72 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 122.094 -0.379 . . . . 0.0 110.824 -177.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -35.31 -55.91 0.63 Allowed 'General case' 0 C--O 1.222 -0.349 0 C-N-CA 125.329 1.451 . . . . 0.0 112.097 166.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 18.8 m -64.07 -31.2 72.31 Favored 'General case' 0 N--CA 1.439 -1.016 0 C-N-CA 127.986 2.514 . . . . 0.0 108.491 -170.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 29.8 m0 -66.41 -63.26 1.11 Allowed 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 106.927 -1.508 . . . . 0.0 106.927 178.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -53.8 -31.75 50.11 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.458 0.703 . . . . 0.0 111.533 175.754 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.72 -56.72 10.53 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 119.775 1.171 . . . . 0.0 109.862 178.117 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -57.49 -35.81 70.68 Favored 'General case' 0 CA--C 1.514 -0.421 0 CA-C-O 121.028 0.442 . . . . 0.0 110.758 179.654 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 18.9 mtmm -63.55 -58.14 7.93 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.416 175.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 7.4 mtpm? -54.0 -39.83 66.42 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 123.514 0.725 . . . . 0.0 111.825 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 42.6 t -73.93 -62.2 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.5 0 C-N-CA 123.953 0.901 . . . . 0.0 109.022 179.071 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.2 m -117.02 -43.55 2.85 Favored 'General case' 0 N--CA 1.439 -0.984 0 C-N-CA 124.083 0.953 . . . . 0.0 110.902 -161.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 124.13 -21.34 6.94 Favored Glycine 0 CA--C 1.534 1.241 0 C-N-CA 124.873 1.225 . . . . 0.0 112.376 -176.091 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 9.7 t -86.22 72.88 10.31 Favored 'General case' 0 C--O 1.227 -0.126 0 O-C-N 121.474 -1.015 . . . . 0.0 109.102 -164.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -73.72 38.45 0.9 Allowed Glycine 0 CA--C 1.533 1.184 0 N-CA-C 117.369 1.708 . . . . 0.0 117.369 -160.495 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 61.0 mt-30 -116.16 122.68 45.79 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 126.394 1.877 . . . . 0.0 108.625 -176.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -174.8 -166.47 32.72 Favored Glycine 0 CA--C 1.521 0.458 0 CA-C-N 119.298 0.954 . . . . 0.0 111.869 -177.414 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 78.1 tttt -166.69 150.3 7.03 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 175.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -88.23 161.35 17.25 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 -177.817 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -138.9 115.96 10.95 Favored 'General case' 0 N--CA 1.441 -0.876 0 N-CA-C 106.707 -1.59 . . . . 0.0 106.707 173.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 73.27 -75.58 0.07 Allowed 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.432 0.693 . . . . 0.0 111.493 165.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -168.48 46.94 0.04 OUTLIER 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 129.739 3.216 . . . . 0.0 109.418 167.316 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -144.01 -170.21 3.28 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 104.991 -2.225 . . . . 0.0 104.991 160.223 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.9 m -150.76 159.48 44.5 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 119.268 0.94 . . . . 0.0 110.235 -170.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 51.1 mtt-85 -136.11 152.38 50.78 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 124.599 1.159 . . . . 0.0 109.934 179.038 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 41.2 t -131.99 167.86 18.92 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 124.1 0.875 . . . . 0.0 111.281 -172.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 86.0 m-85 . . . . . 0 C--O 1.233 0.191 0 C-N-CA 127.132 2.173 . . . . 0.0 109.135 172.074 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.1 pt? . . . . . 0 N--CA 1.447 -0.622 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -133.24 -175.29 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.974 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 -168.476 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -143.71 91.78 2.28 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 121.625 0.726 . . . . 0.0 110.179 162.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 94.8 t -135.73 140.95 43.38 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 161.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.22 104.29 0.08 Allowed 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 125.79 1.636 . . . . 0.0 113.183 -177.19 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.92 130.71 42.34 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 167.107 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 29.6 m-85 -88.7 -21.72 23.75 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 123.752 0.821 . . . . 0.0 109.438 150.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -167.55 168.6 12.69 Favored 'General case' 0 C--O 1.224 -0.283 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 -175.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.3 p -62.89 -41.98 99.61 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 125.478 1.511 . . . . 0.0 111.973 174.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.0 t -57.1 -35.57 69.59 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 121.683 -0.635 . . . . 0.0 111.376 -174.303 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -35.63 -55.48 0.69 Allowed 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.387 1.475 . . . . 0.0 112.645 163.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 11.6 m -65.94 -31.41 72.32 Favored 'General case' 0 N--CA 1.439 -1.011 0 C-N-CA 127.892 2.477 . . . . 0.0 109.01 -173.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 35.4 m0 -64.87 -63.37 1.13 Allowed 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 106.421 -1.696 . . . . 0.0 106.421 177.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -53.65 -33.0 53.7 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 122.865 0.466 . . . . 0.0 111.685 176.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.86 -55.49 29.23 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 119.265 0.938 . . . . 0.0 110.267 175.34 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -60.13 -34.08 73.03 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 121.097 0.475 . . . . 0.0 110.373 178.586 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.1 mtmt -64.15 -50.81 66.73 Favored 'General case' 0 N--CA 1.44 -0.967 0 O-C-N 121.35 -0.844 . . . . 0.0 110.456 178.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 10.2 mtpm? -57.97 -39.73 78.88 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.795 178.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 38.3 t -72.32 -60.51 2.35 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.403 0 C-N-CA 123.802 0.841 . . . . 0.0 109.551 179.323 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.9 t -118.24 -39.96 3.0 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.171 0.988 . . . . 0.0 112.578 -165.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 120.52 -25.36 7.33 Favored Glycine 0 CA--C 1.532 1.128 0 C-N-CA 123.896 0.76 . . . . 0.0 111.648 -178.172 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.9 t -87.83 75.27 8.92 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 124.048 0.939 . . . . 0.0 108.996 -167.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -71.95 54.47 1.38 Allowed Glycine 0 CA--C 1.534 1.234 0 N-CA-C 116.891 1.516 . . . . 0.0 116.891 -161.009 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -129.62 123.03 30.26 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 120.278 2.039 . . . . 0.0 111.171 -173.013 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -175.55 -168.99 36.72 Favored Glycine 0 CA--C 1.527 0.837 0 CA-C-N 118.273 0.488 . . . . 0.0 112.256 -176.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -149.06 158.78 44.45 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 125.987 1.715 . . . . 0.0 107.651 165.097 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -86.94 153.73 21.36 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 2.2 tp60 -124.5 106.8 10.45 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 176.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 73.88 -85.31 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.409 0 O-C-N 121.752 -0.593 . . . . 0.0 109.836 167.301 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 34.3 m120 -152.73 46.19 0.71 Allowed 'General case' 0 C--O 1.224 -0.266 0 C-N-CA 127.323 2.249 . . . . 0.0 107.289 161.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 5.2 mp0 -135.44 -175.84 4.07 Favored 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 128.597 2.759 . . . . 0.0 103.994 169.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -153.41 154.33 34.24 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 119.947 1.249 . . . . 0.0 110.545 -170.151 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 66.6 mtp180 -144.05 111.74 6.09 Favored 'General case' 0 CA--C 1.506 -0.724 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.338 -168.022 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -76.39 168.31 20.28 Favored 'General case' 0 N--CA 1.438 -1.032 0 CA-C-O 121.798 0.809 . . . . 0.0 110.384 166.797 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 1.4 p90 . . . . . 0 N--CA 1.443 -0.8 0 C-N-CA 124.913 1.285 . . . . 0.0 111.25 177.674 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.2 pt? . . . . . 0 N--CA 1.445 -0.68 0 N-CA-C 107.294 -1.373 . . . . 0.0 107.294 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -136.53 158.28 37.48 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.25 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 -162.585 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -86.44 -17.92 33.04 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 125.061 1.344 . . . . 0.0 112.012 -171.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 63.2 t -70.09 134.44 30.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 C-N-CA 119.994 -0.682 . . . . 0.0 110.756 -159.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 56.8 pttt -53.6 102.2 0.05 Allowed 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.331 1.452 . . . . 0.0 112.611 -178.028 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -62.6 131.41 48.96 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 169.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -90.67 -17.2 27.23 Favored 'General case' 0 CA--C 1.535 0.402 0 O-C-N 124.684 1.24 . . . . 0.0 109.659 157.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 173.54 156.41 0.12 Allowed 'General case' 0 C--N 1.343 0.323 0 C-N-CA 126.41 1.884 . . . . 0.0 107.518 -175.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 35.4 m -47.6 -38.4 14.47 Favored 'General case' 0 CA--C 1.528 0.131 0 C-N-CA 124.151 0.98 . . . . 0.0 113.581 174.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.0 p -60.98 -28.59 69.12 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 121.892 -0.505 . . . . 0.0 112.005 -179.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 7.6 tm-20 -55.5 -52.89 62.16 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.178 0.591 . . . . 0.0 109.435 173.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 15.1 m -55.94 -28.17 55.7 Favored 'General case' 0 N--CA 1.442 -0.862 0 C-N-CA 127.726 2.41 . . . . 0.0 109.705 -176.216 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 37.4 m0 -66.68 -66.5 0.55 Allowed 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 107.039 -1.467 . . . . 0.0 107.039 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -50.89 -33.52 24.42 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 118.368 -0.825 . . . . 0.0 111.112 174.181 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.35 -58.75 5.12 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 120.056 1.298 . . . . 0.0 111.534 177.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -60.81 -30.26 69.97 Favored 'General case' 0 CA--C 1.519 -0.232 0 O-C-N 121.511 -0.743 . . . . 0.0 110.886 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -65.97 -48.73 70.31 Favored 'General case' 0 N--CA 1.442 -0.859 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.747 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.1 tmtt? -60.3 -37.64 81.15 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 124.453 1.101 . . . . 0.0 110.774 177.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 29.8 t -72.17 -62.0 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.428 -1.543 0 C-N-CA 124.05 0.94 . . . . 0.0 108.497 177.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.3 m -122.06 -49.87 2.06 Favored 'General case' 0 N--CA 1.431 -1.395 0 C-N-CA 123.922 0.889 . . . . 0.0 110.684 -163.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 134.18 -20.95 3.94 Favored Glycine 0 CA--C 1.536 1.389 0 C-N-CA 123.926 0.774 . . . . 0.0 112.253 -170.237 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 30.9 m -82.83 63.09 6.76 Favored 'General case' 0 C--O 1.228 -0.079 0 C-N-CA 125.205 1.402 . . . . 0.0 111.084 -164.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -65.99 1.26 4.92 Favored Glycine 0 CA--C 1.536 1.371 0 N-CA-C 116.297 1.279 . . . . 0.0 116.297 -162.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -89.56 105.48 17.82 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 119.629 1.714 . . . . 0.0 108.401 -173.432 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -158.85 -174.0 27.99 Favored Glycine 0 C--N 1.333 0.397 0 O-C-N 122.27 -0.269 . . . . 0.0 112.712 -171.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -151.33 154.98 37.77 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 124.753 1.221 . . . . 0.0 108.109 173.317 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -87.77 161.04 17.8 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 176.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 45.9 tt0 -136.01 127.63 28.89 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 105.164 -2.161 . . . . 0.0 105.164 170.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 68.71 -89.45 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 118.797 0.726 . . . . 0.0 110.555 168.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 36.6 m120 -161.27 55.28 0.28 Allowed 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 130.129 3.372 . . . . 0.0 104.065 165.011 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -145.99 175.47 10.42 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 130.855 3.662 . . . . 0.0 102.794 176.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.2 m -156.84 157.85 35.68 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-N 120.06 1.3 . . . . 0.0 110.809 -168.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 15.2 mtp180 -144.15 145.3 32.02 Favored 'General case' 0 CA--C 1.512 -0.497 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 -170.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 8.4 p -132.89 151.53 52.02 Favored 'General case' 0 CA--C 1.515 -0.384 0 O-C-N 124.244 0.965 . . . . 0.0 110.733 169.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.448 -0.526 0 C-N-CA 123.92 0.888 . . . . 0.0 112.322 -173.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.2 pt? . . . . . 0 N--CA 1.446 -0.627 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -130.42 174.52 12.71 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.003 0 N-CA-C 106.574 -1.639 . . . . 0.0 106.574 -175.813 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -132.59 71.27 1.47 Allowed 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 122.163 0.982 . . . . 0.0 110.653 175.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 64.7 t -131.37 136.37 57.65 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 114.357 -1.292 . . . . 0.0 109.032 167.193 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 60.0 pttt -45.95 113.64 0.65 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 126.156 1.782 . . . . 0.0 112.618 179.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -74.09 136.67 43.02 Favored 'General case' 0 CA--C 1.516 -0.351 0 C-N-CA 120.103 -0.639 . . . . 0.0 109.859 170.123 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 7.2 t80 -100.73 -8.18 23.03 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 161.066 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 174.08 165.12 0.2 Allowed 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 126.941 2.096 . . . . 0.0 106.461 -175.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.6 m -62.33 -36.26 81.66 Favored 'General case' 0 C--O 1.226 -0.182 0 C-N-CA 122.73 0.412 . . . . 0.0 111.961 170.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.5 p -59.09 -37.75 77.89 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 122.131 -0.356 . . . . 0.0 110.652 -179.529 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -42.58 -55.3 3.57 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.165 0.986 . . . . 0.0 110.63 170.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 25.5 m -56.56 -31.11 63.88 Favored 'General case' 0 N--CA 1.444 -0.763 0 C-N-CA 127.174 2.19 . . . . 0.0 109.678 -173.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 34.2 m0 -65.74 -63.47 1.08 Allowed 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 -179.214 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -51.62 -36.37 45.58 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-O 118.691 -0.671 . . . . 0.0 111.031 173.565 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.74 -57.58 10.46 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 119.632 1.106 . . . . 0.0 110.863 -178.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -59.04 -35.31 73.1 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-O 121.37 0.605 . . . . 0.0 110.55 178.497 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.1 mtmt -62.55 -45.46 92.84 Favored 'General case' 0 N--CA 1.441 -0.909 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 178.621 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -54.91 -52.39 63.05 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 122.957 0.503 . . . . 0.0 111.231 176.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -67.38 -65.32 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 118.47 0.577 . . . . 0.0 112.093 178.713 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 62.2 p -105.25 -50.02 3.33 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 122.546 0.338 . . . . 0.0 110.703 -170.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 126.46 -10.36 7.24 Favored Glycine 0 CA--C 1.532 1.126 0 CA-C-N 115.464 -0.789 . . . . 0.0 112.224 -161.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.5 m -78.66 57.49 2.05 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 118.674 1.237 . . . . 0.0 112.347 -165.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -74.2 30.55 0.97 Allowed Glycine 0 CA--C 1.533 1.199 0 N-CA-C 117.093 1.597 . . . . 0.0 117.093 -154.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 -122.79 123.76 41.78 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 119.57 1.685 . . . . 0.0 108.069 -172.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -179.11 -170.86 41.59 Favored Glycine 0 CA--C 1.526 0.757 0 CA-C-N 118.921 0.782 . . . . 0.0 112.743 -175.101 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -147.49 159.47 43.69 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 125.526 1.53 . . . . 0.0 108.337 166.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -88.37 141.18 28.75 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.775 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 11.3 tp60 -102.58 99.54 9.55 Favored 'General case' 0 N--CA 1.445 -0.713 0 N-CA-C 105.595 -2.002 . . . . 0.0 105.595 171.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 69.4 -77.62 0.05 Allowed 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 119.182 0.901 . . . . 0.0 112.32 166.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -153.95 39.11 0.47 Allowed 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 128.458 2.703 . . . . 0.0 110.933 168.449 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -136.86 -177.77 4.89 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 104.219 -2.511 . . . . 0.0 104.219 166.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.1 m -151.1 153.7 35.55 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 119.861 1.209 . . . . 0.0 110.639 -167.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 75.9 mtp180 -144.67 110.85 5.5 Favored 'General case' 0 CA--C 1.507 -0.693 0 C-N-CA 123.666 0.787 . . . . 0.0 109.475 -163.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 4.6 m -91.15 -154.99 0.38 Allowed 'General case' 0 N--CA 1.441 -0.875 0 CA-C-N 114.685 -1.143 . . . . 0.0 110.484 -178.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.451 -0.409 0 C-N-CA 124.857 1.263 . . . . 0.0 109.481 -175.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.6 pt? . . . . . 0 N--CA 1.45 -0.438 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -145.48 157.77 13.01 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.619 0 N-CA-C 105.978 -1.86 . . . . 0.0 105.978 -157.842 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -118.35 33.17 5.76 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 123.139 0.576 . . . . 0.0 110.759 -169.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.4 p -77.99 127.36 38.55 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.175 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 170.349 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 53.3 pttt -43.84 101.83 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.31 1.444 . . . . 0.0 111.287 171.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -68.8 133.47 48.36 Favored 'General case' 0 CA--C 1.517 -0.306 0 C-N-CA 119.414 -0.914 . . . . 0.0 110.32 177.492 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -98.05 -8.14 28.39 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.416 158.274 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 176.24 166.24 0.43 Allowed 'General case' 0 C--O 1.225 -0.202 0 C-N-CA 126.137 1.775 . . . . 0.0 107.15 -177.273 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.8 m -61.58 -35.35 77.58 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 118.334 0.515 . . . . 0.0 112.041 172.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.8 p -58.79 -32.56 69.44 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 121.666 -0.646 . . . . 0.0 111.61 -179.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -44.26 -52.71 7.28 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 124.092 0.957 . . . . 0.0 111.136 169.257 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 8.9 m -67.04 -30.69 70.84 Favored 'General case' 0 N--CA 1.44 -0.962 0 C-N-CA 127.677 2.391 . . . . 0.0 108.514 -172.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 34.2 m0 -64.95 -65.55 0.66 Allowed 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 106.0 -1.852 . . . . 0.0 106.0 176.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 4.0 p -54.22 -31.32 52.84 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 123.006 0.522 . . . . 0.0 111.755 179.022 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.48 -55.03 20.1 Favored 'General case' 0 N--CA 1.457 -0.092 0 CA-C-N 119.394 0.997 . . . . 0.0 110.432 175.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -60.96 -31.8 71.35 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-O 120.952 0.406 . . . . 0.0 110.086 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 22.9 mtpp -65.79 -53.45 40.17 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-O 121.377 0.608 . . . . 0.0 110.967 174.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? -54.15 -38.77 65.86 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.385 179.006 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 78.8 t -77.7 -66.72 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.425 -1.689 0 C-N-CA 124.027 0.931 . . . . 0.0 109.622 176.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 29.3 p -95.36 -50.8 4.86 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 123.157 0.583 . . . . 0.0 111.557 -169.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 122.31 -28.28 5.84 Favored Glycine 0 CA--C 1.531 1.047 0 C-N-CA 125.264 1.412 . . . . 0.0 110.783 -166.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -89.28 80.22 6.91 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.895 1.278 . . . . 0.0 109.184 -165.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -76.14 40.22 1.46 Allowed Glycine 0 CA--C 1.532 1.151 0 N-CA-C 117.175 1.63 . . . . 0.0 117.175 -156.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 61.2 mt-30 -115.5 116.68 28.6 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 120.104 1.952 . . . . 0.0 110.814 -171.066 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -170.19 -169.88 33.87 Favored Glycine 0 C--N 1.339 0.709 0 N-CA-C 111.453 -0.659 . . . . 0.0 111.453 -178.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 45.2 mtpt -150.97 156.46 41.2 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 124.722 1.209 . . . . 0.0 108.732 169.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -88.83 162.91 15.92 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 178.345 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 -141.77 125.99 17.47 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 106.858 -1.534 . . . . 0.0 106.858 168.178 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 7.2 m120 66.03 -78.13 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.943 0.897 . . . . 0.0 111.589 169.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -165.26 44.43 0.08 Allowed 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 129.782 3.233 . . . . 0.0 109.64 168.655 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 93.8 mt-30 -134.4 179.98 5.94 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 127.611 2.364 . . . . 0.0 105.23 168.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.4 m -153.57 157.61 39.98 Favored 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 -177.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 8.1 mtt180 -146.12 128.6 15.98 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 118.022 -0.989 . . . . 0.0 109.502 -170.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -103.45 167.71 9.63 Favored 'General case' 0 C--N 1.343 0.306 0 CA-C-O 121.885 0.85 . . . . 0.0 112.209 171.545 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.451 -0.377 0 C-N-CA 126.076 1.75 . . . . 0.0 111.107 -176.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.3 pt? . . . . . 0 N--CA 1.447 -0.587 0 N-CA-C 109.211 -0.662 . . . . 0.0 109.211 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -138.89 166.17 22.85 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.186 0 N-CA-C 106.794 -1.558 . . . . 0.0 106.794 -163.714 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 46.9 t0 -127.42 81.8 2.04 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 122.047 0.927 . . . . 0.0 109.055 166.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 93.3 t -122.13 133.89 67.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 N-CA-C 106.2 -1.778 . . . . 0.0 106.2 156.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -62.1 108.58 1.09 Allowed 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 124.514 1.126 . . . . 0.0 111.464 -174.082 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 11.4 p -63.54 128.24 34.93 Favored 'General case' 0 CA--C 1.516 -0.354 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.711 176.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -71.83 -38.14 70.22 Favored 'General case' 0 N--CA 1.45 -0.446 0 O-C-N 124.421 1.076 . . . . 0.0 108.108 153.499 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -169.17 160.31 9.62 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.666 1.187 . . . . 0.0 108.386 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 21.8 m -47.06 -40.52 15.14 Favored 'General case' 0 C--O 1.226 -0.16 0 C-N-CA 124.383 1.073 . . . . 0.0 112.378 173.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.08 -23.6 65.59 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-O 119.096 -0.478 . . . . 0.0 112.112 -177.809 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -69.9 -48.14 59.78 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 119.235 0.925 . . . . 0.0 109.674 174.414 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 21.3 m -47.84 -28.16 2.46 Favored 'General case' 0 CA--C 1.511 -0.522 0 C-N-CA 125.937 1.695 . . . . 0.0 110.596 -179.372 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 37.1 m0 -64.81 -65.85 0.62 Allowed 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 177.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -51.4 -31.95 24.48 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-O 117.918 -1.039 . . . . 0.0 111.464 172.173 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.42 -63.31 1.27 Allowed 'General case' 0 C--N 1.342 0.245 0 CA-C-N 121.018 1.735 . . . . 0.0 111.265 176.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -57.68 -30.94 65.86 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 121.906 0.86 . . . . 0.0 110.848 -178.5 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.7 mtmm -66.49 -49.45 66.56 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 173.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 67.4 mttt -51.98 -53.26 43.62 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.25 1.02 . . . . 0.0 109.95 177.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -63.04 -40.88 90.72 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 179.287 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -151.6 -49.15 0.11 Allowed 'General case' 0 N--CA 1.447 -0.613 0 O-C-N 121.419 -0.8 . . . . 0.0 111.768 -164.82 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 144.52 -15.14 2.04 Favored Glycine 0 CA--C 1.53 0.979 0 C-N-CA 120.721 -0.752 . . . . 0.0 114.154 -178.114 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 9.3 m -79.79 59.12 3.02 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 124.059 0.943 . . . . 0.0 111.682 -163.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -70.87 12.01 2.3 Favored Glycine 0 CA--C 1.532 1.152 0 N-CA-C 116.339 1.295 . . . . 0.0 116.339 -157.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -105.22 108.06 19.37 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 119.16 1.48 . . . . 0.0 107.042 -172.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -167.03 -170.37 31.82 Favored Glycine 0 C--N 1.336 0.575 0 N-CA-C 111.966 -0.454 . . . . 0.0 111.966 -168.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 78.2 mttt -156.22 154.91 31.51 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 124.922 1.289 . . . . 0.0 108.631 177.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -91.35 160.09 15.66 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 176.419 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -140.81 120.9 13.74 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 106.231 -1.766 . . . . 0.0 106.231 176.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 70.84 -84.96 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 118.25 0.477 . . . . 0.0 110.078 168.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -162.34 56.36 0.23 Allowed 'General case' 0 N--CA 1.462 0.131 0 C-N-CA 129.175 2.99 . . . . 0.0 104.793 162.079 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 5.6 mp0 -143.09 -178.96 6.1 Favored 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 128.882 2.873 . . . . 0.0 103.796 170.017 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.2 m -157.39 158.5 36.02 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 119.595 1.089 . . . . 0.0 109.998 -169.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 58.1 mtt-85 -144.81 153.32 41.51 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 124.555 1.142 . . . . 0.0 110.096 -176.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 8.7 p -139.07 163.33 32.7 Favored 'General case' 0 CA--C 1.521 -0.164 0 O-C-N 124.389 1.056 . . . . 0.0 111.088 170.609 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.533 0.294 0 C-N-CA 123.807 0.843 . . . . 0.0 112.194 -171.606 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.6 pt? . . . . . 0 N--CA 1.452 -0.361 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -145.26 158.74 13.36 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.338 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 -158.464 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -123.5 41.62 3.43 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 121.881 0.848 . . . . 0.0 111.516 -174.726 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 97.5 t -87.19 129.14 39.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 166.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 52.8 pttt -49.53 101.48 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 126.211 1.805 . . . . 0.0 113.363 179.292 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -66.47 127.07 30.89 Favored 'General case' 0 CA--C 1.515 -0.378 0 C-N-CA 123.0 0.52 . . . . 0.0 110.591 170.358 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 87.2 m-85 -96.94 -12.43 23.41 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 125.198 1.561 . . . . 0.0 109.979 153.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -177.15 153.42 0.97 Allowed 'General case' 0 C--N 1.343 0.318 0 C-N-CA 124.483 1.113 . . . . 0.0 109.212 -177.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.9 p -54.52 -41.22 69.4 Favored 'General case' 0 N--CA 1.457 -0.12 0 C-N-CA 125.31 1.444 . . . . 0.0 111.199 171.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.5 p -59.3 -25.08 63.84 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -178.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -60.0 -57.38 13.11 Favored 'General case' 0 C--O 1.223 -0.312 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 173.63 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 11.7 m -48.56 -31.4 6.48 Favored 'General case' 0 CA--C 1.508 -0.646 0 C-N-CA 129.008 2.923 . . . . 0.0 109.964 -175.446 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 33.8 m0 -62.58 -63.82 1.11 Allowed 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 175.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -48.11 -39.77 21.45 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 123.263 0.625 . . . . 0.0 111.922 173.487 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.29 -56.72 18.14 Favored 'General case' 0 C--N 1.328 -0.327 0 O-C-N 121.681 -0.637 . . . . 0.0 110.546 178.553 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -59.75 -35.56 74.84 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.595 0.712 . . . . 0.0 110.549 179.076 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 4.3 mtmp? -64.5 -44.63 90.31 Favored 'General case' 0 N--CA 1.439 -1.011 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.438 177.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.43 -54.43 32.28 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 124.226 1.011 . . . . 0.0 109.785 178.791 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -67.58 -62.95 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.325 0 N-CA-C 112.087 0.402 . . . . 0.0 112.087 178.226 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 70.7 p -103.6 -49.51 3.66 Favored 'General case' 0 CA--C 1.522 -0.099 0 C-N-CA 122.779 0.431 . . . . 0.0 110.806 -167.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 118.65 -18.1 10.89 Favored Glycine 0 CA--C 1.532 1.1 0 CA-C-N 115.151 -0.932 . . . . 0.0 111.401 -163.692 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 24.5 m -79.56 67.31 5.28 Favored 'General case' 0 C--O 1.227 -0.123 0 C-N-CA 124.467 1.107 . . . . 0.0 110.285 -169.348 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -72.44 40.67 0.76 Allowed Glycine 0 CA--C 1.539 1.584 0 N-CA-C 117.036 1.574 . . . . 0.0 117.036 -160.207 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 63.1 mt-30 -117.09 120.53 38.6 Favored 'General case' 0 C--O 1.224 -0.282 0 C-N-CA 125.739 1.616 . . . . 0.0 108.942 -172.381 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -175.2 -168.39 35.67 Favored Glycine 0 C--N 1.335 0.524 0 CA-C-N 119.622 1.101 . . . . 0.0 111.508 -178.021 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 81.4 mttt -153.77 160.83 42.41 Favored 'General case' 0 CA--C 1.522 -0.101 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 165.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.18 165.57 14.38 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 177.051 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -141.32 141.58 33.87 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 106.264 -1.754 . . . . 0.0 106.264 165.323 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 18.9 t30 61.68 -93.43 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 118.591 0.632 . . . . 0.0 111.07 167.546 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.0 m120 -153.35 55.37 0.75 Allowed 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 127.632 2.373 . . . . 0.0 106.224 162.167 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 17.1 mp0 -148.12 176.82 9.9 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 129.966 3.306 . . . . 0.0 104.442 -176.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.4 m -156.81 155.1 30.96 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 119.54 1.064 . . . . 0.0 110.126 -171.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 -142.2 134.84 28.24 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 123.847 0.859 . . . . 0.0 109.248 -170.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 49.0 t -111.32 158.05 19.47 Favored 'General case' 0 C--N 1.341 0.228 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 -174.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 16.8 m-30 . . . . . 0 N--CA 1.454 -0.258 0 C-N-CA 125.481 1.512 . . . . 0.0 109.64 -175.302 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.4 pt? . . . . . 0 N--CA 1.451 -0.402 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -137.1 162.6 33.75 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.15 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 -167.128 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -90.56 -16.91 27.9 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 124.501 1.12 . . . . 0.0 112.621 -172.122 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 58.3 t -75.19 134.57 29.07 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 CA-C-N 118.795 0.725 . . . . 0.0 111.757 -157.294 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.2 tmtt? -37.7 106.31 0.05 OUTLIER 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 127.578 2.351 . . . . 0.0 112.104 173.04 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -75.28 135.22 40.95 Favored 'General case' 0 CA--C 1.515 -0.388 0 C-N-CA 120.332 -0.547 . . . . 0.0 109.915 168.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -95.12 -16.37 22.66 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 158.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 178.51 166.43 0.83 Allowed 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 106.099 -1.815 . . . . 0.0 106.099 -172.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.9 p -61.31 -39.37 90.22 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 124.06 0.944 . . . . 0.0 111.48 172.733 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.6 p -56.77 -40.94 76.78 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 122.773 0.429 . . . . 0.0 111.046 -177.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -40.66 -56.87 2.02 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.634 1.174 . . . . 0.0 111.078 170.546 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 23.7 m -57.95 -28.37 64.25 Favored 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 128.026 2.53 . . . . 0.0 109.73 -173.311 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 33.2 m0 -64.65 -66.15 0.58 Allowed 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 107.186 -1.413 . . . . 0.0 107.186 177.534 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -51.67 -33.14 32.54 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 118.085 -0.959 . . . . 0.0 111.696 174.409 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.82 -54.38 36.01 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 120.107 1.321 . . . . 0.0 110.709 175.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 5.1 t -58.12 -37.16 74.06 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.071 0.463 . . . . 0.0 110.46 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 40.3 mtmt -63.5 -58.71 6.15 Favored 'General case' 0 N--CA 1.44 -0.943 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.706 177.079 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 64.3 mmtt -49.53 -47.11 49.13 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.303 1.041 . . . . 0.0 111.835 178.076 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 44.0 t -70.87 -60.02 2.86 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.77 0 C-N-CA 123.962 0.905 . . . . 0.0 109.15 -178.102 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.2 m -118.58 -41.54 2.81 Favored 'General case' 0 N--CA 1.439 -1.004 0 C-N-CA 123.591 0.756 . . . . 0.0 110.987 -161.103 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 120.83 -21.42 8.41 Favored Glycine 0 CA--C 1.533 1.215 0 C-N-CA 124.908 1.242 . . . . 0.0 112.372 -177.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 21.5 m -88.17 61.08 6.09 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 124.709 1.204 . . . . 0.0 110.322 -160.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -64.13 23.39 0.09 OUTLIER Glycine 0 CA--C 1.54 1.623 0 N-CA-C 120.414 2.926 . . . . 0.0 120.414 -152.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -108.38 118.2 36.16 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 121.129 2.465 . . . . 0.0 109.903 -176.3 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -163.99 -170.49 28.98 Favored Glycine 0 CA--C 1.528 0.875 0 N-CA-C 112.157 -0.377 . . . . 0.0 112.157 -174.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -156.38 156.08 33.26 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 125.159 1.384 . . . . 0.0 107.879 174.073 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -92.14 160.57 15.13 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 178.485 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.8 tp-100 -133.62 126.69 31.41 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 105.896 -1.89 . . . . 0.0 105.896 165.659 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.2 t30 69.04 -78.91 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 164.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -166.63 44.86 0.06 Allowed 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 130.411 3.484 . . . . 0.0 108.894 170.388 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -147.61 179.35 7.75 Favored 'General case' 0 N--CA 1.442 -0.825 0 C-N-CA 128.875 2.87 . . . . 0.0 104.167 177.453 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 5.0 m -153.94 164.75 37.9 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 119.894 1.224 . . . . 0.0 110.399 -169.422 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 73.4 mtp180 -140.0 152.93 46.68 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 125.651 1.58 . . . . 0.0 108.976 -178.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 36.8 t -132.59 162.63 30.8 Favored 'General case' 0 C--O 1.224 -0.26 0 O-C-N 124.652 1.22 . . . . 0.0 109.34 178.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.534 0.355 0 CA-C-N 118.651 0.66 . . . . 0.0 111.365 -177.294 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.457 -0.097 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -140.42 160.67 25.02 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.373 0 N-CA-C 104.932 -2.247 . . . . 0.0 104.932 -171.487 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -123.33 41.88 3.36 Favored 'General case' 0 C--N 1.332 -0.19 0 C-N-CA 123.077 0.551 . . . . 0.0 110.677 -171.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 95.9 t -96.45 135.97 28.83 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 170.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.67 106.7 0.27 Allowed 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.815 1.246 . . . . 0.0 112.372 -177.748 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -65.19 127.29 31.08 Favored 'General case' 0 CA--C 1.515 -0.367 0 C-N-CA 122.587 0.355 . . . . 0.0 110.259 168.005 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -85.21 -19.19 32.06 Favored 'General case' 0 CA--C 1.538 0.519 0 O-C-N 124.403 1.064 . . . . 0.0 109.237 155.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -175.39 171.51 2.85 Favored 'General case' 0 C--O 1.221 -0.406 0 C-N-CA 125.486 1.515 . . . . 0.0 108.11 -179.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 20.0 m -62.86 -37.94 88.86 Favored 'General case' 0 N--CA 1.464 0.254 0 O-C-N 121.72 -0.612 . . . . 0.0 111.934 170.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.2 p -57.99 -34.36 69.9 Favored 'General case' 0 N--CA 1.452 -0.361 0 O-C-N 121.768 -0.582 . . . . 0.0 110.999 -178.138 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -40.24 -54.69 2.31 Favored 'General case' 0 C--O 1.225 -0.225 0 C-N-CA 124.42 1.088 . . . . 0.0 111.567 167.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 19.1 m -64.93 -30.06 71.03 Favored 'General case' 0 N--CA 1.44 -0.949 0 C-N-CA 127.394 2.278 . . . . 0.0 108.438 -171.019 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 28.9 m0 -64.9 -65.72 0.64 Allowed 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 106.178 -1.786 . . . . 0.0 106.178 176.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -51.46 -33.6 31.73 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 118.604 -0.712 . . . . 0.0 112.149 176.75 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.48 -54.88 25.57 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 119.902 1.228 . . . . 0.0 110.259 177.376 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -60.29 -34.1 73.29 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 120.794 0.33 . . . . 0.0 110.343 179.835 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 39.1 mtmt -65.16 -53.9 37.85 Favored 'General case' 0 N--CA 1.439 -0.999 0 C-N-CA 122.483 0.313 . . . . 0.0 110.839 176.267 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -48.32 -49.49 33.89 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 123.569 0.748 . . . . 0.0 110.71 176.786 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 65.3 t -73.15 -56.07 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.697 0 C-N-CA 124.289 1.036 . . . . 0.0 110.299 -175.477 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 11.9 t -138.91 18.85 2.65 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 113.588 0.959 . . . . 0.0 113.588 -162.517 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.09 -27.53 0.54 Allowed Glycine 0 CA--C 1.542 1.74 0 O-C-N 120.566 -1.334 . . . . 0.0 115.132 176.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 10.1 t -84.72 73.52 10.58 Favored 'General case' 0 C--O 1.226 -0.171 0 O-C-N 121.488 -1.007 . . . . 0.0 109.539 -162.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -72.04 35.77 0.63 Allowed Glycine 0 CA--C 1.536 1.398 0 N-CA-C 117.013 1.565 . . . . 0.0 117.013 -162.439 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -111.56 109.74 19.81 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 119.952 1.876 . . . . 0.0 109.454 -173.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -161.8 -169.19 24.78 Favored Glycine 0 CA--C 1.527 0.784 0 CA-C-N 118.736 0.698 . . . . 0.0 113.565 -173.558 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 19.2 ttmm -165.98 142.59 5.2 Favored 'General case' 0 CA--C 1.519 -0.246 0 C-N-CA 125.192 1.397 . . . . 0.0 107.748 -178.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . 0.402 ' HA ' ' HA ' ' A' ' 34' ' ' CYS . 0.1 OUTLIER -86.08 149.04 25.42 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 109.217 -0.661 . . . . 0.0 109.217 -177.901 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 21.1 tp60 -116.22 111.3 19.98 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 105.056 -2.202 . . . . 0.0 105.056 174.555 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 63.32 -92.37 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 119.598 1.09 . . . . 0.0 109.731 172.002 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 21.8 m120 -147.68 55.18 1.07 Allowed 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 126.02 1.728 . . . . 0.0 107.891 165.193 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.4 mp0 -141.55 175.76 9.42 Favored 'General case' 0 N--CA 1.445 -0.715 0 C-N-CA 130.752 3.621 . . . . 0.0 103.177 171.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.402 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 0.8 OUTLIER -147.9 155.82 42.01 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-N 120.725 1.602 . . . . 0.0 110.759 -171.46 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 63.0 mtp180 -139.51 151.88 46.49 Favored 'General case' 0 CA--C 1.509 -0.619 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 -171.141 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 47.5 t -143.37 141.45 30.92 Favored 'General case' 0 C--N 1.332 -0.179 0 O-C-N 124.543 1.152 . . . . 0.0 110.817 -172.181 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 72.9 t80 . . . . . 0 N--CA 1.453 -0.298 0 C-N-CA 126.021 1.728 . . . . 0.0 109.834 -170.343 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.6 pt? . . . . . 0 CA--C 1.522 -0.104 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -139.39 162.05 27.34 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.184 0 C-N-CA 126.085 1.754 . . . . 0.0 106.702 -166.332 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -88.42 -15.82 34.47 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 124.03 0.932 . . . . 0.0 113.216 -169.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -67.46 139.46 20.89 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 C-N-CA 119.369 -0.932 . . . . 0.0 112.31 -156.318 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 34.3 mttt -65.55 95.63 0.23 Allowed 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.758 1.223 . . . . 0.0 111.645 -174.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.4 p -67.09 133.21 49.41 Favored 'General case' 0 CA--C 1.517 -0.31 0 O-C-N 123.109 0.255 . . . . 0.0 111.12 176.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 52.8 m-85 -85.47 -27.79 25.45 Favored 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 124.047 0.842 . . . . 0.0 109.295 150.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -169.79 160.71 8.8 Favored 'General case' 0 C--O 1.223 -0.333 0 C-N-CA 123.813 0.845 . . . . 0.0 109.833 -179.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 66.8 m -46.56 -38.28 9.21 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 114.161 1.171 . . . . 0.0 114.161 175.069 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.8 p -58.02 -27.73 63.81 Favored 'General case' 0 N--CA 1.449 -0.475 0 O-C-N 121.634 -0.666 . . . . 0.0 112.161 -179.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -54.49 -47.05 73.5 Favored 'General case' 0 C--O 1.219 -0.503 0 C-N-CA 124.333 1.053 . . . . 0.0 111.345 170.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.412 ' SG ' ' CA ' ' A' ' 29' ' ' CYS . 6.3 m -67.47 -33.16 74.56 Favored 'General case' 0 CA--C 1.498 -1.027 0 C-N-CA 125.922 1.689 . . . . 0.0 107.614 -175.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 33.4 m0 -64.55 -65.79 0.63 Allowed 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 106.53 -1.656 . . . . 0.0 106.53 177.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 21.4 p -55.87 -29.76 60.43 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 118.583 -0.723 . . . . 0.0 111.999 -179.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.25 -54.76 18.0 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 119.298 0.953 . . . . 0.0 111.27 175.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.8 t -60.0 -36.92 78.23 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-O 121.55 0.691 . . . . 0.0 110.089 179.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 75.0 mttt -60.82 -54.39 45.69 Favored 'General case' 0 N--CA 1.436 -1.141 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.938 174.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -43.98 -53.89 5.85 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 124.198 0.999 . . . . 0.0 111.001 177.948 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 91.7 t -77.32 -60.43 2.31 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.836 0 C-N-CA 124.543 1.137 . . . . 0.0 109.775 -173.237 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 30.8 p -103.52 -42.13 5.77 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 122.788 0.435 . . . . 0.0 111.95 -167.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 110.29 -16.5 29.63 Favored Glycine 0 CA--C 1.536 1.365 0 C-N-CA 124.567 1.08 . . . . 0.0 111.234 -165.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 3.5 m -82.75 65.33 7.82 Favored 'General case' 0 C--O 1.224 -0.252 0 C-N-CA 124.276 1.03 . . . . 0.0 110.339 -165.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -74.27 34.86 0.94 Allowed Glycine 0 CA--C 1.538 1.508 0 N-CA-C 117.856 1.902 . . . . 0.0 117.856 -155.132 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 57.4 mt-30 -113.65 124.83 53.24 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 119.891 1.845 . . . . 0.0 109.428 -177.05 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -170.73 -168.21 32.17 Favored Glycine 0 CA--C 1.523 0.559 0 CA-C-N 119.161 0.891 . . . . 0.0 112.529 -175.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -159.81 142.03 13.33 Favored 'General case' 0 CA--C 1.52 -0.207 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 175.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . 0.412 ' CA ' ' SG ' ' A' ' 14' ' ' CYS . 0.5 OUTLIER -86.54 157.52 19.73 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 108.188 -1.041 . . . . 0.0 108.188 -179.514 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 15.5 tt0 -136.67 123.93 21.86 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 105.383 -2.08 . . . . 0.0 105.383 176.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 22.2 t30 68.5 -92.75 0.03 OUTLIER 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 118.805 0.73 . . . . 0.0 109.795 167.244 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 24.3 m120 -154.46 57.05 0.7 Allowed 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 127.561 2.344 . . . . 0.0 105.691 160.486 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.7 mp0 -144.69 175.44 10.16 Favored 'General case' 0 N--CA 1.445 -0.68 0 C-N-CA 130.356 3.463 . . . . 0.0 103.097 175.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.2 m -149.91 161.85 41.48 Favored 'General case' 0 CA--C 1.504 -0.792 0 O-C-N 120.636 -1.29 . . . . 0.0 110.629 -173.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 49.6 mtp180 -139.63 150.72 45.29 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 -175.292 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 49.3 t -137.48 146.98 44.9 Favored 'General case' 0 N--CA 1.463 0.218 0 O-C-N 124.4 1.062 . . . . 0.0 110.398 -173.034 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 87.3 t80 . . . . . 0 N--CA 1.452 -0.328 0 C-N-CA 126.617 1.967 . . . . 0.0 109.344 -171.346 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.1 pt? . . . . . 0 N--CA 1.448 -0.54 0 N-CA-C 105.738 -1.949 . . . . 0.0 105.738 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -132.31 -176.45 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 N-CA-C 107.745 -1.205 . . . . 0.0 107.745 -175.226 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.452 ' CG ' ' HZ3' ' A' ' 7' ' ' LYS . 26.6 t0 -137.39 84.92 2.09 Favored 'General case' 0 N--CA 1.457 -0.097 0 CA-C-O 121.89 0.852 . . . . 0.0 110.928 163.821 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 94.6 t -128.35 136.43 60.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 N-CA-C 105.382 -2.081 . . . . 0.0 105.382 156.313 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.452 ' HZ3' ' CG ' ' A' ' 5' ' ' ASP . 13.2 mptt -70.42 115.74 9.95 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 123.765 0.826 . . . . 0.0 110.932 -168.381 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -68.69 125.38 26.37 Favored 'General case' 0 CA--C 1.514 -0.419 0 C-N-CA 122.661 0.385 . . . . 0.0 110.304 177.114 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -77.66 -27.13 50.82 Favored 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 124.61 1.194 . . . . 0.0 109.588 151.118 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -179.7 153.91 0.57 Allowed 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 124.417 1.087 . . . . 0.0 108.796 -172.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 36.7 m -49.51 -38.85 32.01 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 124.027 0.931 . . . . 0.0 113.04 173.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.3 p -62.12 -20.36 63.98 Favored 'General case' 0 N--CA 1.445 -0.71 0 C-N-CA 122.775 0.43 . . . . 0.0 112.127 -178.383 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.07 -50.74 18.3 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-N 118.509 0.595 . . . . 0.0 109.622 176.09 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 17.7 m -46.35 -28.65 1.39 Allowed 'General case' 0 CA--C 1.51 -0.575 0 C-N-CA 126.91 2.084 . . . . 0.0 110.52 -179.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 29.6 m0 -60.56 -71.43 0.14 Allowed 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 114.524 -1.217 . . . . 0.0 108.107 172.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -50.14 -31.04 12.5 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 124.109 0.964 . . . . 0.0 112.284 175.066 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.06 -54.77 32.81 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 120.273 1.397 . . . . 0.0 110.887 173.167 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 2.5 t -58.22 -35.72 72.09 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.863 0.84 . . . . 0.0 110.286 179.781 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 33.4 mtpt -63.22 -50.61 69.57 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.313 175.245 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -48.43 -55.41 10.96 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.91 0.884 . . . . 0.0 110.644 177.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -66.16 -61.35 1.73 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 179.05 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 81.9 p -107.78 -46.6 3.76 Favored 'General case' 0 C--N 1.338 0.107 0 CA-C-O 120.877 0.37 . . . . 0.0 111.16 -166.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 117.3 -16.94 12.71 Favored Glycine 0 CA--C 1.531 1.074 0 CA-C-N 115.295 -0.866 . . . . 0.0 111.303 -164.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 43.3 t -78.35 62.42 3.0 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 125.327 1.451 . . . . 0.0 110.683 -168.543 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -68.48 28.03 0.27 Allowed Glycine 0 CA--C 1.54 1.646 0 N-CA-C 118.369 2.108 . . . . 0.0 118.369 -157.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 58.2 mt-30 -113.06 108.07 16.82 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 120.584 2.192 . . . . 0.0 110.258 -173.473 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -157.44 -168.2 19.57 Favored Glycine 0 C--N 1.339 0.722 0 CA-C-O 119.872 -0.404 . . . . 0.0 112.599 -174.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -156.37 157.97 36.57 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 126.206 1.802 . . . . 0.0 107.718 170.872 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.51 162.82 15.5 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 108.725 -0.842 . . . . 0.0 108.725 178.108 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 20.4 tt0 -139.24 121.16 15.54 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 106.733 -1.58 . . . . 0.0 106.733 168.294 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 72.27 -88.22 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 123.051 0.54 . . . . 0.0 109.884 170.508 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.7 m120 -159.06 52.81 0.39 Allowed 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 128.55 2.74 . . . . 0.0 105.566 161.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 36.3 mt-30 -137.19 -175.19 3.97 Favored 'General case' 0 N--CA 1.444 -0.728 0 C-N-CA 128.933 2.893 . . . . 0.0 103.358 163.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.6 m -153.86 165.98 34.35 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 119.317 0.962 . . . . 0.0 110.321 -171.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 29.1 mtp180 -147.74 152.88 38.51 Favored 'General case' 0 CA--C 1.516 -0.357 0 C-N-CA 124.747 1.219 . . . . 0.0 108.326 -168.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 48.7 t -145.34 148.2 33.14 Favored 'General case' 0 C--N 1.328 -0.35 0 O-C-N 124.48 1.112 . . . . 0.0 109.491 -174.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.536 0.408 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -169.503 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.3 pt? . . . . . 0 N--CA 1.452 -0.351 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -143.09 159.06 17.8 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.25 0 N-CA-C 106.298 -1.741 . . . . 0.0 106.298 -169.244 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -100.95 8.89 42.84 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 -164.014 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 93.3 t -78.7 136.2 24.36 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 O-C-N 121.687 -0.633 . . . . 0.0 110.68 -170.705 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -61.9 95.41 0.06 Allowed 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 125.419 1.488 . . . . 0.0 111.198 -177.177 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -61.38 120.18 9.96 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.557 170.851 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -83.18 -20.59 34.37 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 124.983 1.427 . . . . 0.0 109.941 151.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -178.83 150.19 0.48 Allowed 'General case' 0 C--N 1.341 0.239 0 C-N-CA 124.432 1.093 . . . . 0.0 109.123 -175.187 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 57.9 m -47.81 -35.61 10.42 Favored 'General case' 0 C--N 1.333 -0.129 0 C-N-CA 124.787 1.235 . . . . 0.0 113.754 173.079 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.0 p -61.24 -28.56 69.25 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 179.643 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -55.13 -54.65 40.46 Favored 'General case' 0 C--O 1.226 -0.175 0 C-N-CA 123.204 0.602 . . . . 0.0 109.507 174.563 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 11.4 m -55.02 -31.46 61.07 Favored 'General case' 0 N--CA 1.443 -0.811 0 C-N-CA 128.684 2.794 . . . . 0.0 109.253 -174.273 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 39.0 m0 -63.46 -68.34 0.35 Allowed 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 178.474 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -51.07 -32.23 21.43 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 118.345 -0.836 . . . . 0.0 112.163 175.483 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.54 -52.77 63.09 Favored 'General case' 0 C--N 1.339 0.136 0 CA-C-N 120.174 1.352 . . . . 0.0 110.326 174.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.8 t -62.46 -35.06 78.12 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 121.247 0.546 . . . . 0.0 110.434 179.3 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 41.7 mtpt -61.94 -51.92 66.15 Favored 'General case' 0 N--CA 1.44 -0.949 0 CA-C-O 121.788 0.804 . . . . 0.0 109.666 176.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.6 tptm -56.69 -42.41 79.04 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.19 -0.913 . . . . 0.0 111.493 -179.214 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 37.5 t -70.52 -59.49 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.357 0 C-N-CA 124.059 0.944 . . . . 0.0 109.447 179.195 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.7 t -117.63 -46.48 2.66 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.855 0.862 . . . . 0.0 111.966 -166.366 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 125.72 -25.04 5.68 Favored Glycine 0 CA--C 1.53 0.972 0 N-CA-C 111.162 -0.775 . . . . 0.0 111.162 -175.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 31.2 t -78.76 73.54 5.31 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 125.413 1.485 . . . . 0.0 108.821 -172.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -70.91 39.91 0.54 Allowed Glycine 0 CA--C 1.54 1.619 0 N-CA-C 116.294 1.278 . . . . 0.0 116.294 -168.451 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 64.2 mt-30 -114.79 115.75 27.52 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 126.217 1.807 . . . . 0.0 108.353 -174.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -170.93 -162.87 24.01 Favored Glycine 0 C--N 1.333 0.366 0 CA-C-N 119.524 1.056 . . . . 0.0 111.257 -176.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 4.6 pttp -167.06 164.81 15.91 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 165.319 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -87.39 172.11 10.07 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 119.999 -0.68 . . . . 0.0 110.153 -176.653 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -145.31 121.67 10.95 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 105.098 -2.186 . . . . 0.0 105.098 172.53 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 64.5 t30 68.86 -93.4 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 119.372 0.987 . . . . 0.0 110.23 169.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 26.1 m120 -153.8 52.03 0.69 Allowed 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 128.315 2.646 . . . . 0.0 106.002 161.532 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -139.17 177.58 7.8 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 131.07 3.748 . . . . 0.0 102.609 175.238 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.3 m -150.56 163.68 37.88 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-N 120.624 1.556 . . . . 0.0 111.647 -173.083 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 50.7 mtp180 -142.39 150.8 41.15 Favored 'General case' 0 CA--C 1.512 -0.518 0 C-N-CA 124.061 0.944 . . . . 0.0 109.686 -170.395 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 52.5 t -141.21 133.88 28.67 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 124.658 1.224 . . . . 0.0 112.694 -174.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 . . . . . 0 N--CA 1.451 -0.379 0 C-N-CA 126.573 1.949 . . . . 0.0 109.715 178.129 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.4 pt? . . . . . 0 N--CA 1.451 -0.402 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -137.07 162.57 33.87 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.18 0 N-CA-C 107.108 -1.441 . . . . 0.0 107.108 -167.095 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -90.56 -16.91 27.9 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 124.501 1.12 . . . . 0.0 112.621 -172.147 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 58.6 t -75.21 134.59 29.01 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 CA-C-N 118.795 0.725 . . . . 0.0 111.799 -157.321 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.2 tmtt? -37.7 106.31 0.05 OUTLIER 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 127.578 2.351 . . . . 0.0 112.104 173.067 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -75.28 135.22 40.95 Favored 'General case' 0 CA--C 1.515 -0.388 0 C-N-CA 120.332 -0.547 . . . . 0.0 109.915 168.907 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -95.12 -16.37 22.66 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 158.512 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 178.51 166.43 0.83 Allowed 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 106.099 -1.815 . . . . 0.0 106.099 -172.726 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.9 p -61.31 -39.33 90.09 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 124.06 0.944 . . . . 0.0 111.48 172.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.6 p -56.83 -40.96 76.99 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 122.86 0.464 . . . . 0.0 111.0 -177.455 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -40.66 -56.87 2.02 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.634 1.174 . . . . 0.0 111.078 170.546 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 23.7 m -57.95 -28.37 64.25 Favored 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 128.026 2.53 . . . . 0.0 109.73 -173.311 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 33.2 m0 -64.65 -66.15 0.58 Allowed 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 107.186 -1.413 . . . . 0.0 107.186 177.534 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -51.67 -33.14 32.54 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 118.085 -0.959 . . . . 0.0 111.696 174.409 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.85 -54.33 36.69 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 120.107 1.321 . . . . 0.0 110.742 175.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 5.1 t -58.12 -37.16 74.06 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.071 0.463 . . . . 0.0 110.46 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 40.3 mtmt -63.5 -58.71 6.15 Favored 'General case' 0 N--CA 1.44 -0.943 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.706 177.079 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 64.3 mmtt -49.55 -47.12 49.3 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.324 1.05 . . . . 0.0 111.772 178.11 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 43.7 t -70.87 -60.02 2.86 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.77 0 C-N-CA 123.962 0.905 . . . . 0.0 109.15 -178.08 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.2 m -118.58 -41.54 2.81 Favored 'General case' 0 N--CA 1.439 -1.004 0 C-N-CA 123.591 0.756 . . . . 0.0 110.987 -161.103 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 120.81 -21.36 8.44 Favored Glycine 0 CA--C 1.534 1.24 0 C-N-CA 124.925 1.25 . . . . 0.0 112.336 -177.778 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 21.5 m -88.22 61.12 6.09 Favored 'General case' 0 C--O 1.223 -0.297 0 C-N-CA 124.709 1.204 . . . . 0.0 110.331 -160.653 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -64.15 23.39 0.09 OUTLIER Glycine 0 CA--C 1.54 1.623 0 N-CA-C 120.414 2.926 . . . . 0.0 120.414 -152.626 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -108.38 118.2 36.16 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 121.129 2.465 . . . . 0.0 109.903 -176.3 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -164.04 -170.51 29.06 Favored Glycine 0 CA--C 1.528 0.876 0 N-CA-C 112.195 -0.362 . . . . 0.0 112.195 -174.589 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -156.34 156.08 33.33 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 125.138 1.375 . . . . 0.0 107.879 174.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -92.14 160.57 15.13 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 178.485 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.8 tp-100 -133.62 126.69 31.41 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 105.896 -1.89 . . . . 0.0 105.896 165.659 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.2 t30 69.04 -78.91 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 164.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -166.63 44.86 0.06 Allowed 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 130.411 3.484 . . . . 0.0 108.894 170.388 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -147.61 179.35 7.75 Favored 'General case' 0 N--CA 1.442 -0.825 0 C-N-CA 128.875 2.87 . . . . 0.0 104.167 177.453 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 5.0 m -153.94 164.75 37.9 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 119.894 1.224 . . . . 0.0 110.399 -169.422 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 73.4 mtp180 -140.0 152.93 46.68 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 125.651 1.58 . . . . 0.0 108.976 -178.685 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 36.8 t -132.59 162.63 30.8 Favored 'General case' 0 C--O 1.224 -0.26 0 O-C-N 124.652 1.22 . . . . 0.0 109.34 178.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.534 0.355 0 CA-C-N 118.651 0.66 . . . . 0.0 111.365 -177.294 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.456 -0.169 0 N-CA-C 111.992 0.367 . . . . 0.0 111.992 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -126.1 167.09 21.13 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.995 0 N-CA-C 105.843 -1.91 . . . . 0.0 105.843 176.973 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -127.72 57.04 1.54 Allowed 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 122.0 0.905 . . . . 0.0 109.892 -177.197 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 43.6 t -128.37 143.8 39.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 N-CA-C 108.231 -1.025 . . . . 0.0 108.231 167.187 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -55.37 132.77 48.94 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 125.19 1.396 . . . . 0.0 113.312 -174.351 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -86.2 139.1 31.36 Favored 'General case' 0 CA--C 1.516 -0.363 0 C-N-CA 123.12 0.568 . . . . 0.0 109.672 164.107 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -91.01 -20.65 21.87 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 124.171 0.92 . . . . 0.0 109.543 154.497 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -178.91 173.47 1.2 Allowed 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 126.972 2.109 . . . . 0.0 106.273 -172.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 31.3 m -64.15 -32.86 74.6 Favored 'General case' 0 N--CA 1.462 0.135 0 C-N-CA 123.668 0.787 . . . . 0.0 112.631 173.332 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -54.12 -54.62 37.0 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 122.134 0.969 . . . . 0.0 110.723 -172.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.5 mp0 -32.57 -57.64 0.34 Allowed 'General case' 0 N--CA 1.429 -1.514 0 C-N-CA 128.07 2.548 . . . . 0.0 114.285 168.577 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 14.5 m -54.17 -29.28 45.04 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 126.376 1.87 . . . . 0.0 109.679 -175.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 30.9 m0 -66.92 -66.54 0.54 Allowed 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 106.214 -1.772 . . . . 0.0 106.214 -179.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -50.36 -32.34 17.08 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 124.018 0.927 . . . . 0.0 111.392 174.815 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.85 -56.42 19.54 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 119.578 1.081 . . . . 0.0 109.732 175.056 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -60.15 -34.05 73.02 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-O 121.048 0.451 . . . . 0.0 111.057 179.478 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 32.6 mtpt -63.72 -54.58 33.2 Favored 'General case' 0 N--CA 1.442 -0.847 0 O-C-N 121.618 -0.676 . . . . 0.0 111.103 176.793 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -57.19 -39.27 75.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.521 178.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 31.8 t -73.32 -67.89 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.431 -1.4 0 C-N-CA 124.293 1.037 . . . . 0.0 109.218 179.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -107.29 -40.23 5.45 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 122.956 0.502 . . . . 0.0 112.063 -170.481 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 117.61 -15.97 12.64 Favored Glycine 0 CA--C 1.532 1.152 0 C-N-CA 124.608 1.099 . . . . 0.0 110.822 -166.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 30.4 t -82.22 64.82 7.07 Favored 'General case' 0 CA--C 1.527 0.094 0 C-N-CA 124.353 1.061 . . . . 0.0 110.092 -166.568 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -70.97 38.38 0.52 Allowed Glycine 0 CA--C 1.535 1.339 0 N-CA-C 117.916 1.926 . . . . 0.0 117.916 -160.06 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 -121.04 114.07 20.96 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 120.071 1.936 . . . . 0.0 108.58 -179.189 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -158.22 -177.69 31.55 Favored Glycine 0 CA--C 1.523 0.534 0 N-CA-C 111.52 -0.632 . . . . 0.0 111.52 -175.498 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -153.35 145.29 23.62 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 106.922 -1.51 . . . . 0.0 106.922 177.637 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -88.51 165.88 14.57 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 178.663 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -138.77 118.33 12.98 Favored 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 105.656 -1.979 . . . . 0.0 105.656 171.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 63.46 -89.32 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.455 0.702 . . . . 0.0 110.556 172.549 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.2 m120 -153.25 53.65 0.75 Allowed 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 127.001 2.121 . . . . 0.0 107.07 168.142 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -143.62 166.17 25.58 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 103.036 -2.949 . . . . 0.0 103.036 173.038 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.2 m -143.12 158.31 43.73 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 120.853 1.66 . . . . 0.0 110.257 -174.436 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 33.5 mtp180 -142.82 154.12 43.87 Favored 'General case' 0 CA--C 1.514 -0.433 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 -172.024 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 41.8 t -133.4 140.71 47.49 Favored 'General case' 0 C--N 1.328 -0.331 0 O-C-N 124.16 0.913 . . . . 0.0 110.15 -172.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 82.8 t80 . . . . . 0 N--CA 1.455 -0.222 0 C-N-CA 125.568 1.547 . . . . 0.0 109.81 -163.258 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.5 pt? . . . . . 0 N--CA 1.453 -0.294 0 N-CA-C 114.926 1.454 . . . . 0.0 114.926 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -138.98 154.2 25.7 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.495 0 N-CA-C 104.348 -2.464 . . . . 0.0 104.348 -165.559 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -122.89 35.16 4.94 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 119.635 1.107 . . . . 0.0 111.089 -171.252 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.3 p -77.43 136.98 23.22 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-N 116.141 -0.481 . . . . 0.0 109.774 172.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 37.5 mtpt -66.16 96.01 0.31 Allowed 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.453 1.101 . . . . 0.0 112.221 -175.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.9 p -61.95 131.42 49.64 Favored 'General case' 0 CA--C 1.519 -0.213 0 O-C-N 123.789 0.681 . . . . 0.0 110.847 176.571 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 81.8 m-85 -88.36 -26.64 22.09 Favored 'General case' 0 N--CA 1.444 -0.771 0 C-N-CA 125.627 1.571 . . . . 0.0 108.749 155.194 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -165.87 160.27 16.73 Favored 'General case' 0 C--N 1.344 0.364 0 C-N-CA 123.548 0.739 . . . . 0.0 109.815 179.622 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.9 p -58.26 -41.24 83.81 Favored 'General case' 0 C--N 1.333 -0.118 0 C-N-CA 123.924 0.889 . . . . 0.0 111.404 173.713 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.39 -24.98 63.89 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 122.81 0.444 . . . . 0.0 111.672 -178.332 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 45.1 tt0 -61.85 -44.56 96.58 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 121.708 -0.62 . . . . 0.0 111.204 172.428 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 29.0 m -59.6 -27.91 66.71 Favored 'General case' 0 N--CA 1.439 -0.993 0 C-N-CA 125.687 1.595 . . . . 0.0 108.871 -177.079 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 36.5 m0 -65.98 -67.5 0.44 Allowed 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 107.444 -1.317 . . . . 0.0 107.444 178.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -53.26 -28.32 27.03 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.921 0.889 . . . . 0.0 111.57 175.019 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.02 -55.65 17.71 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 119.549 1.068 . . . . 0.0 110.23 174.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.2 t -61.08 -32.82 72.47 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 110.439 -0.208 . . . . 0.0 110.439 -179.434 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.6 mtmp? -63.41 -61.39 2.38 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-O 121.156 0.503 . . . . 0.0 110.853 174.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 17.1 pttm -59.52 -31.31 69.27 Favored 'General case' 0 N--CA 1.44 -0.964 0 N-CA-C 112.403 0.52 . . . . 0.0 112.403 -174.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 53.9 t -79.42 -57.57 5.03 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.514 0 C-N-CA 124.281 1.032 . . . . 0.0 109.865 176.309 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 13.2 t -140.64 25.34 2.19 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 113.753 1.02 . . . . 0.0 113.753 -162.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.35 -24.19 0.27 Allowed Glycine 0 CA--C 1.537 1.465 0 O-C-N 120.902 -1.123 . . . . 0.0 115.247 177.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 47.4 m -87.92 64.98 8.12 Favored 'General case' 0 C--O 1.223 -0.324 0 O-C-N 121.122 -1.223 . . . . 0.0 110.603 -155.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -66.79 23.49 0.18 Allowed Glycine 0 CA--C 1.538 1.513 0 N-CA-C 119.589 2.596 . . . . 0.0 119.589 -154.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -111.7 121.91 46.39 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 120.736 2.268 . . . . 0.0 109.709 -175.078 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -170.82 -166.08 29.15 Favored Glycine 0 C--N 1.337 0.613 0 CA-C-N 118.742 0.701 . . . . 0.0 111.832 -177.675 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.63 155.54 21.94 Favored 'General case' 0 CA--C 1.52 -0.177 0 C-N-CA 124.8 1.24 . . . . 0.0 108.586 174.51 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -91.37 166.15 13.04 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 -178.594 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -148.79 121.64 8.73 Favored 'General case' 0 C--O 1.22 -0.483 0 N-CA-C 105.345 -2.095 . . . . 0.0 105.345 -179.197 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 57.65 -94.94 0.05 Allowed 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.913 1.233 . . . . 0.0 109.717 178.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 21.0 m120 -147.22 61.47 1.17 Allowed 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 126.509 1.924 . . . . 0.0 106.926 165.348 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 21.4 mp0 -147.09 173.64 12.3 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 129.5 3.12 . . . . 0.0 105.062 177.547 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.7 m -150.52 157.08 42.59 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 -176.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.06 143.26 27.07 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 124.213 1.005 . . . . 0.0 109.036 -174.053 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 40.7 t -131.45 148.25 52.63 Favored 'General case' 0 C--N 1.338 0.09 0 O-C-N 123.853 0.72 . . . . 0.0 110.47 -164.385 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 87.7 t80 . . . . . 0 N--CA 1.455 -0.218 0 C-N-CA 125.901 1.68 . . . . 0.0 109.722 -168.276 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.5 pt? . . . . . 0 N--CA 1.454 -0.275 0 N-CA-C 115.184 1.55 . . . . 0.0 115.184 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -136.17 159.2 38.78 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.66 0 N-CA-C 103.984 -2.598 . . . . 0.0 103.984 -170.589 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -137.27 47.53 2.1 Favored 'General case' 0 C--N 1.328 -0.354 0 O-C-N 120.901 -1.124 . . . . 0.0 109.234 -173.085 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 87.7 t -97.6 139.35 20.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 171.534 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.72 105.91 0.18 Allowed 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -175.22 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.2 p -67.64 133.84 50.08 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 169.437 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -78.86 -33.33 45.95 Favored 'General case' 0 N--CA 1.454 -0.236 0 O-C-N 124.335 1.022 . . . . 0.0 109.003 151.613 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -172.76 156.86 3.59 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 124.213 1.005 . . . . 0.0 108.374 -175.33 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 58.8 m -46.94 -45.88 21.03 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 124.488 1.115 . . . . 0.0 112.617 175.523 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.3 m -63.83 -11.7 29.61 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 -177.464 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.9 -48.41 31.03 Favored 'General case' 0 C--O 1.215 -0.74 0 CA-C-N 119.29 0.95 . . . . 0.0 109.271 168.427 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 18.4 m -48.71 -29.91 4.97 Favored 'General case' 0 CA--C 1.513 -0.473 0 C-N-CA 125.944 1.698 . . . . 0.0 110.1 -178.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 42.2 m0 -62.31 -68.09 0.36 Allowed 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 107.01 -1.478 . . . . 0.0 107.01 175.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -52.89 -28.51 23.54 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 117.789 -1.101 . . . . 0.0 112.444 173.931 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.3 -53.46 52.49 Favored 'General case' 0 C--O 1.228 -0.065 0 CA-C-N 121.306 1.866 . . . . 0.0 109.903 174.7 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -61.95 -34.14 75.56 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.122 178.535 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 40.8 mtmt -65.31 -52.15 55.93 Favored 'General case' 0 N--CA 1.445 -0.695 0 O-C-N 121.835 -0.541 . . . . 0.0 111.502 176.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 65.6 mttt -49.76 -45.95 50.05 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.243 1.417 . . . . 0.0 109.938 177.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 95.1 t -76.79 -69.84 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.424 -1.732 0 C-N-CA 124.252 1.021 . . . . 0.0 109.887 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 47.0 p -98.31 -49.04 4.83 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 122.457 0.303 . . . . 0.0 111.445 -169.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 123.35 -17.52 7.91 Favored Glycine 0 CA--C 1.533 1.207 0 C-N-CA 124.961 1.267 . . . . 0.0 111.193 -163.434 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 5.0 m -81.9 64.66 6.69 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 124.483 1.113 . . . . 0.0 110.612 -165.387 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -71.77 38.93 0.63 Allowed Glycine 0 CA--C 1.539 1.539 0 N-CA-C 118.26 2.064 . . . . 0.0 118.26 -155.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -123.27 133.03 54.21 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 120.312 2.056 . . . . 0.0 109.171 -175.605 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 179.01 -164.31 32.51 Favored Glycine 0 CA--C 1.524 0.647 0 CA-C-N 119.24 0.927 . . . . 0.0 111.181 -177.375 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.75 158.07 32.9 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 123.946 0.898 . . . . 0.0 109.108 166.806 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -91.98 165.32 13.27 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 -178.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 -146.42 115.8 7.09 Favored 'General case' 0 N--CA 1.444 -0.761 0 N-CA-C 105.644 -1.984 . . . . 0.0 105.644 179.184 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 71.48 -83.3 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 118.743 0.701 . . . . 0.0 110.325 170.059 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 36.3 m120 -162.35 55.58 0.23 Allowed 'General case' 0 N--CA 1.463 0.181 0 C-N-CA 130.026 3.33 . . . . 0.0 104.639 164.102 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -143.93 174.44 10.84 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 129.278 3.031 . . . . 0.0 103.431 177.009 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.2 m -154.41 158.67 40.37 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-N 120.525 1.511 . . . . 0.0 108.952 -173.456 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.56 140.58 25.03 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 123.594 0.758 . . . . 0.0 109.684 -173.519 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 41.1 t -122.58 148.55 45.09 Favored 'General case' 0 C--N 1.34 0.195 0 C-N-CA 123.816 0.846 . . . . 0.0 110.49 -168.283 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 90.9 t80 . . . . . 0 N--CA 1.452 -0.359 0 C-N-CA 126.101 1.76 . . . . 0.0 109.846 -173.747 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.4 pt? . . . . . 0 N--CA 1.448 -0.537 0 N-CA-C 110.49 -0.189 . . . . 0.0 110.49 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -145.05 160.21 13.67 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.219 0 N-CA-C 106.403 -1.702 . . . . 0.0 106.403 -163.131 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -120.42 32.58 5.95 Favored 'General case' 0 C--N 1.332 -0.159 0 C-N-CA 123.542 0.737 . . . . 0.0 110.737 -173.378 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 97.0 t -82.88 133.87 28.15 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 N-CA-C 108.115 -1.069 . . . . 0.0 108.115 171.681 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.1 mtpp -65.26 94.24 0.16 Allowed 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 125.701 1.6 . . . . 0.0 112.057 -173.606 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.7 p -58.44 136.02 57.38 Favored 'General case' 0 N--CA 1.464 0.238 0 O-C-N 123.436 0.46 . . . . 0.0 110.616 173.517 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 82.0 m-85 -91.09 -27.25 18.7 Favored 'General case' 0 N--CA 1.445 -0.697 0 C-N-CA 126.592 1.957 . . . . 0.0 108.306 152.666 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -158.68 162.05 37.17 Favored 'General case' 0 C--N 1.344 0.329 0 CA-C-N 118.605 0.639 . . . . 0.0 110.834 179.087 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.8 p -61.88 -45.07 95.36 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 124.875 1.27 . . . . 0.0 111.234 173.003 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.9 p -55.04 -32.25 61.72 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 121.178 0.513 . . . . 0.0 111.092 -178.147 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 48.7 tt0 -51.98 -48.78 64.23 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 123.607 0.763 . . . . 0.0 111.937 172.493 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 32.9 m -56.62 -30.42 63.25 Favored 'General case' 0 N--CA 1.444 -0.774 0 C-N-CA 126.606 1.962 . . . . 0.0 109.006 -177.985 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 32.2 m0 -64.56 -64.08 0.97 Allowed 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 107.494 -1.299 . . . . 0.0 107.494 179.832 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -51.6 -35.41 41.39 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 118.385 -0.817 . . . . 0.0 111.463 173.563 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.66 -56.15 18.0 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 119.872 1.214 . . . . 0.0 110.559 -179.038 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -57.71 -36.55 72.14 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.37 0.605 . . . . 0.0 110.472 179.32 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.7 mtmp? -62.8 -50.74 69.8 Favored 'General case' 0 N--CA 1.435 -1.202 0 CA-C-N 115.589 -0.732 . . . . 0.0 112.442 177.507 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 65.9 mmtt -50.22 -52.99 31.29 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 123.66 0.784 . . . . 0.0 111.024 178.272 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -67.93 -63.95 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 CA-C-N 118.177 0.444 . . . . 0.0 111.651 177.537 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.9 m -116.92 -37.79 3.54 Favored 'General case' 0 N--CA 1.442 -0.838 0 C-N-CA 123.581 0.753 . . . . 0.0 110.465 -155.652 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 116.94 -14.83 13.92 Favored Glycine 0 CA--C 1.531 1.055 0 C-N-CA 123.196 0.427 . . . . 0.0 113.183 -178.757 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.7 t -82.04 67.29 7.98 Favored 'General case' 0 N--CA 1.465 0.313 0 O-C-N 121.601 -0.94 . . . . 0.0 109.621 -166.663 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -74.08 37.08 0.93 Allowed Glycine 0 CA--C 1.537 1.457 0 N-CA-C 116.964 1.546 . . . . 0.0 116.964 -159.407 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -122.65 126.71 48.16 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 125.814 1.645 . . . . 0.0 107.522 -175.481 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -179.37 -172.43 43.54 Favored Glycine 0 CA--C 1.525 0.663 0 CA-C-N 119.246 0.93 . . . . 0.0 111.922 -176.091 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.28 157.13 42.73 Favored 'General case' 0 C--O 1.232 0.135 0 C-N-CA 125.62 1.568 . . . . 0.0 107.457 166.878 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -89.74 151.63 21.73 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 178.474 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 54.7 tp60 -124.09 112.88 17.65 Favored 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 105.923 -1.88 . . . . 0.0 105.923 177.85 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 62.95 -89.77 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 119.256 0.934 . . . . 0.0 110.099 174.567 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -150.28 56.22 0.94 Allowed 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 126.713 2.005 . . . . 0.0 107.916 164.128 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -135.55 179.75 6.14 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 129.313 3.045 . . . . 0.0 103.953 166.047 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.2 m -150.43 147.44 27.55 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-N 119.457 1.026 . . . . 0.0 109.319 -178.265 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 41.7 mtt180 -140.18 136.59 33.61 Favored 'General case' 0 CA--C 1.513 -0.464 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 -173.407 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.8 t -126.16 167.46 15.38 Favored 'General case' 0 C--O 1.225 -0.187 0 O-C-N 124.577 1.173 . . . . 0.0 110.103 -162.929 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 28.6 t80 . . . . . 0 N--CA 1.452 -0.333 0 C-N-CA 124.394 1.078 . . . . 0.0 109.429 166.65 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.1 pt? . . . . . 0 CA--C 1.519 -0.219 0 N-CA-C 112.759 0.652 . . . . 0.0 112.759 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -132.15 171.13 18.57 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.208 0 N-CA-C 106.17 -1.789 . . . . 0.0 106.17 -170.382 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -133.42 83.44 2.05 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-O 122.26 1.028 . . . . 0.0 110.249 168.451 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 93.5 t -125.78 138.67 53.74 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 CA-C-N 113.956 -1.474 . . . . 0.0 107.374 160.819 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -68.58 106.25 2.52 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 124.495 1.118 . . . . 0.0 111.32 -169.34 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 5.8 p -66.67 130.44 43.18 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 120.784 0.326 . . . . 0.0 110.965 174.301 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -78.95 -36.21 41.99 Favored 'General case' 0 N--CA 1.442 -0.832 0 C-N-CA 125.351 1.46 . . . . 0.0 108.124 148.069 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -161.47 154.71 21.17 Favored 'General case' 0 C--O 1.222 -0.359 0 CA-C-N 118.44 0.563 . . . . 0.0 112.008 -177.451 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 27.9 m -50.75 -41.08 56.19 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 123.862 0.865 . . . . 0.0 112.583 173.606 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.31 -20.08 57.82 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 123.058 0.543 . . . . 0.0 112.292 -179.0 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 70.7 tt0 -72.03 -44.03 64.03 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 124.083 0.953 . . . . 0.0 110.79 176.05 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 20.8 m -55.16 -29.48 57.87 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 126.635 1.974 . . . . 0.0 108.874 179.21 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 36.1 m0 -64.83 -68.42 0.36 Allowed 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 179.288 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -54.71 -26.51 34.21 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 123.909 0.884 . . . . 0.0 111.557 175.938 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.14 -55.5 18.33 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 119.943 1.247 . . . . 0.0 109.806 174.003 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 3.8 t -55.16 -38.68 68.59 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.974 0.892 . . . . 0.0 110.278 178.579 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.9 mtmt -63.23 -53.6 50.5 Favored 'General case' 0 N--CA 1.434 -1.235 0 CA-C-N 115.159 -0.928 . . . . 0.0 110.519 177.133 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -52.98 -40.96 64.13 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 116.924 -1.512 . . . . 0.0 113.119 -179.007 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -67.98 -60.74 2.18 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 CA-C-N 119.314 0.961 . . . . 0.0 111.318 169.665 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 47.5 p -113.54 -65.96 1.13 Allowed 'General case' 0 N--CA 1.458 -0.065 0 CA-C-O 121.306 0.575 . . . . 0.0 110.45 -168.168 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 148.17 -23.05 1.41 Allowed Glycine 0 CA--C 1.529 0.963 0 CA-C-N 115.137 -0.938 . . . . 0.0 113.171 -170.757 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.2 p -82.44 72.36 9.51 Favored 'General case' 0 C--N 1.333 -0.139 0 O-C-N 121.553 -0.969 . . . . 0.0 109.666 -168.875 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -70.51 50.91 0.83 Allowed Glycine 0 CA--C 1.537 1.452 0 N-CA-C 117.034 1.574 . . . . 0.0 117.034 -163.057 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -131.53 101.9 5.7 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 125.421 1.488 . . . . 0.0 109.788 -165.188 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -161.82 -165.85 19.49 Favored Glycine 0 CA--C 1.525 0.681 0 CA-C-N 118.242 0.474 . . . . 0.0 113.467 -170.798 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 20.6 ttmm -162.98 144.91 10.14 Favored 'General case' 0 C--O 1.232 0.164 0 N-CA-C 107.403 -1.332 . . . . 0.0 107.403 178.853 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -87.64 162.19 17.27 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 -179.54 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.4 tp-100 -143.27 132.71 23.47 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 106.929 -1.508 . . . . 0.0 106.929 171.221 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 64.08 -91.26 0.03 OUTLIER 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 123.214 0.606 . . . . 0.0 109.975 170.065 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 23.2 m120 -155.42 62.92 0.61 Allowed 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 127.608 2.363 . . . . 0.0 105.781 158.234 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 17.2 mp0 -147.69 179.46 7.68 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 130.951 3.701 . . . . 0.0 103.983 174.267 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.5 m -152.84 161.17 42.89 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 121.11 -0.994 . . . . 0.0 109.572 -174.598 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.8 mtt85 -138.05 152.83 49.2 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 124.416 1.086 . . . . 0.0 109.26 179.406 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 53.5 t -136.45 137.72 40.72 Favored 'General case' 0 CA--C 1.522 -0.132 0 C-N-CA 124.317 1.047 . . . . 0.0 108.314 179.828 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.141 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 -153.933 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.8 pt? . . . . . 0 N--CA 1.453 -0.306 0 N-CA-C 106.592 -1.633 . . . . 0.0 106.592 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -139.41 159.21 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.176 0 N-CA-C 106.432 -1.692 . . . . 0.0 106.432 -174.212 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -92.89 -9.67 39.33 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.253 1.021 . . . . 0.0 112.244 -171.5 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 59.2 t -72.09 134.37 30.01 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 C-N-CA 119.953 -0.699 . . . . 0.0 110.55 -160.777 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -58.08 101.2 0.07 Allowed 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 125.568 1.547 . . . . 0.0 111.531 -174.385 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -68.25 129.13 39.0 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 109.265 -0.642 . . . . 0.0 109.265 168.869 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -91.7 -16.8 26.41 Favored 'General case' 0 N--CA 1.454 -0.258 0 O-C-N 124.353 1.033 . . . . 0.0 109.316 150.437 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -169.7 148.15 3.59 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 123.701 0.801 . . . . 0.0 109.069 -178.698 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 27.1 m -47.37 -39.64 15.65 Favored 'General case' 0 N--CA 1.46 0.034 0 C-N-CA 124.551 1.14 . . . . 0.0 112.092 170.899 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.2 p -61.37 -22.93 65.41 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-O 118.889 -0.577 . . . . 0.0 112.25 -177.933 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.86 -47.88 56.9 Favored 'General case' 0 C--O 1.216 -0.678 0 CA-C-N 119.437 1.017 . . . . 0.0 109.283 174.372 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 27.5 m -47.9 -28.32 2.6 Favored 'General case' 0 CA--C 1.512 -0.513 0 C-N-CA 126.227 1.811 . . . . 0.0 110.441 -177.486 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 39.0 m0 -64.34 -67.79 0.4 Allowed 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.339 -1.3 . . . . 0.0 107.735 176.633 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -52.24 -27.95 16.81 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-O 118.164 -0.922 . . . . 0.0 111.725 172.878 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.07 -61.57 1.97 Allowed 'General case' 0 C--N 1.339 0.151 0 CA-C-N 121.035 1.743 . . . . 0.0 110.986 175.929 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -57.81 -30.41 65.68 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.249 0.547 . . . . 0.0 110.533 179.295 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.7 mtmt -67.89 -49.72 60.36 Favored 'General case' 0 N--CA 1.443 -0.79 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 172.742 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 51.6 mttt -50.21 -49.64 52.07 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 124.695 1.198 . . . . 0.0 109.789 178.771 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -67.45 -67.21 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 CA-C-N 118.146 0.43 . . . . 0.0 111.412 173.762 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 18.5 m -114.26 -49.46 2.84 Favored 'General case' 0 N--CA 1.438 -1.046 0 C-N-CA 123.255 0.622 . . . . 0.0 110.425 -158.045 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 133.16 -15.79 4.74 Favored Glycine 0 CA--C 1.533 1.189 0 C-N-CA 123.013 0.339 . . . . 0.0 112.829 -171.729 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.0 m -79.27 61.74 3.44 Favored 'General case' 0 C--O 1.225 -0.191 0 C-N-CA 124.393 1.077 . . . . 0.0 111.868 -164.624 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -70.67 1.6 21.16 Favored Glycine 0 CA--C 1.536 1.36 0 N-CA-C 116.159 1.223 . . . . 0.0 116.159 -158.71 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 60.0 mt-30 -90.66 110.81 21.98 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 119.846 1.823 . . . . 0.0 108.14 -176.631 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -164.44 -161.93 14.45 Favored Glycine 0 C--N 1.337 0.638 0 CA-C-N 118.741 0.701 . . . . 0.0 114.672 -170.879 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 6.9 mttp -169.29 150.58 4.35 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 123.935 0.894 . . . . 0.0 109.175 -175.179 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -94.32 160.47 14.66 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.932 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.0 tt0 -134.6 131.69 38.14 Favored 'General case' 0 N--CA 1.444 -0.767 0 N-CA-C 105.296 -2.113 . . . . 0.0 105.296 165.974 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 21.1 t30 67.22 -90.81 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 118.713 0.688 . . . . 0.0 110.574 163.522 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 31.1 m120 -156.16 53.83 0.56 Allowed 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 127.968 2.507 . . . . 0.0 106.107 164.032 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 25.0 mp0 -151.05 176.9 10.7 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 129.391 3.076 . . . . 0.0 103.818 -179.802 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.6 m -160.41 167.84 26.46 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 120.21 1.368 . . . . 0.0 111.137 -165.47 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 33.6 mtp180 -146.58 160.83 41.66 Favored 'General case' 0 CA--C 1.518 -0.266 0 C-N-CA 125.054 1.342 . . . . 0.0 109.255 179.809 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 29.0 p -131.32 177.89 7.13 Favored 'General case' 0 CA--C 1.513 -0.445 0 O-C-N 124.507 1.129 . . . . 0.0 109.88 162.399 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 3.8 p90 . . . . . 0 N--CA 1.446 -0.633 0 C-N-CA 124.197 0.999 . . . . 0.0 111.879 -172.356 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.2 pt? . . . . . 0 N--CA 1.452 -0.371 0 CA-C-O 120.533 0.206 . . . . 0.0 110.582 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -143.61 158.92 16.74 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.205 0 N-CA-C 106.063 -1.828 . . . . 0.0 106.063 -160.551 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -120.39 30.22 7.06 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 121.745 0.783 . . . . 0.0 112.352 -174.226 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 52.4 t -85.79 134.42 27.26 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 171.787 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.6 mptt -69.82 107.29 3.46 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 125.443 1.497 . . . . 0.0 112.056 -165.181 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -63.3 126.16 26.51 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 123.896 0.878 . . . . 0.0 109.968 171.219 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -82.73 -21.55 34.72 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 124.873 1.358 . . . . 0.0 109.173 153.128 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -175.64 179.24 1.45 Allowed 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 126.174 1.79 . . . . 0.0 106.588 -176.156 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 39.7 m -70.98 -34.02 70.99 Favored 'General case' 0 N--CA 1.461 0.104 0 C-N-CA 125.497 1.519 . . . . 0.0 113.093 173.779 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -52.88 -56.3 16.84 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-O 122.065 0.936 . . . . 0.0 110.963 -172.36 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . 0.269 8.4 mp0 -20.97 -59.44 0.03 OUTLIER 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 128.93 2.892 . . . . 0.0 115.761 159.4 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 31.6 m -61.08 -27.29 68.25 Favored 'General case' 0 N--CA 1.442 -0.828 0 C-N-CA 125.706 1.602 . . . . 0.0 109.09 -172.295 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 35.9 m0 -69.7 -64.85 0.8 Allowed 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 -179.007 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -52.78 -30.79 34.96 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 124.049 0.939 . . . . 0.0 110.869 174.76 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.22 -57.98 8.71 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 119.385 0.993 . . . . 0.0 110.329 173.615 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -59.21 -32.21 69.73 Favored 'General case' 0 CA--C 1.521 -0.15 0 O-C-N 121.989 -0.444 . . . . 0.0 111.063 -179.461 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.6 mtmt -64.95 -57.09 9.65 Favored 'General case' 0 N--CA 1.437 -1.122 0 CA-C-O 120.797 0.332 . . . . 0.0 111.1 176.2 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.2 mtpt -56.46 -38.27 71.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.591 -179.858 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 40.6 t -70.03 -61.94 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.427 -1.615 0 C-N-CA 123.848 0.859 . . . . 0.0 109.172 176.948 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.2 m -120.6 -45.69 2.4 Favored 'General case' 0 N--CA 1.436 -1.137 0 C-N-CA 123.628 0.771 . . . . 0.0 111.16 -162.877 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 126.26 -20.05 6.3 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 124.636 1.112 . . . . 0.0 111.997 -173.376 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 31.0 t -84.23 65.58 8.89 Favored 'General case' 0 C--N 1.333 -0.145 0 C-N-CA 124.691 1.197 . . . . 0.0 109.636 -166.136 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -71.03 40.27 0.55 Allowed Glycine 0 CA--C 1.533 1.183 0 N-CA-C 117.539 1.776 . . . . 0.0 117.539 -160.084 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -129.19 123.95 33.34 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 120.093 1.947 . . . . 0.0 109.261 -175.186 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -177.05 -166.22 33.64 Favored Glycine 0 C--N 1.335 0.507 0 N-CA-C 110.109 -1.196 . . . . 0.0 110.109 -175.543 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 6.7 mtmp? -153.89 166.02 34.26 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 124.492 1.117 . . . . 0.0 108.074 164.435 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -85.58 165.06 17.37 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 176.845 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -136.95 128.81 29.09 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 105.703 -1.962 . . . . 0.0 105.703 165.117 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 67.68 -89.9 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 123.238 0.615 . . . . 0.0 110.397 166.577 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 31.9 m120 -154.58 58.38 0.69 Allowed 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 127.314 2.246 . . . . 0.0 105.899 161.256 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 19.7 mp0 -151.15 176.45 11.17 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 129.288 3.035 . . . . 0.0 104.18 179.121 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.7 m -154.83 153.99 32.05 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-N 120.324 1.42 . . . . 0.0 110.73 -169.743 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 17.4 mtt180 -145.11 128.26 16.67 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 124.048 0.939 . . . . 0.0 110.204 -168.731 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -99.79 161.71 13.45 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 123.332 0.653 . . . . 0.0 111.453 178.039 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.454 -0.232 0 C-N-CA 123.811 0.844 . . . . 0.0 111.284 -171.272 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.3 pt? . . . . . 0 N--CA 1.447 -0.582 0 N-CA-C 106.439 -1.689 . . . . 0.0 106.439 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -131.73 -175.63 1.49 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.726 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 -165.742 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -141.58 83.81 1.88 Allowed 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 122.081 0.943 . . . . 0.0 110.86 161.07 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 80.5 t -130.14 134.57 62.51 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 N-CA-C 105.6 -2.0 . . . . 0.0 105.6 160.554 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.0 mptt -68.91 111.19 4.8 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 124.642 1.177 . . . . 0.0 110.263 -169.333 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -61.23 126.96 29.26 Favored 'General case' 0 CA--C 1.515 -0.376 0 C-N-CA 122.725 0.41 . . . . 0.0 110.191 175.518 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -89.67 -15.77 31.91 Favored 'General case' 0 N--CA 1.449 -0.488 0 O-C-N 125.003 1.439 . . . . 0.0 109.598 157.51 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 179.33 153.05 0.42 Allowed 'General case' 0 C--N 1.344 0.359 0 C-N-CA 125.485 1.514 . . . . 0.0 108.604 -177.146 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 24.4 m -54.95 -37.48 66.51 Favored 'General case' 0 N--CA 1.462 0.165 0 C-N-CA 123.056 0.542 . . . . 0.0 112.162 171.906 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.45 -23.18 64.22 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-O 119.427 -0.32 . . . . 0.0 111.765 179.076 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -67.46 -50.78 57.66 Favored 'General case' 0 C--O 1.217 -0.627 0 CA-C-N 118.655 0.661 . . . . 0.0 109.562 175.071 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 23.7 m -49.32 -27.31 3.79 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 126.108 1.763 . . . . 0.0 110.655 -177.108 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 31.2 m0 -63.36 -65.96 0.61 Allowed 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 114.821 -1.081 . . . . 0.0 108.192 173.271 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -52.95 -31.51 40.85 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-O 117.716 -1.135 . . . . 0.0 111.585 174.084 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.47 -55.46 27.43 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 121.686 2.039 . . . . 0.0 110.477 173.801 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 2.0 t -54.53 -37.46 65.41 Favored 'General case' 0 CA--C 1.527 0.087 0 C-N-CA 123.088 0.555 . . . . 0.0 109.858 178.259 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.7 mtpt -66.7 -54.24 25.16 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-O 121.351 0.596 . . . . 0.0 111.784 177.563 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 20.1 mtpp -53.75 -38.65 64.61 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 124.659 1.184 . . . . 0.0 110.25 -179.413 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 54.1 t -76.07 -61.63 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.426 -1.632 0 C-N-CA 124.734 1.214 . . . . 0.0 110.051 177.715 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 11.4 t -134.52 13.47 3.77 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 114.166 1.173 . . . . 0.0 114.166 -162.753 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 76.17 -26.19 1.53 Allowed Glycine 0 CA--C 1.537 1.424 0 O-C-N 120.317 -1.489 . . . . 0.0 114.259 178.658 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.4 m -81.17 62.8 5.26 Favored 'General case' 0 C--O 1.223 -0.333 0 C-N-CA 125.451 1.5 . . . . 0.0 111.511 -162.621 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -66.73 49.44 0.22 Allowed Glycine 0 CA--C 1.54 1.647 0 N-CA-C 119.023 2.369 . . . . 0.0 119.023 -156.807 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -130.92 118.71 21.08 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 120.477 2.139 . . . . 0.0 109.945 -173.419 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -172.98 -164.95 29.21 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 111.357 -0.697 . . . . 0.0 111.357 -177.378 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 58.4 mttt -160.56 161.13 32.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 124.882 1.273 . . . . 0.0 108.582 169.531 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -92.18 162.34 14.36 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 -177.674 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.7 tp-100 -133.55 133.72 42.47 Favored 'General case' 0 N--CA 1.444 -0.733 0 N-CA-C 106.069 -1.826 . . . . 0.0 106.069 166.407 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 63.55 -87.63 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 117.971 0.35 . . . . 0.0 111.64 168.084 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -161.02 63.94 0.29 Allowed 'General case' 0 C--O 1.227 -0.118 0 C-N-CA 129.681 3.192 . . . . 0.0 104.169 165.259 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -161.64 174.58 13.11 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 129.279 3.032 . . . . 0.0 103.007 -177.759 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.7 m -153.65 160.61 42.44 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 121.199 1.818 . . . . 0.0 111.075 -169.112 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 63.8 mtp180 -139.43 151.12 45.99 Favored 'General case' 0 CA--C 1.511 -0.554 0 C-N-CA 125.351 1.461 . . . . 0.0 108.812 178.559 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -154.5 154.32 32.95 Favored 'General case' 0 C--N 1.333 -0.124 0 O-C-N 124.117 0.886 . . . . 0.0 112.562 -178.885 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.243 0 CA-C-O 120.962 0.41 . . . . 0.0 111.037 -174.171 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 18.8 m-85 . . . . . 0 N--CA 1.451 -0.387 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -76.37 126.28 8.11 Favored Glycine 0 N--CA 1.445 -0.766 0 N-CA-C 108.272 -1.931 . . . . 0.0 108.272 173.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -141.76 130.93 23.38 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 118.776 1.288 . . . . 0.0 109.659 164.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -136.14 167.38 24.68 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.171 0 N-CA-C 106.563 -1.644 . . . . 0.0 106.563 -164.342 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -129.68 88.38 2.67 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 122.193 0.997 . . . . 0.0 108.718 162.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 99.1 t -133.23 137.9 52.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 159.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.4 mptt -41.04 107.66 0.08 Allowed 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 127.217 2.207 . . . . 0.0 112.746 178.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -68.16 133.57 49.11 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 167.231 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -93.62 -15.07 25.74 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 158.154 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 176.25 155.91 0.23 Allowed 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 125.902 1.681 . . . . 0.0 107.832 -175.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 40.6 m -51.46 -39.62 57.83 Favored 'General case' 0 C--O 1.227 -0.12 0 C-N-CA 123.006 0.522 . . . . 0.0 111.724 171.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.9 p -62.8 -20.21 64.79 Favored 'General case' 0 N--CA 1.445 -0.716 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -178.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.25 -49.2 36.87 Favored 'General case' 0 C--O 1.218 -0.569 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 175.107 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 20.3 m -46.63 -29.64 1.94 Allowed 'General case' 0 CA--C 1.503 -0.853 0 C-N-CA 126.106 1.762 . . . . 0.0 110.138 178.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 31.5 m0 -63.59 -66.06 0.59 Allowed 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 176.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -51.37 -35.95 40.98 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 118.455 -0.783 . . . . 0.0 111.75 174.776 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.08 -57.05 11.92 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 120.243 1.383 . . . . 0.0 111.376 177.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 17.7 m -58.8 -33.78 70.75 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 122.232 1.015 . . . . 0.0 110.895 -179.531 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.5 mtmt -69.23 -42.78 75.22 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-N 115.178 -0.919 . . . . 0.0 113.143 175.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 41.7 mttm -54.28 -53.8 48.83 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.519 0.328 . . . . 0.0 110.359 174.317 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -62.78 -57.14 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 178.339 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 60.2 p -116.4 -57.24 2.22 Favored 'General case' 0 CA--C 1.522 -0.117 0 CA-C-O 121.185 0.517 . . . . 0.0 110.897 -169.136 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 130.29 -15.19 5.57 Favored Glycine 0 CA--C 1.532 1.136 0 CA-C-N 114.874 -1.057 . . . . 0.0 112.07 -161.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 58.0 p -79.11 63.28 3.73 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 118.659 1.229 . . . . 0.0 111.049 -171.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -69.0 2.3 8.8 Favored Glycine 0 CA--C 1.533 1.187 0 O-C-N 121.517 -0.739 . . . . 0.0 114.916 -164.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 30.8 mt-30 -85.93 105.52 16.46 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 119.158 1.479 . . . . 0.0 107.375 -177.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -158.45 -172.81 26.06 Favored Glycine 0 CA--C 1.524 0.645 0 CA-C-O 121.148 0.304 . . . . 0.0 112.908 -172.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 4.4 ttmm -159.84 143.34 14.24 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 125.398 1.479 . . . . 0.0 107.658 -174.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.39 151.43 22.05 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 177.41 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 56.7 tp60 -125.31 116.9 22.66 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 105.079 -2.193 . . . . 0.0 105.079 172.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 66.04 -82.37 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 118.911 0.778 . . . . 0.0 111.481 168.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -157.9 43.29 0.31 Allowed 'General case' 0 N--CA 1.444 -0.727 0 C-N-CA 128.423 2.689 . . . . 0.0 109.649 171.214 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 26.5 mp0 -141.65 178.42 7.48 Favored 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 128.006 2.522 . . . . 0.0 105.091 172.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -159.27 152.47 22.31 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 119.185 0.902 . . . . 0.0 110.16 -164.444 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 8.8 mtt180 -146.29 132.87 19.81 Favored 'General case' 0 C--O 1.227 -0.09 0 CA-C-O 118.415 -0.802 . . . . 0.0 110.087 -167.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -102.91 164.17 11.78 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 123.712 0.805 . . . . 0.0 111.225 168.273 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 71.4 t80 . . . . . 0 N--CA 1.451 -0.392 0 C-N-CA 126.816 2.046 . . . . 0.0 109.384 177.98 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 . . . . . 0 N--CA 1.452 -0.327 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -59.81 117.1 10.17 Favored Glycine 0 N--CA 1.443 -0.84 0 N-CA-C 111.847 -0.501 . . . . 0.0 111.847 163.306 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -132.07 130.42 41.25 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 157.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -136.87 178.25 5.08 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.018 0 N-CA-C 107.429 -1.322 . . . . 0.0 107.429 -166.421 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 49.6 t0 -130.19 102.29 6.16 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 154.301 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -130.97 148.31 33.06 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 N-CA-C 105.995 -1.854 . . . . 0.0 105.995 148.79 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 42.7 mttm -64.57 115.46 5.21 Favored 'General case' 0 N--CA 1.444 -0.735 0 C-N-CA 123.828 0.851 . . . . 0.0 110.866 -170.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -73.22 119.55 17.62 Favored 'General case' 0 CA--C 1.511 -0.536 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 175.296 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -79.79 -22.88 42.57 Favored 'General case' 0 N--CA 1.449 -0.496 0 O-C-N 125.495 1.747 . . . . 0.0 109.078 156.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 178.97 154.17 0.41 Allowed 'General case' 0 C--N 1.344 0.344 0 C-N-CA 125.405 1.482 . . . . 0.0 108.751 -175.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.0 m -52.79 -38.71 61.52 Favored 'General case' 0 C--O 1.231 0.105 0 C-N-CA 123.321 0.649 . . . . 0.0 112.38 171.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.31 -22.28 64.75 Favored 'General case' 0 N--CA 1.445 -0.68 0 C-N-CA 122.721 0.408 . . . . 0.0 111.925 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.07 -51.11 34.51 Favored 'General case' 0 C--O 1.22 -0.489 0 CA-C-O 121.329 0.585 . . . . 0.0 109.506 176.063 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 20.8 m -47.6 -28.61 2.41 Favored 'General case' 0 CA--C 1.51 -0.579 0 C-N-CA 126.361 1.864 . . . . 0.0 110.444 -179.122 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 27.0 m0 -61.79 -68.55 0.31 Allowed 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 173.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -50.99 -32.47 21.25 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 117.945 -1.026 . . . . 0.0 112.308 174.852 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.01 -51.19 67.78 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 120.88 1.673 . . . . 0.0 110.831 173.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 2.0 t -60.79 -35.84 77.48 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 121.444 0.64 . . . . 0.0 109.813 178.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.3 mtpt -63.19 -50.61 69.66 Favored 'General case' 0 N--CA 1.44 -0.941 0 O-C-N 121.477 -0.765 . . . . 0.0 110.331 176.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 39.6 tptt -52.12 -45.3 64.87 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 124.452 1.101 . . . . 0.0 111.205 178.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 43.6 t -75.01 -63.14 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.428 -1.561 0 C-N-CA 124.646 1.178 . . . . 0.0 109.732 -178.328 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -110.3 -35.12 6.16 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.817 0.847 . . . . 0.0 112.421 -166.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 108.76 -23.21 24.49 Favored Glycine 0 CA--C 1.532 1.106 0 N-CA-C 110.6 -1.0 . . . . 0.0 110.6 -170.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 13.6 m -81.91 66.63 7.57 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 125.595 1.558 . . . . 0.0 110.046 -167.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -67.49 47.61 0.29 Allowed Glycine 0 CA--C 1.54 1.64 0 N-CA-C 117.98 1.952 . . . . 0.0 117.98 -160.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -132.38 98.61 4.43 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 119.951 1.875 . . . . 0.0 110.594 -163.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -159.17 -163.6 13.36 Favored Glycine 0 CA--C 1.525 0.702 0 CA-C-O 119.838 -0.423 . . . . 0.0 113.339 -172.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -158.65 160.17 36.2 Favored 'General case' 0 C--O 1.232 0.184 0 C-N-CA 126.997 2.119 . . . . 0.0 107.636 169.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -91.13 160.89 15.33 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 178.406 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -136.96 126.02 24.44 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 173.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 6.2 m120 64.43 -82.64 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.647 1.179 . . . . 0.0 110.616 174.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -163.63 43.89 0.11 Allowed 'General case' 0 N--CA 1.441 -0.899 0 C-N-CA 127.47 2.308 . . . . 0.0 106.155 172.093 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 7.8 mp0 -139.79 -177.82 5.14 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 129.911 3.285 . . . . 0.0 103.84 175.278 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.5 m -150.11 160.41 43.68 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 120.328 1.422 . . . . 0.0 111.897 -171.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 51.3 mtp180 -144.94 147.96 33.3 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 124.139 0.975 . . . . 0.0 108.385 -172.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 48.0 t -133.95 159.71 39.9 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.45 -0.474 0 CA-C-N 118.464 0.574 . . . . 0.0 110.858 -173.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 25.1 p90 . . . . . 0 N--CA 1.452 -0.373 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -61.88 123.19 30.94 Favored Glycine 0 CA--C 1.522 0.511 0 CA-C-O 117.894 -1.504 . . . . 0.0 110.082 172.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -132.67 122.89 25.33 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 106.317 -1.735 . . . . 0.0 106.317 159.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.3 pt -145.35 151.47 15.04 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.48 0 N-CA-C 104.828 -2.286 . . . . 0.0 104.828 -152.024 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -108.65 86.91 2.37 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 170.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 19.6 m -121.16 135.84 60.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 114.052 -1.431 . . . . 0.0 108.249 157.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -73.03 95.44 2.01 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 124.082 0.953 . . . . 0.0 111.525 -167.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.6 p -64.92 131.04 45.6 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.706 -177.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -87.15 -25.72 23.95 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 124.26 0.975 . . . . 0.0 109.468 151.151 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -164.09 167.62 20.07 Favored 'General case' 0 C--O 1.223 -0.291 0 C-N-CA 123.748 0.819 . . . . 0.0 109.186 -178.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.7 p -59.13 -37.48 77.32 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 125.15 1.38 . . . . 0.0 112.179 174.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.5 p -56.25 -36.33 68.42 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 121.287 0.565 . . . . 0.0 111.581 -176.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -39.59 -53.37 2.13 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 125.37 1.468 . . . . 0.0 111.947 168.002 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.7 m -67.94 -31.07 70.56 Favored 'General case' 0 N--CA 1.439 -0.996 0 C-N-CA 127.76 2.424 . . . . 0.0 108.813 -173.365 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 33.3 m0 -65.1 -63.36 1.12 Allowed 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 106.227 -1.768 . . . . 0.0 106.227 176.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 1.3 p -53.69 -31.02 46.31 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 119.026 -0.512 . . . . 0.0 111.573 177.062 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.8 -57.54 10.52 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 119.371 0.987 . . . . 0.0 110.72 174.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -58.85 -34.77 71.97 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 122.171 0.986 . . . . 0.0 110.583 -178.739 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.9 mtpm? -62.54 -55.46 27.16 Favored 'General case' 0 N--CA 1.438 -1.037 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.912 176.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 85.1 mttt -48.22 -50.25 30.11 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 124.175 0.99 . . . . 0.0 111.481 -179.475 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -68.65 -71.34 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 118.58 0.627 . . . . 0.0 110.907 174.618 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 88.3 m -104.43 -35.79 7.79 Favored 'General case' 0 N--CA 1.435 -1.223 0 C-N-CA 123.96 0.904 . . . . 0.0 110.74 -159.191 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 112.02 -16.4 25.36 Favored Glycine 0 CA--C 1.532 1.126 0 C-N-CA 123.374 0.512 . . . . 0.0 111.982 -175.08 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.7 p -80.84 63.91 5.41 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 126.557 1.943 . . . . 0.0 110.031 -166.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -72.54 41.64 0.82 Allowed Glycine 0 CA--C 1.537 1.44 0 N-CA-C 117.57 1.788 . . . . 0.0 117.57 -155.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -120.87 135.17 55.25 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 119.955 1.877 . . . . 0.0 109.214 -177.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 175.52 -166.42 37.82 Favored Glycine 0 CA--C 1.524 0.633 0 N-CA-C 111.189 -0.764 . . . . 0.0 111.189 -177.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 4.3 mptt -157.89 156.2 30.94 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 125.363 1.465 . . . . 0.0 108.676 171.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -90.53 160.84 15.76 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -137.88 131.2 30.64 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 105.518 -2.03 . . . . 0.0 105.518 170.543 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 31.4 t30 67.58 -93.05 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 118.984 0.811 . . . . 0.0 110.089 165.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 24.3 m120 -154.95 58.51 0.67 Allowed 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 127.888 2.475 . . . . 0.0 105.367 160.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 17.1 mp0 -149.25 178.37 8.81 Favored 'General case' 0 N--CA 1.444 -0.733 0 C-N-CA 129.762 3.225 . . . . 0.0 103.711 177.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.3 m -155.4 165.22 37.29 Favored 'General case' 0 CA--C 1.506 -0.726 0 O-C-N 120.899 -1.126 . . . . 0.0 110.055 -171.24 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -141.9 146.34 35.61 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 175.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 20.2 m -84.35 -129.65 0.03 OUTLIER 'General case' 0 N--CA 1.439 -1.0 0 N-CA-C 108.058 -1.09 . . . . 0.0 108.058 164.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 3.8 p90 . . . . . 0 N--CA 1.449 -0.508 0 C-N-CA 124.01 0.924 . . . . 0.0 108.853 -173.998 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 15.4 m-85 . . . . . 0 CA--C 1.532 0.282 0 CA-C-O 121.371 0.605 . . . . 0.0 111.804 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 125.33 -154.96 18.62 Favored Glycine 0 C--N 1.335 0.522 0 C-N-CA 124.768 1.175 . . . . 0.0 111.032 172.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.5 pp -91.55 150.54 21.15 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 123.219 0.608 . . . . 0.0 111.818 -172.018 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -130.09 -168.76 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.903 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 -174.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.5 t0 -135.5 105.44 6.22 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-O 120.745 0.307 . . . . 0.0 110.599 156.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -142.7 136.65 27.38 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.21 0 N-CA-C 109.295 -0.632 . . . . 0.0 109.295 152.235 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 55.1 pttt -46.31 114.52 0.82 Allowed 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 125.648 1.579 . . . . 0.0 112.001 176.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 5.2 p -88.39 134.73 33.75 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 118.004 0.365 . . . . 0.0 111.838 177.156 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -90.39 -21.33 22.01 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 153.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -164.89 166.68 19.37 Favored 'General case' 0 C--O 1.223 -0.303 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 -178.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.9 p -59.75 -39.24 84.14 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 124.519 1.127 . . . . 0.0 111.737 172.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.5 p -56.06 -36.29 67.9 Favored 'General case' 0 N--CA 1.451 -0.381 0 O-C-N 121.969 -0.457 . . . . 0.0 111.448 -176.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -39.18 -55.25 1.68 Allowed 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.159 1.384 . . . . 0.0 111.486 167.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 13.8 m -64.97 -31.45 72.69 Favored 'General case' 0 N--CA 1.438 -1.025 0 C-N-CA 128.186 2.595 . . . . 0.0 108.824 -173.268 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 33.2 m0 -64.02 -67.0 0.47 Allowed 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 105.837 -1.912 . . . . 0.0 105.837 178.501 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -52.44 -32.84 41.34 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 123.265 0.626 . . . . 0.0 111.843 177.732 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.95 -54.88 35.67 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 119.519 1.054 . . . . 0.0 110.147 175.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.7 t -59.94 -34.74 73.66 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-O 120.865 0.364 . . . . 0.0 110.643 179.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 4.8 mtpm? -63.36 -55.14 26.96 Favored 'General case' 0 N--CA 1.438 -1.046 0 O-C-N 122.314 -0.241 . . . . 0.0 110.833 176.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -53.22 -48.29 68.27 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 123.311 0.645 . . . . 0.0 111.079 178.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 40.8 t -70.79 -51.23 38.0 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.485 0 C-N-CA 123.997 0.919 . . . . 0.0 110.191 -176.355 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -129.03 -34.16 1.93 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.778 0.831 . . . . 0.0 112.341 -157.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 118.16 -31.94 5.46 Favored Glycine 0 CA--C 1.533 1.156 0 C-N-CA 124.588 1.09 . . . . 0.0 112.342 176.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 49.5 m -85.53 81.69 8.58 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 126.254 1.822 . . . . 0.0 110.253 -166.268 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -76.53 47.46 2.42 Favored Glycine 0 CA--C 1.536 1.363 0 CA-C-O 118.72 -1.045 . . . . 0.0 115.355 -164.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -119.52 122.57 41.94 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 119.341 1.571 . . . . 0.0 108.739 -178.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -173.35 -169.14 35.42 Favored Glycine 0 CA--C 1.522 0.522 0 CA-C-N 119.162 0.892 . . . . 0.0 112.233 -174.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -161.8 145.34 12.34 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 177.2 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -88.37 152.27 22.03 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 179.265 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 31.0 tp60 -127.59 108.69 10.99 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 105.67 -1.974 . . . . 0.0 105.67 -179.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 65.64 -79.69 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 119.233 0.924 . . . . 0.0 111.44 172.279 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -159.31 43.08 0.23 Allowed 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 129.327 3.051 . . . . 0.0 110.758 169.178 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -133.9 -171.56 2.76 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 105.97 -1.863 . . . . 0.0 105.97 157.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.2 m -145.03 162.35 37.16 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 119.254 0.934 . . . . 0.0 111.079 -172.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 41.3 mtp180 -142.9 153.36 43.03 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 -174.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 49.1 t -135.3 148.39 49.49 Favored 'General case' 0 C--N 1.33 -0.267 0 O-C-N 124.437 1.086 . . . . 0.0 110.891 -175.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 88.3 t80 . . . . . 0 C--O 1.234 0.276 0 C-N-CA 126.837 2.055 . . . . 0.0 109.433 -172.11 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.456 -0.169 0 CA-C-O 122.282 1.039 . . . . 0.0 109.366 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -87.32 138.53 15.42 Favored Glycine 0 N--CA 1.445 -0.728 0 C-N-CA 127.285 2.374 . . . . 0.0 108.18 172.051 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -142.03 131.17 23.32 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 118.403 1.102 . . . . 0.0 108.074 171.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -132.9 166.05 30.57 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.878 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 -161.465 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 22.0 p-10 -117.53 24.96 10.75 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 125.52 1.528 . . . . 0.0 112.115 -169.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 21.3 t -117.02 133.35 64.04 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 C-N-CA 123.811 0.844 . . . . 0.0 110.127 -179.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt -46.31 146.14 1.48 Allowed 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 126.853 2.061 . . . . 0.0 114.491 -176.416 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -104.56 129.49 52.64 Favored 'General case' 0 CA--C 1.511 -0.539 0 C-N-CA 123.034 0.533 . . . . 0.0 110.221 167.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -94.66 -10.74 30.9 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 157.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -174.98 168.75 3.47 Favored 'General case' 0 C--N 1.342 0.264 0 C-N-CA 126.154 1.782 . . . . 0.0 107.499 -179.436 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.6 p -64.82 -42.99 94.53 Favored 'General case' 0 C--N 1.333 -0.122 0 C-N-CA 125.81 1.644 . . . . 0.0 111.462 169.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.4 p -55.11 -38.88 68.72 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 122.094 -0.379 . . . . 0.0 110.824 -177.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -35.31 -55.91 0.63 Allowed 'General case' 0 C--O 1.222 -0.349 0 C-N-CA 125.329 1.451 . . . . 0.0 112.097 166.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 18.8 m -64.07 -31.2 72.31 Favored 'General case' 0 N--CA 1.439 -1.016 0 C-N-CA 127.986 2.514 . . . . 0.0 108.491 -170.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 29.8 m0 -66.41 -63.26 1.11 Allowed 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 106.927 -1.508 . . . . 0.0 106.927 178.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -53.8 -31.75 50.11 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.458 0.703 . . . . 0.0 111.533 175.754 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.72 -56.72 10.53 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 119.775 1.171 . . . . 0.0 109.862 178.117 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -57.49 -35.81 70.68 Favored 'General case' 0 CA--C 1.514 -0.421 0 CA-C-O 121.028 0.442 . . . . 0.0 110.758 179.654 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 18.9 mtmm -63.55 -58.14 7.93 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.416 175.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 7.4 mtpm? -54.0 -39.83 66.42 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 123.514 0.725 . . . . 0.0 111.825 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 42.6 t -73.93 -62.2 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.5 0 C-N-CA 123.953 0.901 . . . . 0.0 109.022 179.071 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.2 m -117.02 -43.55 2.85 Favored 'General case' 0 N--CA 1.439 -0.984 0 C-N-CA 124.083 0.953 . . . . 0.0 110.902 -161.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 124.13 -21.34 6.94 Favored Glycine 0 CA--C 1.534 1.241 0 C-N-CA 124.873 1.225 . . . . 0.0 112.376 -176.091 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 9.7 t -86.22 72.88 10.31 Favored 'General case' 0 C--O 1.227 -0.126 0 O-C-N 121.474 -1.015 . . . . 0.0 109.102 -164.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -73.72 38.45 0.9 Allowed Glycine 0 CA--C 1.533 1.184 0 N-CA-C 117.369 1.708 . . . . 0.0 117.369 -160.495 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 61.0 mt-30 -116.16 122.68 45.79 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 126.394 1.877 . . . . 0.0 108.625 -176.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -174.8 -166.47 32.72 Favored Glycine 0 CA--C 1.521 0.458 0 CA-C-N 119.298 0.954 . . . . 0.0 111.869 -177.414 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 78.1 tttt -166.69 150.3 7.03 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 175.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -88.23 161.35 17.25 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 -177.817 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -138.9 115.96 10.95 Favored 'General case' 0 N--CA 1.441 -0.876 0 N-CA-C 106.707 -1.59 . . . . 0.0 106.707 173.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 73.27 -75.58 0.07 Allowed 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.432 0.693 . . . . 0.0 111.493 165.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -168.48 46.94 0.04 OUTLIER 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 129.739 3.216 . . . . 0.0 109.418 167.316 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -144.01 -170.21 3.28 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 104.991 -2.225 . . . . 0.0 104.991 160.223 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.9 m -150.76 159.48 44.5 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 119.268 0.94 . . . . 0.0 110.235 -170.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 51.1 mtt-85 -136.11 152.38 50.78 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 124.599 1.159 . . . . 0.0 109.934 179.038 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 41.2 t -131.99 167.86 18.92 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 124.1 0.875 . . . . 0.0 111.281 -172.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 86.0 m-85 . . . . . 0 C--O 1.233 0.191 0 C-N-CA 127.132 2.173 . . . . 0.0 109.135 172.074 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 34.6 m-85 . . . . . 0 N--CA 1.45 -0.455 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -46.0 134.28 9.62 Favored Glycine 0 CA--C 1.53 1.023 0 C-N-CA 123.629 0.633 . . . . 0.0 112.228 173.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -147.71 132.89 18.34 Favored 'General case' 0 N--CA 1.447 -0.622 0 O-C-N 122.115 -0.638 . . . . 0.0 109.448 159.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -133.24 -175.29 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.974 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 -168.476 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -143.71 91.78 2.28 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 121.625 0.726 . . . . 0.0 110.179 162.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 94.8 t -135.73 140.95 43.38 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 161.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.22 104.29 0.08 Allowed 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 125.79 1.636 . . . . 0.0 113.183 -177.19 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.92 130.71 42.34 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 167.107 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 29.6 m-85 -88.7 -21.72 23.75 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 123.752 0.821 . . . . 0.0 109.438 150.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -167.55 168.6 12.69 Favored 'General case' 0 C--O 1.224 -0.283 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 -175.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.3 p -62.89 -41.98 99.61 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 125.478 1.511 . . . . 0.0 111.973 174.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.0 t -57.1 -35.57 69.59 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 121.683 -0.635 . . . . 0.0 111.376 -174.303 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -35.63 -55.48 0.69 Allowed 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.387 1.475 . . . . 0.0 112.645 163.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 11.6 m -65.94 -31.41 72.32 Favored 'General case' 0 N--CA 1.439 -1.011 0 C-N-CA 127.892 2.477 . . . . 0.0 109.01 -173.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 35.4 m0 -64.87 -63.37 1.13 Allowed 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 106.421 -1.696 . . . . 0.0 106.421 177.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -53.65 -33.0 53.7 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 122.865 0.466 . . . . 0.0 111.685 176.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.86 -55.49 29.23 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 119.265 0.938 . . . . 0.0 110.267 175.34 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -60.13 -34.08 73.03 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 121.097 0.475 . . . . 0.0 110.373 178.586 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.1 mtmt -64.15 -50.81 66.73 Favored 'General case' 0 N--CA 1.44 -0.967 0 O-C-N 121.35 -0.844 . . . . 0.0 110.456 178.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 10.2 mtpm? -57.97 -39.73 78.88 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.795 178.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 38.3 t -72.32 -60.51 2.35 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.403 0 C-N-CA 123.802 0.841 . . . . 0.0 109.551 179.323 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.9 t -118.24 -39.96 3.0 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.171 0.988 . . . . 0.0 112.578 -165.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 120.52 -25.36 7.33 Favored Glycine 0 CA--C 1.532 1.128 0 C-N-CA 123.896 0.76 . . . . 0.0 111.648 -178.172 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.9 t -87.83 75.27 8.92 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 124.048 0.939 . . . . 0.0 108.996 -167.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -71.95 54.47 1.38 Allowed Glycine 0 CA--C 1.534 1.234 0 N-CA-C 116.891 1.516 . . . . 0.0 116.891 -161.009 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -129.62 123.03 30.26 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 120.278 2.039 . . . . 0.0 111.171 -173.013 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -175.55 -168.99 36.72 Favored Glycine 0 CA--C 1.527 0.837 0 CA-C-N 118.273 0.488 . . . . 0.0 112.256 -176.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -149.06 158.78 44.45 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 125.987 1.715 . . . . 0.0 107.651 165.097 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -86.94 153.73 21.36 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 2.2 tp60 -124.5 106.8 10.45 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 176.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 73.88 -85.31 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.409 0 O-C-N 121.752 -0.593 . . . . 0.0 109.836 167.301 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 34.3 m120 -152.73 46.19 0.71 Allowed 'General case' 0 C--O 1.224 -0.266 0 C-N-CA 127.323 2.249 . . . . 0.0 107.289 161.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 5.2 mp0 -135.44 -175.84 4.07 Favored 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 128.597 2.759 . . . . 0.0 103.994 169.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -153.41 154.33 34.24 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 119.947 1.249 . . . . 0.0 110.545 -170.151 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 66.6 mtp180 -144.05 111.74 6.09 Favored 'General case' 0 CA--C 1.506 -0.724 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.338 -168.022 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -76.39 168.31 20.28 Favored 'General case' 0 N--CA 1.438 -1.032 0 CA-C-O 121.798 0.809 . . . . 0.0 110.384 166.797 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 1.4 p90 . . . . . 0 N--CA 1.443 -0.8 0 C-N-CA 124.913 1.285 . . . . 0.0 111.25 177.674 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.451 -0.385 0 CA-C-O 121.265 0.555 . . . . 0.0 110.424 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -44.97 136.12 6.62 Favored Glycine 0 CA--C 1.527 0.782 0 C-N-CA 124.836 1.208 . . . . 0.0 110.992 156.08 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -137.46 126.58 24.45 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 107.294 -1.373 . . . . 0.0 107.294 147.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -136.53 158.28 37.48 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.25 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 -162.585 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -86.44 -17.92 33.04 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 125.061 1.344 . . . . 0.0 112.012 -171.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 63.2 t -70.09 134.44 30.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 C-N-CA 119.994 -0.682 . . . . 0.0 110.756 -159.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 56.8 pttt -53.6 102.2 0.05 Allowed 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.331 1.452 . . . . 0.0 112.611 -178.028 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -62.6 131.41 48.96 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 169.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -90.67 -17.2 27.23 Favored 'General case' 0 CA--C 1.535 0.402 0 O-C-N 124.684 1.24 . . . . 0.0 109.659 157.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 173.54 156.41 0.12 Allowed 'General case' 0 C--N 1.343 0.323 0 C-N-CA 126.41 1.884 . . . . 0.0 107.518 -175.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 35.4 m -47.6 -38.4 14.47 Favored 'General case' 0 CA--C 1.528 0.131 0 C-N-CA 124.151 0.98 . . . . 0.0 113.581 174.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.0 p -60.98 -28.59 69.12 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 121.892 -0.505 . . . . 0.0 112.005 -179.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 7.6 tm-20 -55.5 -52.89 62.16 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.178 0.591 . . . . 0.0 109.435 173.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 15.1 m -55.94 -28.17 55.7 Favored 'General case' 0 N--CA 1.442 -0.862 0 C-N-CA 127.726 2.41 . . . . 0.0 109.705 -176.216 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 37.4 m0 -66.68 -66.5 0.55 Allowed 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 107.039 -1.467 . . . . 0.0 107.039 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -50.89 -33.52 24.42 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 118.368 -0.825 . . . . 0.0 111.112 174.181 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.35 -58.75 5.12 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 120.056 1.298 . . . . 0.0 111.534 177.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -60.81 -30.26 69.97 Favored 'General case' 0 CA--C 1.519 -0.232 0 O-C-N 121.511 -0.743 . . . . 0.0 110.886 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -65.97 -48.73 70.31 Favored 'General case' 0 N--CA 1.442 -0.859 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.747 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.1 tmtt? -60.3 -37.64 81.15 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 124.453 1.101 . . . . 0.0 110.774 177.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 29.8 t -72.17 -62.0 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.428 -1.543 0 C-N-CA 124.05 0.94 . . . . 0.0 108.497 177.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.3 m -122.06 -49.87 2.06 Favored 'General case' 0 N--CA 1.431 -1.395 0 C-N-CA 123.922 0.889 . . . . 0.0 110.684 -163.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 134.18 -20.95 3.94 Favored Glycine 0 CA--C 1.536 1.389 0 C-N-CA 123.926 0.774 . . . . 0.0 112.253 -170.237 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 30.9 m -82.83 63.09 6.76 Favored 'General case' 0 C--O 1.228 -0.079 0 C-N-CA 125.205 1.402 . . . . 0.0 111.084 -164.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -65.99 1.26 4.92 Favored Glycine 0 CA--C 1.536 1.371 0 N-CA-C 116.297 1.279 . . . . 0.0 116.297 -162.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -89.56 105.48 17.82 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 119.629 1.714 . . . . 0.0 108.401 -173.432 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -158.85 -174.0 27.99 Favored Glycine 0 C--N 1.333 0.397 0 O-C-N 122.27 -0.269 . . . . 0.0 112.712 -171.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -151.33 154.98 37.77 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 124.753 1.221 . . . . 0.0 108.109 173.317 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -87.77 161.04 17.8 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 176.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 45.9 tt0 -136.01 127.63 28.89 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 105.164 -2.161 . . . . 0.0 105.164 170.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 68.71 -89.45 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 118.797 0.726 . . . . 0.0 110.555 168.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 36.6 m120 -161.27 55.28 0.28 Allowed 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 130.129 3.372 . . . . 0.0 104.065 165.011 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -145.99 175.47 10.42 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 130.855 3.662 . . . . 0.0 102.794 176.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.2 m -156.84 157.85 35.68 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-N 120.06 1.3 . . . . 0.0 110.809 -168.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 15.2 mtp180 -144.15 145.3 32.02 Favored 'General case' 0 CA--C 1.512 -0.497 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 -170.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 8.4 p -132.89 151.53 52.02 Favored 'General case' 0 CA--C 1.515 -0.384 0 O-C-N 124.244 0.965 . . . . 0.0 110.733 169.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.448 -0.526 0 C-N-CA 123.92 0.888 . . . . 0.0 112.322 -173.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 4.1 t80 . . . . . 0 N--CA 1.456 -0.148 0 CA-C-O 121.778 0.799 . . . . 0.0 110.061 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -54.83 162.71 4.23 Favored Glycine 0 CA--C 1.527 0.835 0 C-N-CA 125.893 1.711 . . . . 0.0 112.196 178.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -148.38 129.05 14.14 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 156.095 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -130.42 174.52 12.71 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.003 0 N-CA-C 106.574 -1.639 . . . . 0.0 106.574 -175.813 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -132.59 71.27 1.47 Allowed 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 122.163 0.982 . . . . 0.0 110.653 175.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 64.7 t -131.37 136.37 57.65 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 114.357 -1.292 . . . . 0.0 109.032 167.193 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 60.0 pttt -45.95 113.64 0.65 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 126.156 1.782 . . . . 0.0 112.618 179.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -74.09 136.67 43.02 Favored 'General case' 0 CA--C 1.516 -0.351 0 C-N-CA 120.103 -0.639 . . . . 0.0 109.859 170.123 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 7.2 t80 -100.73 -8.18 23.03 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 161.066 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 174.08 165.12 0.2 Allowed 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 126.941 2.096 . . . . 0.0 106.461 -175.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.6 m -62.33 -36.26 81.66 Favored 'General case' 0 C--O 1.226 -0.182 0 C-N-CA 122.73 0.412 . . . . 0.0 111.961 170.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.5 p -59.09 -37.75 77.89 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 122.131 -0.356 . . . . 0.0 110.652 -179.529 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -42.58 -55.3 3.57 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.165 0.986 . . . . 0.0 110.63 170.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 25.5 m -56.56 -31.11 63.88 Favored 'General case' 0 N--CA 1.444 -0.763 0 C-N-CA 127.174 2.19 . . . . 0.0 109.678 -173.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 34.2 m0 -65.74 -63.47 1.08 Allowed 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 -179.214 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -51.62 -36.37 45.58 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-O 118.691 -0.671 . . . . 0.0 111.031 173.565 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.74 -57.58 10.46 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 119.632 1.106 . . . . 0.0 110.863 -178.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -59.04 -35.31 73.1 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-O 121.37 0.605 . . . . 0.0 110.55 178.497 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.1 mtmt -62.55 -45.46 92.84 Favored 'General case' 0 N--CA 1.441 -0.909 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 178.621 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -54.91 -52.39 63.05 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 122.957 0.503 . . . . 0.0 111.231 176.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -67.38 -65.32 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 118.47 0.577 . . . . 0.0 112.093 178.713 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 62.2 p -105.25 -50.02 3.33 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 122.546 0.338 . . . . 0.0 110.703 -170.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 126.46 -10.36 7.24 Favored Glycine 0 CA--C 1.532 1.126 0 CA-C-N 115.464 -0.789 . . . . 0.0 112.224 -161.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.5 m -78.66 57.49 2.05 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 118.674 1.237 . . . . 0.0 112.347 -165.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -74.2 30.55 0.97 Allowed Glycine 0 CA--C 1.533 1.199 0 N-CA-C 117.093 1.597 . . . . 0.0 117.093 -154.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 -122.79 123.76 41.78 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 119.57 1.685 . . . . 0.0 108.069 -172.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -179.11 -170.86 41.59 Favored Glycine 0 CA--C 1.526 0.757 0 CA-C-N 118.921 0.782 . . . . 0.0 112.743 -175.101 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -147.49 159.47 43.69 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 125.526 1.53 . . . . 0.0 108.337 166.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -88.37 141.18 28.75 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.775 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 11.3 tp60 -102.58 99.54 9.55 Favored 'General case' 0 N--CA 1.445 -0.713 0 N-CA-C 105.595 -2.002 . . . . 0.0 105.595 171.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 69.4 -77.62 0.05 Allowed 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 119.182 0.901 . . . . 0.0 112.32 166.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -153.95 39.11 0.47 Allowed 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 128.458 2.703 . . . . 0.0 110.933 168.449 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -136.86 -177.77 4.89 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 104.219 -2.511 . . . . 0.0 104.219 166.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.1 m -151.1 153.7 35.55 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 119.861 1.209 . . . . 0.0 110.639 -167.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 75.9 mtp180 -144.67 110.85 5.5 Favored 'General case' 0 CA--C 1.507 -0.693 0 C-N-CA 123.666 0.787 . . . . 0.0 109.475 -163.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 4.6 m -91.15 -154.99 0.38 Allowed 'General case' 0 N--CA 1.441 -0.875 0 CA-C-N 114.685 -1.143 . . . . 0.0 110.484 -178.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.451 -0.409 0 C-N-CA 124.857 1.263 . . . . 0.0 109.481 -175.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 9.6 t80 . . . . . 0 N--CA 1.454 -0.259 0 CA-C-O 121.884 0.849 . . . . 0.0 109.217 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -58.24 128.74 48.3 Favored Glycine 0 N--CA 1.447 -0.576 0 N-CA-C 107.814 -2.114 . . . . 0.0 107.814 155.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -138.02 125.81 22.44 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 119.155 1.478 . . . . 0.0 109.218 168.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -145.48 157.77 13.01 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.619 0 N-CA-C 105.978 -1.86 . . . . 0.0 105.978 -157.842 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -118.35 33.17 5.76 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 123.139 0.576 . . . . 0.0 110.759 -169.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.4 p -77.99 127.36 38.55 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.175 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 170.349 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 53.3 pttt -43.84 101.83 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.31 1.444 . . . . 0.0 111.287 171.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -68.8 133.47 48.36 Favored 'General case' 0 CA--C 1.517 -0.306 0 C-N-CA 119.414 -0.914 . . . . 0.0 110.32 177.492 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -98.05 -8.14 28.39 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.416 158.274 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 176.24 166.24 0.43 Allowed 'General case' 0 C--O 1.225 -0.202 0 C-N-CA 126.137 1.775 . . . . 0.0 107.15 -177.273 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.8 m -61.58 -35.35 77.58 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 118.334 0.515 . . . . 0.0 112.041 172.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.8 p -58.79 -32.56 69.44 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 121.666 -0.646 . . . . 0.0 111.61 -179.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -44.26 -52.71 7.28 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 124.092 0.957 . . . . 0.0 111.136 169.257 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 8.9 m -67.04 -30.69 70.84 Favored 'General case' 0 N--CA 1.44 -0.962 0 C-N-CA 127.677 2.391 . . . . 0.0 108.514 -172.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 34.2 m0 -64.95 -65.55 0.66 Allowed 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 106.0 -1.852 . . . . 0.0 106.0 176.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 4.0 p -54.22 -31.32 52.84 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 123.006 0.522 . . . . 0.0 111.755 179.022 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.48 -55.03 20.1 Favored 'General case' 0 N--CA 1.457 -0.092 0 CA-C-N 119.394 0.997 . . . . 0.0 110.432 175.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -60.96 -31.8 71.35 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-O 120.952 0.406 . . . . 0.0 110.086 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 22.9 mtpp -65.79 -53.45 40.17 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-O 121.377 0.608 . . . . 0.0 110.967 174.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? -54.15 -38.77 65.86 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.385 179.006 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 78.8 t -77.7 -66.72 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.425 -1.689 0 C-N-CA 124.027 0.931 . . . . 0.0 109.622 176.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 29.3 p -95.36 -50.8 4.86 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 123.157 0.583 . . . . 0.0 111.557 -169.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 122.31 -28.28 5.84 Favored Glycine 0 CA--C 1.531 1.047 0 C-N-CA 125.264 1.412 . . . . 0.0 110.783 -166.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -89.28 80.22 6.91 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.895 1.278 . . . . 0.0 109.184 -165.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -76.14 40.22 1.46 Allowed Glycine 0 CA--C 1.532 1.151 0 N-CA-C 117.175 1.63 . . . . 0.0 117.175 -156.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 61.2 mt-30 -115.5 116.68 28.6 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 120.104 1.952 . . . . 0.0 110.814 -171.066 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -170.19 -169.88 33.87 Favored Glycine 0 C--N 1.339 0.709 0 N-CA-C 111.453 -0.659 . . . . 0.0 111.453 -178.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 45.2 mtpt -150.97 156.46 41.2 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 124.722 1.209 . . . . 0.0 108.732 169.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -88.83 162.91 15.92 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 178.345 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 -141.77 125.99 17.47 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 106.858 -1.534 . . . . 0.0 106.858 168.178 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 7.2 m120 66.03 -78.13 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.943 0.897 . . . . 0.0 111.589 169.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -165.26 44.43 0.08 Allowed 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 129.782 3.233 . . . . 0.0 109.64 168.655 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 93.8 mt-30 -134.4 179.98 5.94 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 127.611 2.364 . . . . 0.0 105.23 168.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.4 m -153.57 157.61 39.98 Favored 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 -177.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 8.1 mtt180 -146.12 128.6 15.98 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 118.022 -0.989 . . . . 0.0 109.502 -170.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -103.45 167.71 9.63 Favored 'General case' 0 C--N 1.343 0.306 0 CA-C-O 121.885 0.85 . . . . 0.0 112.209 171.545 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.451 -0.377 0 C-N-CA 126.076 1.75 . . . . 0.0 111.107 -176.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 59.8 m-85 . . . . . 0 CA--C 1.538 0.5 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -56.91 124.53 35.91 Favored Glycine 0 N--CA 1.447 -0.582 0 CA-C-O 118.612 -1.105 . . . . 0.0 110.622 176.488 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -139.22 130.74 27.15 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 118.164 0.982 . . . . 0.0 109.211 159.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -138.89 166.17 22.85 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.186 0 N-CA-C 106.794 -1.558 . . . . 0.0 106.794 -163.714 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 46.9 t0 -127.42 81.8 2.04 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 122.047 0.927 . . . . 0.0 109.055 166.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 93.3 t -122.13 133.89 67.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 N-CA-C 106.2 -1.778 . . . . 0.0 106.2 156.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -62.1 108.58 1.09 Allowed 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 124.514 1.126 . . . . 0.0 111.464 -174.082 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 11.4 p -63.54 128.24 34.93 Favored 'General case' 0 CA--C 1.516 -0.354 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.711 176.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -71.83 -38.14 70.22 Favored 'General case' 0 N--CA 1.45 -0.446 0 O-C-N 124.421 1.076 . . . . 0.0 108.108 153.499 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -169.17 160.31 9.62 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.666 1.187 . . . . 0.0 108.386 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 21.8 m -47.06 -40.52 15.14 Favored 'General case' 0 C--O 1.226 -0.16 0 C-N-CA 124.383 1.073 . . . . 0.0 112.378 173.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.08 -23.6 65.59 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-O 119.096 -0.478 . . . . 0.0 112.112 -177.809 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -69.9 -48.14 59.78 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 119.235 0.925 . . . . 0.0 109.674 174.414 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 21.3 m -47.84 -28.16 2.46 Favored 'General case' 0 CA--C 1.511 -0.522 0 C-N-CA 125.937 1.695 . . . . 0.0 110.596 -179.372 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 37.1 m0 -64.81 -65.85 0.62 Allowed 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 177.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -51.4 -31.95 24.48 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-O 117.918 -1.039 . . . . 0.0 111.464 172.173 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.42 -63.31 1.27 Allowed 'General case' 0 C--N 1.342 0.245 0 CA-C-N 121.018 1.735 . . . . 0.0 111.265 176.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -57.68 -30.94 65.86 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 121.906 0.86 . . . . 0.0 110.848 -178.5 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.7 mtmm -66.49 -49.45 66.56 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 173.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 67.4 mttt -51.98 -53.26 43.62 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.25 1.02 . . . . 0.0 109.95 177.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -63.04 -40.88 90.72 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 179.287 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -151.6 -49.15 0.11 Allowed 'General case' 0 N--CA 1.447 -0.613 0 O-C-N 121.419 -0.8 . . . . 0.0 111.768 -164.82 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 144.52 -15.14 2.04 Favored Glycine 0 CA--C 1.53 0.979 0 C-N-CA 120.721 -0.752 . . . . 0.0 114.154 -178.114 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 9.3 m -79.79 59.12 3.02 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 124.059 0.943 . . . . 0.0 111.682 -163.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -70.87 12.01 2.3 Favored Glycine 0 CA--C 1.532 1.152 0 N-CA-C 116.339 1.295 . . . . 0.0 116.339 -157.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -105.22 108.06 19.37 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 119.16 1.48 . . . . 0.0 107.042 -172.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -167.03 -170.37 31.82 Favored Glycine 0 C--N 1.336 0.575 0 N-CA-C 111.966 -0.454 . . . . 0.0 111.966 -168.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 78.2 mttt -156.22 154.91 31.51 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 124.922 1.289 . . . . 0.0 108.631 177.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -91.35 160.09 15.66 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 176.419 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -140.81 120.9 13.74 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 106.231 -1.766 . . . . 0.0 106.231 176.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 70.84 -84.96 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 118.25 0.477 . . . . 0.0 110.078 168.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -162.34 56.36 0.23 Allowed 'General case' 0 N--CA 1.462 0.131 0 C-N-CA 129.175 2.99 . . . . 0.0 104.793 162.079 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 5.6 mp0 -143.09 -178.96 6.1 Favored 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 128.882 2.873 . . . . 0.0 103.796 170.017 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.2 m -157.39 158.5 36.02 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 119.595 1.089 . . . . 0.0 109.998 -169.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 58.1 mtt-85 -144.81 153.32 41.51 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 124.555 1.142 . . . . 0.0 110.096 -176.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 8.7 p -139.07 163.33 32.7 Favored 'General case' 0 CA--C 1.521 -0.164 0 O-C-N 124.389 1.056 . . . . 0.0 111.088 170.609 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.533 0.294 0 C-N-CA 123.807 0.843 . . . . 0.0 112.194 -171.606 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 29.3 t80 . . . . . 0 N--CA 1.453 -0.304 0 CA-C-O 121.928 0.87 . . . . 0.0 109.562 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -61.8 138.41 46.48 Favored Glycine 0 CA--C 1.522 0.484 0 N-CA-C 109.201 -1.56 . . . . 0.0 109.201 160.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -140.01 126.87 20.69 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 118.825 1.312 . . . . 0.0 109.709 170.102 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -145.26 158.74 13.36 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.338 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 -158.464 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -123.5 41.62 3.43 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 121.881 0.848 . . . . 0.0 111.516 -174.726 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 97.5 t -87.19 129.14 39.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 166.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 52.8 pttt -49.53 101.48 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 126.211 1.805 . . . . 0.0 113.363 179.292 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -66.47 127.07 30.89 Favored 'General case' 0 CA--C 1.515 -0.378 0 C-N-CA 123.0 0.52 . . . . 0.0 110.591 170.358 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 87.2 m-85 -96.94 -12.43 23.41 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 125.198 1.561 . . . . 0.0 109.979 153.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -177.15 153.42 0.97 Allowed 'General case' 0 C--N 1.343 0.318 0 C-N-CA 124.483 1.113 . . . . 0.0 109.212 -177.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.9 p -54.52 -41.22 69.4 Favored 'General case' 0 N--CA 1.457 -0.12 0 C-N-CA 125.31 1.444 . . . . 0.0 111.199 171.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.5 p -59.3 -25.08 63.84 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -178.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -60.0 -57.38 13.11 Favored 'General case' 0 C--O 1.223 -0.312 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 173.63 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 11.7 m -48.56 -31.4 6.48 Favored 'General case' 0 CA--C 1.508 -0.646 0 C-N-CA 129.008 2.923 . . . . 0.0 109.964 -175.446 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 33.8 m0 -62.58 -63.82 1.11 Allowed 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 175.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -48.11 -39.77 21.45 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 123.263 0.625 . . . . 0.0 111.922 173.487 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.29 -56.72 18.14 Favored 'General case' 0 C--N 1.328 -0.327 0 O-C-N 121.681 -0.637 . . . . 0.0 110.546 178.553 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -59.75 -35.56 74.84 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.595 0.712 . . . . 0.0 110.549 179.076 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 4.3 mtmp? -64.5 -44.63 90.31 Favored 'General case' 0 N--CA 1.439 -1.011 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.438 177.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.43 -54.43 32.28 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 124.226 1.011 . . . . 0.0 109.785 178.791 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -67.58 -62.95 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.325 0 N-CA-C 112.087 0.402 . . . . 0.0 112.087 178.226 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 70.7 p -103.6 -49.51 3.66 Favored 'General case' 0 CA--C 1.522 -0.099 0 C-N-CA 122.779 0.431 . . . . 0.0 110.806 -167.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 118.65 -18.1 10.89 Favored Glycine 0 CA--C 1.532 1.1 0 CA-C-N 115.151 -0.932 . . . . 0.0 111.401 -163.692 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 24.5 m -79.56 67.31 5.28 Favored 'General case' 0 C--O 1.227 -0.123 0 C-N-CA 124.467 1.107 . . . . 0.0 110.285 -169.348 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -72.44 40.67 0.76 Allowed Glycine 0 CA--C 1.539 1.584 0 N-CA-C 117.036 1.574 . . . . 0.0 117.036 -160.207 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 63.1 mt-30 -117.09 120.53 38.6 Favored 'General case' 0 C--O 1.224 -0.282 0 C-N-CA 125.739 1.616 . . . . 0.0 108.942 -172.381 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -175.2 -168.39 35.67 Favored Glycine 0 C--N 1.335 0.524 0 CA-C-N 119.622 1.101 . . . . 0.0 111.508 -178.021 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 81.4 mttt -153.77 160.83 42.41 Favored 'General case' 0 CA--C 1.522 -0.101 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 165.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.18 165.57 14.38 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 177.051 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -141.32 141.58 33.87 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 106.264 -1.754 . . . . 0.0 106.264 165.323 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 18.9 t30 61.68 -93.43 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 118.591 0.632 . . . . 0.0 111.07 167.546 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.0 m120 -153.35 55.37 0.75 Allowed 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 127.632 2.373 . . . . 0.0 106.224 162.167 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 17.1 mp0 -148.12 176.82 9.9 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 129.966 3.306 . . . . 0.0 104.442 -176.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.4 m -156.81 155.1 30.96 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 119.54 1.064 . . . . 0.0 110.126 -171.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 -142.2 134.84 28.24 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 123.847 0.859 . . . . 0.0 109.248 -170.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 49.0 t -111.32 158.05 19.47 Favored 'General case' 0 C--N 1.341 0.228 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 -174.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 16.8 m-30 . . . . . 0 N--CA 1.454 -0.258 0 C-N-CA 125.481 1.512 . . . . 0.0 109.64 -175.302 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 10.7 t80 . . . . . 0 N--CA 1.453 -0.283 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -39.22 147.96 0.14 Allowed Glycine 0 CA--C 1.522 0.517 0 C-N-CA 126.637 2.065 . . . . 0.0 112.119 160.045 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -140.2 130.34 25.0 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 162.25 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -137.1 162.6 33.75 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.15 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 -167.128 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -90.56 -16.91 27.9 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 124.501 1.12 . . . . 0.0 112.621 -172.122 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 58.3 t -75.19 134.57 29.07 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 CA-C-N 118.795 0.725 . . . . 0.0 111.757 -157.294 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.2 tmtt? -37.7 106.31 0.05 OUTLIER 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 127.578 2.351 . . . . 0.0 112.104 173.04 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -75.28 135.22 40.95 Favored 'General case' 0 CA--C 1.515 -0.388 0 C-N-CA 120.332 -0.547 . . . . 0.0 109.915 168.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -95.12 -16.37 22.66 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 158.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 178.51 166.43 0.83 Allowed 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 106.099 -1.815 . . . . 0.0 106.099 -172.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.9 p -61.31 -39.37 90.22 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 124.06 0.944 . . . . 0.0 111.48 172.733 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.6 p -56.77 -40.94 76.78 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 122.773 0.429 . . . . 0.0 111.046 -177.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -40.66 -56.87 2.02 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.634 1.174 . . . . 0.0 111.078 170.546 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 23.7 m -57.95 -28.37 64.25 Favored 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 128.026 2.53 . . . . 0.0 109.73 -173.311 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 33.2 m0 -64.65 -66.15 0.58 Allowed 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 107.186 -1.413 . . . . 0.0 107.186 177.534 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -51.67 -33.14 32.54 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 118.085 -0.959 . . . . 0.0 111.696 174.409 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.82 -54.38 36.01 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 120.107 1.321 . . . . 0.0 110.709 175.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 5.1 t -58.12 -37.16 74.06 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.071 0.463 . . . . 0.0 110.46 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 40.3 mtmt -63.5 -58.71 6.15 Favored 'General case' 0 N--CA 1.44 -0.943 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.706 177.079 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 64.3 mmtt -49.53 -47.11 49.13 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.303 1.041 . . . . 0.0 111.835 178.076 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 44.0 t -70.87 -60.02 2.86 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.77 0 C-N-CA 123.962 0.905 . . . . 0.0 109.15 -178.102 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.2 m -118.58 -41.54 2.81 Favored 'General case' 0 N--CA 1.439 -1.004 0 C-N-CA 123.591 0.756 . . . . 0.0 110.987 -161.103 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 120.83 -21.42 8.41 Favored Glycine 0 CA--C 1.533 1.215 0 C-N-CA 124.908 1.242 . . . . 0.0 112.372 -177.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 21.5 m -88.17 61.08 6.09 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 124.709 1.204 . . . . 0.0 110.322 -160.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -64.13 23.39 0.09 OUTLIER Glycine 0 CA--C 1.54 1.623 0 N-CA-C 120.414 2.926 . . . . 0.0 120.414 -152.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -108.38 118.2 36.16 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 121.129 2.465 . . . . 0.0 109.903 -176.3 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -163.99 -170.49 28.98 Favored Glycine 0 CA--C 1.528 0.875 0 N-CA-C 112.157 -0.377 . . . . 0.0 112.157 -174.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -156.38 156.08 33.26 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 125.159 1.384 . . . . 0.0 107.879 174.073 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -92.14 160.57 15.13 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 178.485 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.8 tp-100 -133.62 126.69 31.41 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 105.896 -1.89 . . . . 0.0 105.896 165.659 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.2 t30 69.04 -78.91 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 164.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -166.63 44.86 0.06 Allowed 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 130.411 3.484 . . . . 0.0 108.894 170.388 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -147.61 179.35 7.75 Favored 'General case' 0 N--CA 1.442 -0.825 0 C-N-CA 128.875 2.87 . . . . 0.0 104.167 177.453 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 5.0 m -153.94 164.75 37.9 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 119.894 1.224 . . . . 0.0 110.399 -169.422 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 73.4 mtp180 -140.0 152.93 46.68 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 125.651 1.58 . . . . 0.0 108.976 -178.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 36.8 t -132.59 162.63 30.8 Favored 'General case' 0 C--O 1.224 -0.26 0 O-C-N 124.652 1.22 . . . . 0.0 109.34 178.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.534 0.355 0 CA-C-N 118.651 0.66 . . . . 0.0 111.365 -177.294 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 . . . . . 0 CA--C 1.532 0.284 0 CA-C-O 121.158 0.504 . . . . 0.0 110.922 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 135.8 -118.4 1.85 Allowed Glycine 0 N--CA 1.449 -0.498 0 CA-C-O 117.949 -1.473 . . . . 0.0 110.664 173.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -130.78 147.16 52.4 Favored 'General case' 0 C--N 1.339 0.119 0 CA-C-N 118.512 1.156 . . . . 0.0 112.224 -173.581 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -140.42 160.67 25.02 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.373 0 N-CA-C 104.932 -2.247 . . . . 0.0 104.932 -171.487 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -123.33 41.88 3.36 Favored 'General case' 0 C--N 1.332 -0.19 0 C-N-CA 123.077 0.551 . . . . 0.0 110.677 -171.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 95.9 t -96.45 135.97 28.83 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 170.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.67 106.7 0.27 Allowed 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.815 1.246 . . . . 0.0 112.372 -177.748 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -65.19 127.29 31.08 Favored 'General case' 0 CA--C 1.515 -0.367 0 C-N-CA 122.587 0.355 . . . . 0.0 110.259 168.005 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -85.21 -19.19 32.06 Favored 'General case' 0 CA--C 1.538 0.519 0 O-C-N 124.403 1.064 . . . . 0.0 109.237 155.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -175.39 171.51 2.85 Favored 'General case' 0 C--O 1.221 -0.406 0 C-N-CA 125.486 1.515 . . . . 0.0 108.11 -179.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 20.0 m -62.86 -37.94 88.86 Favored 'General case' 0 N--CA 1.464 0.254 0 O-C-N 121.72 -0.612 . . . . 0.0 111.934 170.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.2 p -57.99 -34.36 69.9 Favored 'General case' 0 N--CA 1.452 -0.361 0 O-C-N 121.768 -0.582 . . . . 0.0 110.999 -178.138 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -40.24 -54.69 2.31 Favored 'General case' 0 C--O 1.225 -0.225 0 C-N-CA 124.42 1.088 . . . . 0.0 111.567 167.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 19.1 m -64.93 -30.06 71.03 Favored 'General case' 0 N--CA 1.44 -0.949 0 C-N-CA 127.394 2.278 . . . . 0.0 108.438 -171.019 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 28.9 m0 -64.9 -65.72 0.64 Allowed 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 106.178 -1.786 . . . . 0.0 106.178 176.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -51.46 -33.6 31.73 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 118.604 -0.712 . . . . 0.0 112.149 176.75 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.48 -54.88 25.57 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 119.902 1.228 . . . . 0.0 110.259 177.376 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -60.29 -34.1 73.29 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 120.794 0.33 . . . . 0.0 110.343 179.835 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 39.1 mtmt -65.16 -53.9 37.85 Favored 'General case' 0 N--CA 1.439 -0.999 0 C-N-CA 122.483 0.313 . . . . 0.0 110.839 176.267 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -48.32 -49.49 33.89 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 123.569 0.748 . . . . 0.0 110.71 176.786 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 65.3 t -73.15 -56.07 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.697 0 C-N-CA 124.289 1.036 . . . . 0.0 110.299 -175.477 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 11.9 t -138.91 18.85 2.65 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 113.588 0.959 . . . . 0.0 113.588 -162.517 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.09 -27.53 0.54 Allowed Glycine 0 CA--C 1.542 1.74 0 O-C-N 120.566 -1.334 . . . . 0.0 115.132 176.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 10.1 t -84.72 73.52 10.58 Favored 'General case' 0 C--O 1.226 -0.171 0 O-C-N 121.488 -1.007 . . . . 0.0 109.539 -162.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -72.04 35.77 0.63 Allowed Glycine 0 CA--C 1.536 1.398 0 N-CA-C 117.013 1.565 . . . . 0.0 117.013 -162.439 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -111.56 109.74 19.81 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 119.952 1.876 . . . . 0.0 109.454 -173.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -161.8 -169.19 24.78 Favored Glycine 0 CA--C 1.527 0.784 0 CA-C-N 118.736 0.698 . . . . 0.0 113.565 -173.558 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 19.2 ttmm -165.98 142.59 5.2 Favored 'General case' 0 CA--C 1.519 -0.246 0 C-N-CA 125.192 1.397 . . . . 0.0 107.748 -178.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . 0.402 ' HA ' ' HA ' ' A' ' 34' ' ' CYS . 0.1 OUTLIER -86.08 149.04 25.42 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 109.217 -0.661 . . . . 0.0 109.217 -177.901 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 21.1 tp60 -116.22 111.3 19.98 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 105.056 -2.202 . . . . 0.0 105.056 174.555 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 63.32 -92.37 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 119.598 1.09 . . . . 0.0 109.731 172.002 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 21.8 m120 -147.68 55.18 1.07 Allowed 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 126.02 1.728 . . . . 0.0 107.891 165.193 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.4 mp0 -141.55 175.76 9.42 Favored 'General case' 0 N--CA 1.445 -0.715 0 C-N-CA 130.752 3.621 . . . . 0.0 103.177 171.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.402 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 0.8 OUTLIER -147.9 155.82 42.01 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-N 120.725 1.602 . . . . 0.0 110.759 -171.46 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 63.0 mtp180 -139.51 151.88 46.49 Favored 'General case' 0 CA--C 1.509 -0.619 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 -171.141 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 47.5 t -143.37 141.45 30.92 Favored 'General case' 0 C--N 1.332 -0.179 0 O-C-N 124.543 1.152 . . . . 0.0 110.817 -172.181 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 72.9 t80 . . . . . 0 N--CA 1.453 -0.298 0 C-N-CA 126.021 1.728 . . . . 0.0 109.834 -170.343 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 . . . . . 0 N--CA 1.449 -0.495 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 127.29 -127.85 5.99 Favored Glycine 0 C--N 1.332 0.307 0 CA-C-O 117.869 -1.517 . . . . 0.0 111.71 168.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -125.93 143.02 51.26 Favored 'General case' 0 C--N 1.342 0.279 0 CA-C-N 118.652 1.226 . . . . 0.0 112.514 -169.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -139.39 162.05 27.34 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.184 0 C-N-CA 126.085 1.754 . . . . 0.0 106.702 -166.332 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -88.42 -15.82 34.47 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 124.03 0.932 . . . . 0.0 113.216 -169.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -67.46 139.46 20.89 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 C-N-CA 119.369 -0.932 . . . . 0.0 112.31 -156.318 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 34.3 mttt -65.55 95.63 0.23 Allowed 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.758 1.223 . . . . 0.0 111.645 -174.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.4 p -67.09 133.21 49.41 Favored 'General case' 0 CA--C 1.517 -0.31 0 O-C-N 123.109 0.255 . . . . 0.0 111.12 176.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 52.8 m-85 -85.47 -27.79 25.45 Favored 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 124.047 0.842 . . . . 0.0 109.295 150.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -169.79 160.71 8.8 Favored 'General case' 0 C--O 1.223 -0.333 0 C-N-CA 123.813 0.845 . . . . 0.0 109.833 -179.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 66.8 m -46.56 -38.28 9.21 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 114.161 1.171 . . . . 0.0 114.161 175.069 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.8 p -58.02 -27.73 63.81 Favored 'General case' 0 N--CA 1.449 -0.475 0 O-C-N 121.634 -0.666 . . . . 0.0 112.161 -179.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -54.49 -47.05 73.5 Favored 'General case' 0 C--O 1.219 -0.503 0 C-N-CA 124.333 1.053 . . . . 0.0 111.345 170.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.412 ' SG ' ' CA ' ' A' ' 29' ' ' CYS . 6.3 m -67.47 -33.16 74.56 Favored 'General case' 0 CA--C 1.498 -1.027 0 C-N-CA 125.922 1.689 . . . . 0.0 107.614 -175.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 33.4 m0 -64.55 -65.79 0.63 Allowed 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 106.53 -1.656 . . . . 0.0 106.53 177.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 21.4 p -55.87 -29.76 60.43 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 118.583 -0.723 . . . . 0.0 111.999 -179.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.25 -54.76 18.0 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 119.298 0.953 . . . . 0.0 111.27 175.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.8 t -60.0 -36.92 78.23 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-O 121.55 0.691 . . . . 0.0 110.089 179.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 75.0 mttt -60.82 -54.39 45.69 Favored 'General case' 0 N--CA 1.436 -1.141 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.938 174.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -43.98 -53.89 5.85 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 124.198 0.999 . . . . 0.0 111.001 177.948 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 91.7 t -77.32 -60.43 2.31 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.836 0 C-N-CA 124.543 1.137 . . . . 0.0 109.775 -173.237 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 30.8 p -103.52 -42.13 5.77 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 122.788 0.435 . . . . 0.0 111.95 -167.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 110.29 -16.5 29.63 Favored Glycine 0 CA--C 1.536 1.365 0 C-N-CA 124.567 1.08 . . . . 0.0 111.234 -165.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 3.5 m -82.75 65.33 7.82 Favored 'General case' 0 C--O 1.224 -0.252 0 C-N-CA 124.276 1.03 . . . . 0.0 110.339 -165.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -74.27 34.86 0.94 Allowed Glycine 0 CA--C 1.538 1.508 0 N-CA-C 117.856 1.902 . . . . 0.0 117.856 -155.132 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 57.4 mt-30 -113.65 124.83 53.24 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 119.891 1.845 . . . . 0.0 109.428 -177.05 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -170.73 -168.21 32.17 Favored Glycine 0 CA--C 1.523 0.559 0 CA-C-N 119.161 0.891 . . . . 0.0 112.529 -175.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -159.81 142.03 13.33 Favored 'General case' 0 CA--C 1.52 -0.207 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 175.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . 0.412 ' CA ' ' SG ' ' A' ' 14' ' ' CYS . 0.5 OUTLIER -86.54 157.52 19.73 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 108.188 -1.041 . . . . 0.0 108.188 -179.514 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 15.5 tt0 -136.67 123.93 21.86 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 105.383 -2.08 . . . . 0.0 105.383 176.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 22.2 t30 68.5 -92.75 0.03 OUTLIER 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 118.805 0.73 . . . . 0.0 109.795 167.244 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 24.3 m120 -154.46 57.05 0.7 Allowed 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 127.561 2.344 . . . . 0.0 105.691 160.486 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.7 mp0 -144.69 175.44 10.16 Favored 'General case' 0 N--CA 1.445 -0.68 0 C-N-CA 130.356 3.463 . . . . 0.0 103.097 175.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.2 m -149.91 161.85 41.48 Favored 'General case' 0 CA--C 1.504 -0.792 0 O-C-N 120.636 -1.29 . . . . 0.0 110.629 -173.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 49.6 mtp180 -139.63 150.72 45.29 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 -175.292 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 49.3 t -137.48 146.98 44.9 Favored 'General case' 0 N--CA 1.463 0.218 0 O-C-N 124.4 1.062 . . . . 0.0 110.398 -173.034 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 87.3 t80 . . . . . 0 N--CA 1.452 -0.328 0 C-N-CA 126.617 1.967 . . . . 0.0 109.344 -171.346 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 3.2 t80 . . . . . 0 N--CA 1.456 -0.157 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -57.61 171.91 3.12 Favored Glycine 0 CA--C 1.525 0.7 0 C-N-CA 126.708 2.099 . . . . 0.0 112.203 176.054 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -154.22 132.39 11.81 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 105.738 -1.949 . . . . 0.0 105.738 155.283 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -132.31 -176.45 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 N-CA-C 107.745 -1.205 . . . . 0.0 107.745 -175.226 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.452 ' CG ' ' HZ3' ' A' ' 7' ' ' LYS . 26.6 t0 -137.39 84.92 2.09 Favored 'General case' 0 N--CA 1.457 -0.097 0 CA-C-O 121.89 0.852 . . . . 0.0 110.928 163.821 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 94.6 t -128.35 136.43 60.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 N-CA-C 105.382 -2.081 . . . . 0.0 105.382 156.313 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.452 ' HZ3' ' CG ' ' A' ' 5' ' ' ASP . 13.2 mptt -70.42 115.74 9.95 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 123.765 0.826 . . . . 0.0 110.932 -168.381 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -68.69 125.38 26.37 Favored 'General case' 0 CA--C 1.514 -0.419 0 C-N-CA 122.661 0.385 . . . . 0.0 110.304 177.114 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -77.66 -27.13 50.82 Favored 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 124.61 1.194 . . . . 0.0 109.588 151.118 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -179.7 153.91 0.57 Allowed 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 124.417 1.087 . . . . 0.0 108.796 -172.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 36.7 m -49.51 -38.85 32.01 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 124.027 0.931 . . . . 0.0 113.04 173.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.3 p -62.12 -20.36 63.98 Favored 'General case' 0 N--CA 1.445 -0.71 0 C-N-CA 122.775 0.43 . . . . 0.0 112.127 -178.383 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.07 -50.74 18.3 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-N 118.509 0.595 . . . . 0.0 109.622 176.09 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 17.7 m -46.35 -28.65 1.39 Allowed 'General case' 0 CA--C 1.51 -0.575 0 C-N-CA 126.91 2.084 . . . . 0.0 110.52 -179.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 29.6 m0 -60.56 -71.43 0.14 Allowed 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 114.524 -1.217 . . . . 0.0 108.107 172.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -50.14 -31.04 12.5 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 124.109 0.964 . . . . 0.0 112.284 175.066 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.06 -54.77 32.81 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 120.273 1.397 . . . . 0.0 110.887 173.167 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 2.5 t -58.22 -35.72 72.09 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.863 0.84 . . . . 0.0 110.286 179.781 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 33.4 mtpt -63.22 -50.61 69.57 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.313 175.245 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -48.43 -55.41 10.96 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.91 0.884 . . . . 0.0 110.644 177.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -66.16 -61.35 1.73 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 179.05 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 81.9 p -107.78 -46.6 3.76 Favored 'General case' 0 C--N 1.338 0.107 0 CA-C-O 120.877 0.37 . . . . 0.0 111.16 -166.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 117.3 -16.94 12.71 Favored Glycine 0 CA--C 1.531 1.074 0 CA-C-N 115.295 -0.866 . . . . 0.0 111.303 -164.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 43.3 t -78.35 62.42 3.0 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 125.327 1.451 . . . . 0.0 110.683 -168.543 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -68.48 28.03 0.27 Allowed Glycine 0 CA--C 1.54 1.646 0 N-CA-C 118.369 2.108 . . . . 0.0 118.369 -157.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 58.2 mt-30 -113.06 108.07 16.82 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 120.584 2.192 . . . . 0.0 110.258 -173.473 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -157.44 -168.2 19.57 Favored Glycine 0 C--N 1.339 0.722 0 CA-C-O 119.872 -0.404 . . . . 0.0 112.599 -174.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -156.37 157.97 36.57 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 126.206 1.802 . . . . 0.0 107.718 170.872 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.51 162.82 15.5 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 108.725 -0.842 . . . . 0.0 108.725 178.108 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 20.4 tt0 -139.24 121.16 15.54 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 106.733 -1.58 . . . . 0.0 106.733 168.294 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 72.27 -88.22 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 123.051 0.54 . . . . 0.0 109.884 170.508 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.7 m120 -159.06 52.81 0.39 Allowed 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 128.55 2.74 . . . . 0.0 105.566 161.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 36.3 mt-30 -137.19 -175.19 3.97 Favored 'General case' 0 N--CA 1.444 -0.728 0 C-N-CA 128.933 2.893 . . . . 0.0 103.358 163.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.6 m -153.86 165.98 34.35 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 119.317 0.962 . . . . 0.0 110.321 -171.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 29.1 mtp180 -147.74 152.88 38.51 Favored 'General case' 0 CA--C 1.516 -0.357 0 C-N-CA 124.747 1.219 . . . . 0.0 108.326 -168.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 48.7 t -145.34 148.2 33.14 Favored 'General case' 0 C--N 1.328 -0.35 0 O-C-N 124.48 1.112 . . . . 0.0 109.491 -174.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.536 0.408 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -169.503 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 60.6 t80 . . . . . 0 N--CA 1.454 -0.263 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -48.52 160.75 0.6 Allowed Glycine 0 CA--C 1.525 0.715 0 C-N-CA 127.063 2.268 . . . . 0.0 112.416 177.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -143.65 130.79 20.7 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 119.022 1.411 . . . . 0.0 109.457 165.596 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -143.09 159.06 17.8 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.25 0 N-CA-C 106.298 -1.741 . . . . 0.0 106.298 -169.244 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -100.95 8.89 42.84 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 -164.014 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 93.3 t -78.7 136.2 24.36 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 O-C-N 121.687 -0.633 . . . . 0.0 110.68 -170.705 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -61.9 95.41 0.06 Allowed 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 125.419 1.488 . . . . 0.0 111.198 -177.177 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -61.38 120.18 9.96 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.557 170.851 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -83.18 -20.59 34.37 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 124.983 1.427 . . . . 0.0 109.941 151.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -178.83 150.19 0.48 Allowed 'General case' 0 C--N 1.341 0.239 0 C-N-CA 124.432 1.093 . . . . 0.0 109.123 -175.187 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 57.9 m -47.81 -35.61 10.42 Favored 'General case' 0 C--N 1.333 -0.129 0 C-N-CA 124.787 1.235 . . . . 0.0 113.754 173.079 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.0 p -61.24 -28.56 69.25 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 179.643 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -55.13 -54.65 40.46 Favored 'General case' 0 C--O 1.226 -0.175 0 C-N-CA 123.204 0.602 . . . . 0.0 109.507 174.563 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 11.4 m -55.02 -31.46 61.07 Favored 'General case' 0 N--CA 1.443 -0.811 0 C-N-CA 128.684 2.794 . . . . 0.0 109.253 -174.273 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 39.0 m0 -63.46 -68.34 0.35 Allowed 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 178.474 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -51.07 -32.23 21.43 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 118.345 -0.836 . . . . 0.0 112.163 175.483 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.54 -52.77 63.09 Favored 'General case' 0 C--N 1.339 0.136 0 CA-C-N 120.174 1.352 . . . . 0.0 110.326 174.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.8 t -62.46 -35.06 78.12 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 121.247 0.546 . . . . 0.0 110.434 179.3 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 41.7 mtpt -61.94 -51.92 66.15 Favored 'General case' 0 N--CA 1.44 -0.949 0 CA-C-O 121.788 0.804 . . . . 0.0 109.666 176.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.6 tptm -56.69 -42.41 79.04 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.19 -0.913 . . . . 0.0 111.493 -179.214 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 37.5 t -70.52 -59.49 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.357 0 C-N-CA 124.059 0.944 . . . . 0.0 109.447 179.195 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.7 t -117.63 -46.48 2.66 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.855 0.862 . . . . 0.0 111.966 -166.366 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 125.72 -25.04 5.68 Favored Glycine 0 CA--C 1.53 0.972 0 N-CA-C 111.162 -0.775 . . . . 0.0 111.162 -175.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 31.2 t -78.76 73.54 5.31 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 125.413 1.485 . . . . 0.0 108.821 -172.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -70.91 39.91 0.54 Allowed Glycine 0 CA--C 1.54 1.619 0 N-CA-C 116.294 1.278 . . . . 0.0 116.294 -168.451 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 64.2 mt-30 -114.79 115.75 27.52 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 126.217 1.807 . . . . 0.0 108.353 -174.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -170.93 -162.87 24.01 Favored Glycine 0 C--N 1.333 0.366 0 CA-C-N 119.524 1.056 . . . . 0.0 111.257 -176.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 4.6 pttp -167.06 164.81 15.91 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 165.319 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -87.39 172.11 10.07 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 119.999 -0.68 . . . . 0.0 110.153 -176.653 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -145.31 121.67 10.95 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 105.098 -2.186 . . . . 0.0 105.098 172.53 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 64.5 t30 68.86 -93.4 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 119.372 0.987 . . . . 0.0 110.23 169.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 26.1 m120 -153.8 52.03 0.69 Allowed 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 128.315 2.646 . . . . 0.0 106.002 161.532 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -139.17 177.58 7.8 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 131.07 3.748 . . . . 0.0 102.609 175.238 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.3 m -150.56 163.68 37.88 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-N 120.624 1.556 . . . . 0.0 111.647 -173.083 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 50.7 mtp180 -142.39 150.8 41.15 Favored 'General case' 0 CA--C 1.512 -0.518 0 C-N-CA 124.061 0.944 . . . . 0.0 109.686 -170.395 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 52.5 t -141.21 133.88 28.67 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 124.658 1.224 . . . . 0.0 112.694 -174.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 . . . . . 0 N--CA 1.451 -0.379 0 C-N-CA 126.573 1.949 . . . . 0.0 109.715 178.129 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 10.7 t80 . . . . . 0 N--CA 1.453 -0.283 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -39.39 148.04 0.15 Allowed Glycine 0 CA--C 1.522 0.521 0 C-N-CA 126.579 2.038 . . . . 0.0 112.139 160.126 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -140.2 130.34 25.0 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 162.339 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -137.07 162.57 33.87 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.18 0 N-CA-C 107.108 -1.441 . . . . 0.0 107.108 -167.095 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -90.56 -16.91 27.9 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 124.501 1.12 . . . . 0.0 112.621 -172.147 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 58.6 t -75.21 134.59 29.01 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 CA-C-N 118.795 0.725 . . . . 0.0 111.799 -157.321 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.2 tmtt? -37.7 106.31 0.05 OUTLIER 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 127.578 2.351 . . . . 0.0 112.104 173.067 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -75.28 135.22 40.95 Favored 'General case' 0 CA--C 1.515 -0.388 0 C-N-CA 120.332 -0.547 . . . . 0.0 109.915 168.907 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -95.12 -16.37 22.66 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 158.512 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 178.51 166.43 0.83 Allowed 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 106.099 -1.815 . . . . 0.0 106.099 -172.726 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.9 p -61.31 -39.33 90.09 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 124.06 0.944 . . . . 0.0 111.48 172.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.6 p -56.83 -40.96 76.99 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 122.86 0.464 . . . . 0.0 111.0 -177.455 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -40.66 -56.87 2.02 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.634 1.174 . . . . 0.0 111.078 170.546 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 23.7 m -57.95 -28.37 64.25 Favored 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 128.026 2.53 . . . . 0.0 109.73 -173.311 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 33.2 m0 -64.65 -66.15 0.58 Allowed 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 107.186 -1.413 . . . . 0.0 107.186 177.534 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -51.67 -33.14 32.54 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 118.085 -0.959 . . . . 0.0 111.696 174.409 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.85 -54.33 36.69 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 120.107 1.321 . . . . 0.0 110.742 175.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 5.1 t -58.12 -37.16 74.06 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.071 0.463 . . . . 0.0 110.46 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 40.3 mtmt -63.5 -58.71 6.15 Favored 'General case' 0 N--CA 1.44 -0.943 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.706 177.079 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 64.3 mmtt -49.55 -47.12 49.3 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.324 1.05 . . . . 0.0 111.772 178.11 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 43.7 t -70.87 -60.02 2.86 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.77 0 C-N-CA 123.962 0.905 . . . . 0.0 109.15 -178.08 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.2 m -118.58 -41.54 2.81 Favored 'General case' 0 N--CA 1.439 -1.004 0 C-N-CA 123.591 0.756 . . . . 0.0 110.987 -161.103 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 120.81 -21.36 8.44 Favored Glycine 0 CA--C 1.534 1.24 0 C-N-CA 124.925 1.25 . . . . 0.0 112.336 -177.778 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 21.5 m -88.22 61.12 6.09 Favored 'General case' 0 C--O 1.223 -0.297 0 C-N-CA 124.709 1.204 . . . . 0.0 110.331 -160.653 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -64.15 23.39 0.09 OUTLIER Glycine 0 CA--C 1.54 1.623 0 N-CA-C 120.414 2.926 . . . . 0.0 120.414 -152.626 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -108.38 118.2 36.16 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 121.129 2.465 . . . . 0.0 109.903 -176.3 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -164.04 -170.51 29.06 Favored Glycine 0 CA--C 1.528 0.876 0 N-CA-C 112.195 -0.362 . . . . 0.0 112.195 -174.589 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -156.34 156.08 33.33 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 125.138 1.375 . . . . 0.0 107.879 174.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -92.14 160.57 15.13 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 178.485 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.8 tp-100 -133.62 126.69 31.41 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 105.896 -1.89 . . . . 0.0 105.896 165.659 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.2 t30 69.04 -78.91 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 164.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -166.63 44.86 0.06 Allowed 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 130.411 3.484 . . . . 0.0 108.894 170.388 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -147.61 179.35 7.75 Favored 'General case' 0 N--CA 1.442 -0.825 0 C-N-CA 128.875 2.87 . . . . 0.0 104.167 177.453 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 5.0 m -153.94 164.75 37.9 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 119.894 1.224 . . . . 0.0 110.399 -169.422 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 73.4 mtp180 -140.0 152.93 46.68 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 125.651 1.58 . . . . 0.0 108.976 -178.685 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 36.8 t -132.59 162.63 30.8 Favored 'General case' 0 C--O 1.224 -0.26 0 O-C-N 124.652 1.22 . . . . 0.0 109.34 178.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.534 0.355 0 CA-C-N 118.651 0.66 . . . . 0.0 111.365 -177.294 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 7.2 m-85 . . . . . 0 CA--C 1.534 0.346 0 CA-C-O 120.805 0.336 . . . . 0.0 110.983 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 138.65 -152.7 22.21 Favored Glycine 0 C--N 1.334 0.448 0 C-N-CA 124.409 1.004 . . . . 0.0 111.035 172.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -89.84 149.76 22.53 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 117.427 0.614 . . . . 0.0 111.992 -172.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -126.1 167.09 21.13 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.995 0 N-CA-C 105.843 -1.91 . . . . 0.0 105.843 176.973 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -127.72 57.04 1.54 Allowed 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 122.0 0.905 . . . . 0.0 109.892 -177.197 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 43.6 t -128.37 143.8 39.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 N-CA-C 108.231 -1.025 . . . . 0.0 108.231 167.187 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -55.37 132.77 48.94 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 125.19 1.396 . . . . 0.0 113.312 -174.351 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -86.2 139.1 31.36 Favored 'General case' 0 CA--C 1.516 -0.363 0 C-N-CA 123.12 0.568 . . . . 0.0 109.672 164.107 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -91.01 -20.65 21.87 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 124.171 0.92 . . . . 0.0 109.543 154.497 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -178.91 173.47 1.2 Allowed 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 126.972 2.109 . . . . 0.0 106.273 -172.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 31.3 m -64.15 -32.86 74.6 Favored 'General case' 0 N--CA 1.462 0.135 0 C-N-CA 123.668 0.787 . . . . 0.0 112.631 173.332 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -54.12 -54.62 37.0 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 122.134 0.969 . . . . 0.0 110.723 -172.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.5 mp0 -32.57 -57.64 0.34 Allowed 'General case' 0 N--CA 1.429 -1.514 0 C-N-CA 128.07 2.548 . . . . 0.0 114.285 168.577 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 14.5 m -54.17 -29.28 45.04 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 126.376 1.87 . . . . 0.0 109.679 -175.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 30.9 m0 -66.92 -66.54 0.54 Allowed 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 106.214 -1.772 . . . . 0.0 106.214 -179.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -50.36 -32.34 17.08 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 124.018 0.927 . . . . 0.0 111.392 174.815 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.85 -56.42 19.54 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 119.578 1.081 . . . . 0.0 109.732 175.056 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -60.15 -34.05 73.02 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-O 121.048 0.451 . . . . 0.0 111.057 179.478 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 32.6 mtpt -63.72 -54.58 33.2 Favored 'General case' 0 N--CA 1.442 -0.847 0 O-C-N 121.618 -0.676 . . . . 0.0 111.103 176.793 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -57.19 -39.27 75.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.521 178.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 31.8 t -73.32 -67.89 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.431 -1.4 0 C-N-CA 124.293 1.037 . . . . 0.0 109.218 179.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -107.29 -40.23 5.45 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 122.956 0.502 . . . . 0.0 112.063 -170.481 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 117.61 -15.97 12.64 Favored Glycine 0 CA--C 1.532 1.152 0 C-N-CA 124.608 1.099 . . . . 0.0 110.822 -166.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 30.4 t -82.22 64.82 7.07 Favored 'General case' 0 CA--C 1.527 0.094 0 C-N-CA 124.353 1.061 . . . . 0.0 110.092 -166.568 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -70.97 38.38 0.52 Allowed Glycine 0 CA--C 1.535 1.339 0 N-CA-C 117.916 1.926 . . . . 0.0 117.916 -160.06 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 -121.04 114.07 20.96 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 120.071 1.936 . . . . 0.0 108.58 -179.189 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -158.22 -177.69 31.55 Favored Glycine 0 CA--C 1.523 0.534 0 N-CA-C 111.52 -0.632 . . . . 0.0 111.52 -175.498 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -153.35 145.29 23.62 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 106.922 -1.51 . . . . 0.0 106.922 177.637 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -88.51 165.88 14.57 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 178.663 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -138.77 118.33 12.98 Favored 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 105.656 -1.979 . . . . 0.0 105.656 171.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 63.46 -89.32 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.455 0.702 . . . . 0.0 110.556 172.549 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.2 m120 -153.25 53.65 0.75 Allowed 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 127.001 2.121 . . . . 0.0 107.07 168.142 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -143.62 166.17 25.58 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 103.036 -2.949 . . . . 0.0 103.036 173.038 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.2 m -143.12 158.31 43.73 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 120.853 1.66 . . . . 0.0 110.257 -174.436 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 33.5 mtp180 -142.82 154.12 43.87 Favored 'General case' 0 CA--C 1.514 -0.433 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 -172.024 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 41.8 t -133.4 140.71 47.49 Favored 'General case' 0 C--N 1.328 -0.331 0 O-C-N 124.16 0.913 . . . . 0.0 110.15 -172.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 82.8 t80 . . . . . 0 N--CA 1.455 -0.222 0 C-N-CA 125.568 1.547 . . . . 0.0 109.81 -163.258 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 5.8 m-30 . . . . . 0 CA--C 1.532 0.285 0 CA-C-O 121.04 0.447 . . . . 0.0 111.034 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 123.14 -151.34 16.87 Favored Glycine 0 C--N 1.333 0.37 0 C-N-CA 124.461 1.029 . . . . 0.0 111.749 169.463 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -109.49 133.74 52.72 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 114.926 1.454 . . . . 0.0 114.926 -159.471 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -138.98 154.2 25.7 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.495 0 N-CA-C 104.348 -2.464 . . . . 0.0 104.348 -165.559 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -122.89 35.16 4.94 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 119.635 1.107 . . . . 0.0 111.089 -171.252 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.3 p -77.43 136.98 23.22 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-N 116.141 -0.481 . . . . 0.0 109.774 172.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 37.5 mtpt -66.16 96.01 0.31 Allowed 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.453 1.101 . . . . 0.0 112.221 -175.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.9 p -61.95 131.42 49.64 Favored 'General case' 0 CA--C 1.519 -0.213 0 O-C-N 123.789 0.681 . . . . 0.0 110.847 176.571 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 81.8 m-85 -88.36 -26.64 22.09 Favored 'General case' 0 N--CA 1.444 -0.771 0 C-N-CA 125.627 1.571 . . . . 0.0 108.749 155.194 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -165.87 160.27 16.73 Favored 'General case' 0 C--N 1.344 0.364 0 C-N-CA 123.548 0.739 . . . . 0.0 109.815 179.622 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.9 p -58.26 -41.24 83.81 Favored 'General case' 0 C--N 1.333 -0.118 0 C-N-CA 123.924 0.889 . . . . 0.0 111.404 173.713 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.39 -24.98 63.89 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 122.81 0.444 . . . . 0.0 111.672 -178.332 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 45.1 tt0 -61.85 -44.56 96.58 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 121.708 -0.62 . . . . 0.0 111.204 172.428 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 29.0 m -59.6 -27.91 66.71 Favored 'General case' 0 N--CA 1.439 -0.993 0 C-N-CA 125.687 1.595 . . . . 0.0 108.871 -177.079 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 36.5 m0 -65.98 -67.5 0.44 Allowed 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 107.444 -1.317 . . . . 0.0 107.444 178.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -53.26 -28.32 27.03 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.921 0.889 . . . . 0.0 111.57 175.019 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.02 -55.65 17.71 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 119.549 1.068 . . . . 0.0 110.23 174.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.2 t -61.08 -32.82 72.47 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 110.439 -0.208 . . . . 0.0 110.439 -179.434 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.6 mtmp? -63.41 -61.39 2.38 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-O 121.156 0.503 . . . . 0.0 110.853 174.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 17.1 pttm -59.52 -31.31 69.27 Favored 'General case' 0 N--CA 1.44 -0.964 0 N-CA-C 112.403 0.52 . . . . 0.0 112.403 -174.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 53.9 t -79.42 -57.57 5.03 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.514 0 C-N-CA 124.281 1.032 . . . . 0.0 109.865 176.309 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 13.2 t -140.64 25.34 2.19 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 113.753 1.02 . . . . 0.0 113.753 -162.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.35 -24.19 0.27 Allowed Glycine 0 CA--C 1.537 1.465 0 O-C-N 120.902 -1.123 . . . . 0.0 115.247 177.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 47.4 m -87.92 64.98 8.12 Favored 'General case' 0 C--O 1.223 -0.324 0 O-C-N 121.122 -1.223 . . . . 0.0 110.603 -155.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -66.79 23.49 0.18 Allowed Glycine 0 CA--C 1.538 1.513 0 N-CA-C 119.589 2.596 . . . . 0.0 119.589 -154.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -111.7 121.91 46.39 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 120.736 2.268 . . . . 0.0 109.709 -175.078 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -170.82 -166.08 29.15 Favored Glycine 0 C--N 1.337 0.613 0 CA-C-N 118.742 0.701 . . . . 0.0 111.832 -177.675 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.63 155.54 21.94 Favored 'General case' 0 CA--C 1.52 -0.177 0 C-N-CA 124.8 1.24 . . . . 0.0 108.586 174.51 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -91.37 166.15 13.04 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 -178.594 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -148.79 121.64 8.73 Favored 'General case' 0 C--O 1.22 -0.483 0 N-CA-C 105.345 -2.095 . . . . 0.0 105.345 -179.197 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 57.65 -94.94 0.05 Allowed 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.913 1.233 . . . . 0.0 109.717 178.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 21.0 m120 -147.22 61.47 1.17 Allowed 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 126.509 1.924 . . . . 0.0 106.926 165.348 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 21.4 mp0 -147.09 173.64 12.3 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 129.5 3.12 . . . . 0.0 105.062 177.547 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.7 m -150.52 157.08 42.59 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 -176.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.06 143.26 27.07 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 124.213 1.005 . . . . 0.0 109.036 -174.053 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 40.7 t -131.45 148.25 52.63 Favored 'General case' 0 C--N 1.338 0.09 0 O-C-N 123.853 0.72 . . . . 0.0 110.47 -164.385 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 87.7 t80 . . . . . 0 N--CA 1.455 -0.218 0 C-N-CA 125.901 1.68 . . . . 0.0 109.722 -168.276 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 . . . . . 0 N--CA 1.451 -0.4 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 110.59 -152.5 17.39 Favored Glycine 0 CA--C 1.521 0.412 0 C-N-CA 124.071 0.843 . . . . 0.0 112.021 169.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -103.95 136.34 43.78 Favored 'General case' 0 C--N 1.343 0.285 0 N-CA-C 115.184 1.55 . . . . 0.0 115.184 -156.177 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -136.17 159.2 38.78 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.66 0 N-CA-C 103.984 -2.598 . . . . 0.0 103.984 -170.589 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -137.27 47.53 2.1 Favored 'General case' 0 C--N 1.328 -0.354 0 O-C-N 120.901 -1.124 . . . . 0.0 109.234 -173.085 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 87.7 t -97.6 139.35 20.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 171.534 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.72 105.91 0.18 Allowed 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -175.22 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.2 p -67.64 133.84 50.08 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 169.437 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -78.86 -33.33 45.95 Favored 'General case' 0 N--CA 1.454 -0.236 0 O-C-N 124.335 1.022 . . . . 0.0 109.003 151.613 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -172.76 156.86 3.59 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 124.213 1.005 . . . . 0.0 108.374 -175.33 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 58.8 m -46.94 -45.88 21.03 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 124.488 1.115 . . . . 0.0 112.617 175.523 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.3 m -63.83 -11.7 29.61 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 -177.464 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.9 -48.41 31.03 Favored 'General case' 0 C--O 1.215 -0.74 0 CA-C-N 119.29 0.95 . . . . 0.0 109.271 168.427 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 18.4 m -48.71 -29.91 4.97 Favored 'General case' 0 CA--C 1.513 -0.473 0 C-N-CA 125.944 1.698 . . . . 0.0 110.1 -178.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 42.2 m0 -62.31 -68.09 0.36 Allowed 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 107.01 -1.478 . . . . 0.0 107.01 175.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -52.89 -28.51 23.54 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 117.789 -1.101 . . . . 0.0 112.444 173.931 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.3 -53.46 52.49 Favored 'General case' 0 C--O 1.228 -0.065 0 CA-C-N 121.306 1.866 . . . . 0.0 109.903 174.7 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -61.95 -34.14 75.56 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.122 178.535 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 40.8 mtmt -65.31 -52.15 55.93 Favored 'General case' 0 N--CA 1.445 -0.695 0 O-C-N 121.835 -0.541 . . . . 0.0 111.502 176.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 65.6 mttt -49.76 -45.95 50.05 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.243 1.417 . . . . 0.0 109.938 177.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 95.1 t -76.79 -69.84 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.424 -1.732 0 C-N-CA 124.252 1.021 . . . . 0.0 109.887 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 47.0 p -98.31 -49.04 4.83 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 122.457 0.303 . . . . 0.0 111.445 -169.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 123.35 -17.52 7.91 Favored Glycine 0 CA--C 1.533 1.207 0 C-N-CA 124.961 1.267 . . . . 0.0 111.193 -163.434 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 5.0 m -81.9 64.66 6.69 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 124.483 1.113 . . . . 0.0 110.612 -165.387 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -71.77 38.93 0.63 Allowed Glycine 0 CA--C 1.539 1.539 0 N-CA-C 118.26 2.064 . . . . 0.0 118.26 -155.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -123.27 133.03 54.21 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 120.312 2.056 . . . . 0.0 109.171 -175.605 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 179.01 -164.31 32.51 Favored Glycine 0 CA--C 1.524 0.647 0 CA-C-N 119.24 0.927 . . . . 0.0 111.181 -177.375 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.75 158.07 32.9 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 123.946 0.898 . . . . 0.0 109.108 166.806 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -91.98 165.32 13.27 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 -178.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 -146.42 115.8 7.09 Favored 'General case' 0 N--CA 1.444 -0.761 0 N-CA-C 105.644 -1.984 . . . . 0.0 105.644 179.184 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 71.48 -83.3 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 118.743 0.701 . . . . 0.0 110.325 170.059 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 36.3 m120 -162.35 55.58 0.23 Allowed 'General case' 0 N--CA 1.463 0.181 0 C-N-CA 130.026 3.33 . . . . 0.0 104.639 164.102 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -143.93 174.44 10.84 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 129.278 3.031 . . . . 0.0 103.431 177.009 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.2 m -154.41 158.67 40.37 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-N 120.525 1.511 . . . . 0.0 108.952 -173.456 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.56 140.58 25.03 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 123.594 0.758 . . . . 0.0 109.684 -173.519 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 41.1 t -122.58 148.55 45.09 Favored 'General case' 0 C--N 1.34 0.195 0 C-N-CA 123.816 0.846 . . . . 0.0 110.49 -168.283 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 90.9 t80 . . . . . 0 N--CA 1.452 -0.359 0 C-N-CA 126.101 1.76 . . . . 0.0 109.846 -173.747 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 2.6 t80 . . . . . 0 N--CA 1.453 -0.297 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -57.59 137.17 49.93 Favored Glycine 0 N--CA 1.445 -0.721 0 N-CA-C 110.212 -1.155 . . . . 0.0 110.212 151.858 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -145.22 130.8 18.85 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 118.362 1.081 . . . . 0.0 110.49 165.738 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -145.05 160.21 13.67 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.219 0 N-CA-C 106.403 -1.702 . . . . 0.0 106.403 -163.131 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -120.42 32.58 5.95 Favored 'General case' 0 C--N 1.332 -0.159 0 C-N-CA 123.542 0.737 . . . . 0.0 110.737 -173.378 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 97.0 t -82.88 133.87 28.15 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 N-CA-C 108.115 -1.069 . . . . 0.0 108.115 171.681 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.1 mtpp -65.26 94.24 0.16 Allowed 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 125.701 1.6 . . . . 0.0 112.057 -173.606 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.7 p -58.44 136.02 57.38 Favored 'General case' 0 N--CA 1.464 0.238 0 O-C-N 123.436 0.46 . . . . 0.0 110.616 173.517 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 82.0 m-85 -91.09 -27.25 18.7 Favored 'General case' 0 N--CA 1.445 -0.697 0 C-N-CA 126.592 1.957 . . . . 0.0 108.306 152.666 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -158.68 162.05 37.17 Favored 'General case' 0 C--N 1.344 0.329 0 CA-C-N 118.605 0.639 . . . . 0.0 110.834 179.087 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.8 p -61.88 -45.07 95.36 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 124.875 1.27 . . . . 0.0 111.234 173.003 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.9 p -55.04 -32.25 61.72 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 121.178 0.513 . . . . 0.0 111.092 -178.147 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 48.7 tt0 -51.98 -48.78 64.23 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 123.607 0.763 . . . . 0.0 111.937 172.493 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 32.9 m -56.62 -30.42 63.25 Favored 'General case' 0 N--CA 1.444 -0.774 0 C-N-CA 126.606 1.962 . . . . 0.0 109.006 -177.985 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 32.2 m0 -64.56 -64.08 0.97 Allowed 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 107.494 -1.299 . . . . 0.0 107.494 179.832 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -51.6 -35.41 41.39 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 118.385 -0.817 . . . . 0.0 111.463 173.563 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.66 -56.15 18.0 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 119.872 1.214 . . . . 0.0 110.559 -179.038 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -57.71 -36.55 72.14 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.37 0.605 . . . . 0.0 110.472 179.32 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.7 mtmp? -62.8 -50.74 69.8 Favored 'General case' 0 N--CA 1.435 -1.202 0 CA-C-N 115.589 -0.732 . . . . 0.0 112.442 177.507 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 65.9 mmtt -50.22 -52.99 31.29 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 123.66 0.784 . . . . 0.0 111.024 178.272 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -67.93 -63.95 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 CA-C-N 118.177 0.444 . . . . 0.0 111.651 177.537 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.9 m -116.92 -37.79 3.54 Favored 'General case' 0 N--CA 1.442 -0.838 0 C-N-CA 123.581 0.753 . . . . 0.0 110.465 -155.652 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 116.94 -14.83 13.92 Favored Glycine 0 CA--C 1.531 1.055 0 C-N-CA 123.196 0.427 . . . . 0.0 113.183 -178.757 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.7 t -82.04 67.29 7.98 Favored 'General case' 0 N--CA 1.465 0.313 0 O-C-N 121.601 -0.94 . . . . 0.0 109.621 -166.663 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -74.08 37.08 0.93 Allowed Glycine 0 CA--C 1.537 1.457 0 N-CA-C 116.964 1.546 . . . . 0.0 116.964 -159.407 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -122.65 126.71 48.16 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 125.814 1.645 . . . . 0.0 107.522 -175.481 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -179.37 -172.43 43.54 Favored Glycine 0 CA--C 1.525 0.663 0 CA-C-N 119.246 0.93 . . . . 0.0 111.922 -176.091 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.28 157.13 42.73 Favored 'General case' 0 C--O 1.232 0.135 0 C-N-CA 125.62 1.568 . . . . 0.0 107.457 166.878 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -89.74 151.63 21.73 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 178.474 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 54.7 tp60 -124.09 112.88 17.65 Favored 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 105.923 -1.88 . . . . 0.0 105.923 177.85 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 62.95 -89.77 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 119.256 0.934 . . . . 0.0 110.099 174.567 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -150.28 56.22 0.94 Allowed 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 126.713 2.005 . . . . 0.0 107.916 164.128 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -135.55 179.75 6.14 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 129.313 3.045 . . . . 0.0 103.953 166.047 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.2 m -150.43 147.44 27.55 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-N 119.457 1.026 . . . . 0.0 109.319 -178.265 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 41.7 mtt180 -140.18 136.59 33.61 Favored 'General case' 0 CA--C 1.513 -0.464 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 -173.407 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.8 t -126.16 167.46 15.38 Favored 'General case' 0 C--O 1.225 -0.187 0 O-C-N 124.577 1.173 . . . . 0.0 110.103 -162.929 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 28.6 t80 . . . . . 0 N--CA 1.452 -0.333 0 C-N-CA 124.394 1.078 . . . . 0.0 109.429 166.65 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 . . . . . 0 N--CA 1.45 -0.434 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 124.64 -135.7 9.64 Favored Glycine 0 C--N 1.335 0.477 0 CA-C-O 118.742 -1.032 . . . . 0.0 111.581 167.957 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -110.25 144.2 39.29 Favored 'General case' 0 CA--C 1.519 -0.219 0 C-N-CA 124.224 1.009 . . . . 0.0 112.759 -165.781 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -132.15 171.13 18.57 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.208 0 N-CA-C 106.17 -1.789 . . . . 0.0 106.17 -170.382 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -133.42 83.44 2.05 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-O 122.26 1.028 . . . . 0.0 110.249 168.451 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 93.5 t -125.78 138.67 53.74 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 CA-C-N 113.956 -1.474 . . . . 0.0 107.374 160.819 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -68.58 106.25 2.52 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 124.495 1.118 . . . . 0.0 111.32 -169.34 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 5.8 p -66.67 130.44 43.18 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 120.784 0.326 . . . . 0.0 110.965 174.301 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -78.95 -36.21 41.99 Favored 'General case' 0 N--CA 1.442 -0.832 0 C-N-CA 125.351 1.46 . . . . 0.0 108.124 148.069 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -161.47 154.71 21.17 Favored 'General case' 0 C--O 1.222 -0.359 0 CA-C-N 118.44 0.563 . . . . 0.0 112.008 -177.451 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 27.9 m -50.75 -41.08 56.19 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 123.862 0.865 . . . . 0.0 112.583 173.606 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.31 -20.08 57.82 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 123.058 0.543 . . . . 0.0 112.292 -179.0 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 70.7 tt0 -72.03 -44.03 64.03 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 124.083 0.953 . . . . 0.0 110.79 176.05 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 20.8 m -55.16 -29.48 57.87 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 126.635 1.974 . . . . 0.0 108.874 179.21 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 36.1 m0 -64.83 -68.42 0.36 Allowed 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 179.288 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -54.71 -26.51 34.21 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 123.909 0.884 . . . . 0.0 111.557 175.938 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.14 -55.5 18.33 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 119.943 1.247 . . . . 0.0 109.806 174.003 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 3.8 t -55.16 -38.68 68.59 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.974 0.892 . . . . 0.0 110.278 178.579 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.9 mtmt -63.23 -53.6 50.5 Favored 'General case' 0 N--CA 1.434 -1.235 0 CA-C-N 115.159 -0.928 . . . . 0.0 110.519 177.133 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -52.98 -40.96 64.13 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 116.924 -1.512 . . . . 0.0 113.119 -179.007 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -67.98 -60.74 2.18 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 CA-C-N 119.314 0.961 . . . . 0.0 111.318 169.665 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 47.5 p -113.54 -65.96 1.13 Allowed 'General case' 0 N--CA 1.458 -0.065 0 CA-C-O 121.306 0.575 . . . . 0.0 110.45 -168.168 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 148.17 -23.05 1.41 Allowed Glycine 0 CA--C 1.529 0.963 0 CA-C-N 115.137 -0.938 . . . . 0.0 113.171 -170.757 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.2 p -82.44 72.36 9.51 Favored 'General case' 0 C--N 1.333 -0.139 0 O-C-N 121.553 -0.969 . . . . 0.0 109.666 -168.875 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -70.51 50.91 0.83 Allowed Glycine 0 CA--C 1.537 1.452 0 N-CA-C 117.034 1.574 . . . . 0.0 117.034 -163.057 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -131.53 101.9 5.7 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 125.421 1.488 . . . . 0.0 109.788 -165.188 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -161.82 -165.85 19.49 Favored Glycine 0 CA--C 1.525 0.681 0 CA-C-N 118.242 0.474 . . . . 0.0 113.467 -170.798 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 20.6 ttmm -162.98 144.91 10.14 Favored 'General case' 0 C--O 1.232 0.164 0 N-CA-C 107.403 -1.332 . . . . 0.0 107.403 178.853 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -87.64 162.19 17.27 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 -179.54 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.4 tp-100 -143.27 132.71 23.47 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 106.929 -1.508 . . . . 0.0 106.929 171.221 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 64.08 -91.26 0.03 OUTLIER 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 123.214 0.606 . . . . 0.0 109.975 170.065 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 23.2 m120 -155.42 62.92 0.61 Allowed 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 127.608 2.363 . . . . 0.0 105.781 158.234 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 17.2 mp0 -147.69 179.46 7.68 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 130.951 3.701 . . . . 0.0 103.983 174.267 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.5 m -152.84 161.17 42.89 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 121.11 -0.994 . . . . 0.0 109.572 -174.598 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.8 mtt85 -138.05 152.83 49.2 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 124.416 1.086 . . . . 0.0 109.26 179.406 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 53.5 t -136.45 137.72 40.72 Favored 'General case' 0 CA--C 1.522 -0.132 0 C-N-CA 124.317 1.047 . . . . 0.0 108.314 179.828 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.141 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 -153.933 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 13.8 t80 . . . . . 0 CA--C 1.533 0.311 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -47.35 -178.08 0.01 OUTLIER Glycine 0 CA--C 1.531 1.053 0 C-N-CA 128.813 3.101 . . . . 0.0 112.862 166.423 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -155.57 128.45 8.03 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 106.592 -1.633 . . . . 0.0 106.592 150.424 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -139.41 159.21 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.176 0 N-CA-C 106.432 -1.692 . . . . 0.0 106.432 -174.212 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -92.89 -9.67 39.33 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.253 1.021 . . . . 0.0 112.244 -171.5 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 59.2 t -72.09 134.37 30.01 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 C-N-CA 119.953 -0.699 . . . . 0.0 110.55 -160.777 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -58.08 101.2 0.07 Allowed 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 125.568 1.547 . . . . 0.0 111.531 -174.385 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -68.25 129.13 39.0 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 109.265 -0.642 . . . . 0.0 109.265 168.869 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -91.7 -16.8 26.41 Favored 'General case' 0 N--CA 1.454 -0.258 0 O-C-N 124.353 1.033 . . . . 0.0 109.316 150.437 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -169.7 148.15 3.59 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 123.701 0.801 . . . . 0.0 109.069 -178.698 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 27.1 m -47.37 -39.64 15.65 Favored 'General case' 0 N--CA 1.46 0.034 0 C-N-CA 124.551 1.14 . . . . 0.0 112.092 170.899 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.2 p -61.37 -22.93 65.41 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-O 118.889 -0.577 . . . . 0.0 112.25 -177.933 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.86 -47.88 56.9 Favored 'General case' 0 C--O 1.216 -0.678 0 CA-C-N 119.437 1.017 . . . . 0.0 109.283 174.372 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 27.5 m -47.9 -28.32 2.6 Favored 'General case' 0 CA--C 1.512 -0.513 0 C-N-CA 126.227 1.811 . . . . 0.0 110.441 -177.486 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 39.0 m0 -64.34 -67.79 0.4 Allowed 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.339 -1.3 . . . . 0.0 107.735 176.633 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -52.24 -27.95 16.81 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-O 118.164 -0.922 . . . . 0.0 111.725 172.878 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.07 -61.57 1.97 Allowed 'General case' 0 C--N 1.339 0.151 0 CA-C-N 121.035 1.743 . . . . 0.0 110.986 175.929 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -57.81 -30.41 65.68 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.249 0.547 . . . . 0.0 110.533 179.295 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.7 mtmt -67.89 -49.72 60.36 Favored 'General case' 0 N--CA 1.443 -0.79 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 172.742 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 51.6 mttt -50.21 -49.64 52.07 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 124.695 1.198 . . . . 0.0 109.789 178.771 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -67.45 -67.21 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 CA-C-N 118.146 0.43 . . . . 0.0 111.412 173.762 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 18.5 m -114.26 -49.46 2.84 Favored 'General case' 0 N--CA 1.438 -1.046 0 C-N-CA 123.255 0.622 . . . . 0.0 110.425 -158.045 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 133.16 -15.79 4.74 Favored Glycine 0 CA--C 1.533 1.189 0 C-N-CA 123.013 0.339 . . . . 0.0 112.829 -171.729 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.0 m -79.27 61.74 3.44 Favored 'General case' 0 C--O 1.225 -0.191 0 C-N-CA 124.393 1.077 . . . . 0.0 111.868 -164.624 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -70.67 1.6 21.16 Favored Glycine 0 CA--C 1.536 1.36 0 N-CA-C 116.159 1.223 . . . . 0.0 116.159 -158.71 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 60.0 mt-30 -90.66 110.81 21.98 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 119.846 1.823 . . . . 0.0 108.14 -176.631 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -164.44 -161.93 14.45 Favored Glycine 0 C--N 1.337 0.638 0 CA-C-N 118.741 0.701 . . . . 0.0 114.672 -170.879 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 6.9 mttp -169.29 150.58 4.35 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 123.935 0.894 . . . . 0.0 109.175 -175.179 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -94.32 160.47 14.66 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.932 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.0 tt0 -134.6 131.69 38.14 Favored 'General case' 0 N--CA 1.444 -0.767 0 N-CA-C 105.296 -2.113 . . . . 0.0 105.296 165.974 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 21.1 t30 67.22 -90.81 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 118.713 0.688 . . . . 0.0 110.574 163.522 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 31.1 m120 -156.16 53.83 0.56 Allowed 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 127.968 2.507 . . . . 0.0 106.107 164.032 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 25.0 mp0 -151.05 176.9 10.7 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 129.391 3.076 . . . . 0.0 103.818 -179.802 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.6 m -160.41 167.84 26.46 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 120.21 1.368 . . . . 0.0 111.137 -165.47 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 33.6 mtp180 -146.58 160.83 41.66 Favored 'General case' 0 CA--C 1.518 -0.266 0 C-N-CA 125.054 1.342 . . . . 0.0 109.255 179.809 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 29.0 p -131.32 177.89 7.13 Favored 'General case' 0 CA--C 1.513 -0.445 0 O-C-N 124.507 1.129 . . . . 0.0 109.88 162.399 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 3.8 p90 . . . . . 0 N--CA 1.446 -0.633 0 C-N-CA 124.197 0.999 . . . . 0.0 111.879 -172.356 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 79.5 t80 . . . . . 0 N--CA 1.453 -0.319 0 CA-C-O 122.021 0.915 . . . . 0.0 110.357 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -63.31 139.68 44.32 Favored Glycine 0 N--CA 1.449 -0.484 0 N-CA-C 108.236 -1.946 . . . . 0.0 108.236 167.169 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -145.62 127.97 15.87 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 119.208 1.504 . . . . 0.0 110.582 163.889 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -143.61 158.92 16.74 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.205 0 N-CA-C 106.063 -1.828 . . . . 0.0 106.063 -160.551 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -120.39 30.22 7.06 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 121.745 0.783 . . . . 0.0 112.352 -174.226 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 52.4 t -85.79 134.42 27.26 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 171.787 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.6 mptt -69.82 107.29 3.46 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 125.443 1.497 . . . . 0.0 112.056 -165.181 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -63.3 126.16 26.51 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 123.896 0.878 . . . . 0.0 109.968 171.219 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -82.73 -21.55 34.72 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 124.873 1.358 . . . . 0.0 109.173 153.128 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -175.64 179.24 1.45 Allowed 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 126.174 1.79 . . . . 0.0 106.588 -176.156 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 39.7 m -70.98 -34.02 70.99 Favored 'General case' 0 N--CA 1.461 0.104 0 C-N-CA 125.497 1.519 . . . . 0.0 113.093 173.779 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -52.88 -56.3 16.84 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-O 122.065 0.936 . . . . 0.0 110.963 -172.36 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . 0.269 8.4 mp0 -20.97 -59.44 0.03 OUTLIER 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 128.93 2.892 . . . . 0.0 115.761 159.4 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 31.6 m -61.08 -27.29 68.25 Favored 'General case' 0 N--CA 1.442 -0.828 0 C-N-CA 125.706 1.602 . . . . 0.0 109.09 -172.295 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 35.9 m0 -69.7 -64.85 0.8 Allowed 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 -179.007 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -52.78 -30.79 34.96 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 124.049 0.939 . . . . 0.0 110.869 174.76 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.22 -57.98 8.71 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 119.385 0.993 . . . . 0.0 110.329 173.615 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -59.21 -32.21 69.73 Favored 'General case' 0 CA--C 1.521 -0.15 0 O-C-N 121.989 -0.444 . . . . 0.0 111.063 -179.461 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.6 mtmt -64.95 -57.09 9.65 Favored 'General case' 0 N--CA 1.437 -1.122 0 CA-C-O 120.797 0.332 . . . . 0.0 111.1 176.2 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.2 mtpt -56.46 -38.27 71.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.591 -179.858 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 40.6 t -70.03 -61.94 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.427 -1.615 0 C-N-CA 123.848 0.859 . . . . 0.0 109.172 176.948 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.2 m -120.6 -45.69 2.4 Favored 'General case' 0 N--CA 1.436 -1.137 0 C-N-CA 123.628 0.771 . . . . 0.0 111.16 -162.877 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 126.26 -20.05 6.3 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 124.636 1.112 . . . . 0.0 111.997 -173.376 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 31.0 t -84.23 65.58 8.89 Favored 'General case' 0 C--N 1.333 -0.145 0 C-N-CA 124.691 1.197 . . . . 0.0 109.636 -166.136 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -71.03 40.27 0.55 Allowed Glycine 0 CA--C 1.533 1.183 0 N-CA-C 117.539 1.776 . . . . 0.0 117.539 -160.084 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -129.19 123.95 33.34 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 120.093 1.947 . . . . 0.0 109.261 -175.186 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -177.05 -166.22 33.64 Favored Glycine 0 C--N 1.335 0.507 0 N-CA-C 110.109 -1.196 . . . . 0.0 110.109 -175.543 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 6.7 mtmp? -153.89 166.02 34.26 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 124.492 1.117 . . . . 0.0 108.074 164.435 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -85.58 165.06 17.37 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 176.845 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -136.95 128.81 29.09 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 105.703 -1.962 . . . . 0.0 105.703 165.117 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 67.68 -89.9 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 123.238 0.615 . . . . 0.0 110.397 166.577 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 31.9 m120 -154.58 58.38 0.69 Allowed 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 127.314 2.246 . . . . 0.0 105.899 161.256 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 19.7 mp0 -151.15 176.45 11.17 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 129.288 3.035 . . . . 0.0 104.18 179.121 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.7 m -154.83 153.99 32.05 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-N 120.324 1.42 . . . . 0.0 110.73 -169.743 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 17.4 mtt180 -145.11 128.26 16.67 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 124.048 0.939 . . . . 0.0 110.204 -168.731 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -99.79 161.71 13.45 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 123.332 0.653 . . . . 0.0 111.453 178.039 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.454 -0.232 0 C-N-CA 123.811 0.844 . . . . 0.0 111.284 -171.272 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 . . . . . 0 C--O 1.233 0.219 0 CA-C-O 120.321 0.105 . . . . 0.0 110.966 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -42.35 142.95 1.33 Allowed Glycine 0 C--N 1.337 0.613 0 CA-C-O 118.796 -1.002 . . . . 0.0 111.325 172.282 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -141.9 129.2 21.1 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 106.439 -1.689 . . . . 0.0 106.439 167.016 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -131.73 -175.63 1.49 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.726 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 -165.742 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -141.58 83.81 1.88 Allowed 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 122.081 0.943 . . . . 0.0 110.86 161.07 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 80.5 t -130.14 134.57 62.51 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 N-CA-C 105.6 -2.0 . . . . 0.0 105.6 160.554 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.0 mptt -68.91 111.19 4.8 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 124.642 1.177 . . . . 0.0 110.263 -169.333 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -61.23 126.96 29.26 Favored 'General case' 0 CA--C 1.515 -0.376 0 C-N-CA 122.725 0.41 . . . . 0.0 110.191 175.518 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -89.67 -15.77 31.91 Favored 'General case' 0 N--CA 1.449 -0.488 0 O-C-N 125.003 1.439 . . . . 0.0 109.598 157.51 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 179.33 153.05 0.42 Allowed 'General case' 0 C--N 1.344 0.359 0 C-N-CA 125.485 1.514 . . . . 0.0 108.604 -177.146 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 24.4 m -54.95 -37.48 66.51 Favored 'General case' 0 N--CA 1.462 0.165 0 C-N-CA 123.056 0.542 . . . . 0.0 112.162 171.906 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.45 -23.18 64.22 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-O 119.427 -0.32 . . . . 0.0 111.765 179.076 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -67.46 -50.78 57.66 Favored 'General case' 0 C--O 1.217 -0.627 0 CA-C-N 118.655 0.661 . . . . 0.0 109.562 175.071 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 23.7 m -49.32 -27.31 3.79 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 126.108 1.763 . . . . 0.0 110.655 -177.108 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 31.2 m0 -63.36 -65.96 0.61 Allowed 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 114.821 -1.081 . . . . 0.0 108.192 173.271 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -52.95 -31.51 40.85 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-O 117.716 -1.135 . . . . 0.0 111.585 174.084 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.47 -55.46 27.43 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 121.686 2.039 . . . . 0.0 110.477 173.801 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 2.0 t -54.53 -37.46 65.41 Favored 'General case' 0 CA--C 1.527 0.087 0 C-N-CA 123.088 0.555 . . . . 0.0 109.858 178.259 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.7 mtpt -66.7 -54.24 25.16 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-O 121.351 0.596 . . . . 0.0 111.784 177.563 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 20.1 mtpp -53.75 -38.65 64.61 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 124.659 1.184 . . . . 0.0 110.25 -179.413 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 54.1 t -76.07 -61.63 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.426 -1.632 0 C-N-CA 124.734 1.214 . . . . 0.0 110.051 177.715 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 11.4 t -134.52 13.47 3.77 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 114.166 1.173 . . . . 0.0 114.166 -162.753 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 76.17 -26.19 1.53 Allowed Glycine 0 CA--C 1.537 1.424 0 O-C-N 120.317 -1.489 . . . . 0.0 114.259 178.658 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.4 m -81.17 62.8 5.26 Favored 'General case' 0 C--O 1.223 -0.333 0 C-N-CA 125.451 1.5 . . . . 0.0 111.511 -162.621 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -66.73 49.44 0.22 Allowed Glycine 0 CA--C 1.54 1.647 0 N-CA-C 119.023 2.369 . . . . 0.0 119.023 -156.807 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -130.92 118.71 21.08 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 120.477 2.139 . . . . 0.0 109.945 -173.419 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -172.98 -164.95 29.21 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 111.357 -0.697 . . . . 0.0 111.357 -177.378 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 58.4 mttt -160.56 161.13 32.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 124.882 1.273 . . . . 0.0 108.582 169.531 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -92.18 162.34 14.36 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 -177.674 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.7 tp-100 -133.55 133.72 42.47 Favored 'General case' 0 N--CA 1.444 -0.733 0 N-CA-C 106.069 -1.826 . . . . 0.0 106.069 166.407 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 63.55 -87.63 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 117.971 0.35 . . . . 0.0 111.64 168.084 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -161.02 63.94 0.29 Allowed 'General case' 0 C--O 1.227 -0.118 0 C-N-CA 129.681 3.192 . . . . 0.0 104.169 165.259 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -161.64 174.58 13.11 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 129.279 3.032 . . . . 0.0 103.007 -177.759 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.7 m -153.65 160.61 42.44 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 121.199 1.818 . . . . 0.0 111.075 -169.112 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 63.8 mtp180 -139.43 151.12 45.99 Favored 'General case' 0 CA--C 1.511 -0.554 0 C-N-CA 125.351 1.461 . . . . 0.0 108.812 178.559 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -154.5 154.32 32.95 Favored 'General case' 0 C--N 1.333 -0.124 0 O-C-N 124.117 0.886 . . . . 0.0 112.562 -178.885 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.243 0 CA-C-O 120.962 0.41 . . . . 0.0 111.037 -174.171 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.3 pt? . . . . . 0 N--CA 1.449 -0.492 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -136.14 167.38 24.68 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.171 0 N-CA-C 106.563 -1.644 . . . . 0.0 106.563 -164.342 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -129.68 88.38 2.67 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 122.193 0.997 . . . . 0.0 108.718 162.837 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 99.1 t -133.23 137.9 52.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 159.571 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.4 mptt -41.04 107.66 0.08 Allowed 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 127.217 2.207 . . . . 0.0 112.746 178.526 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.501 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -68.16 133.57 49.11 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 167.231 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -93.62 -15.07 25.74 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 158.154 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 176.25 155.91 0.23 Allowed 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 125.902 1.681 . . . . 0.0 107.832 -175.82 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 40.6 m -51.46 -39.62 57.83 Favored 'General case' 0 C--O 1.227 -0.12 0 C-N-CA 123.006 0.522 . . . . 0.0 111.724 171.843 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.9 p -62.8 -20.21 64.79 Favored 'General case' 0 N--CA 1.445 -0.716 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -178.439 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.25 -49.2 36.87 Favored 'General case' 0 C--O 1.218 -0.569 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 175.107 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 20.3 m -46.63 -29.64 1.94 Allowed 'General case' 0 CA--C 1.503 -0.853 0 C-N-CA 126.106 1.762 . . . . 0.0 110.138 178.534 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 31.5 m0 -63.59 -66.06 0.59 Allowed 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 176.517 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -51.37 -35.95 40.98 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 118.455 -0.783 . . . . 0.0 111.75 174.776 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.08 -57.05 11.92 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 120.243 1.383 . . . . 0.0 111.376 177.601 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 17.7 m -58.8 -33.78 70.75 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 122.232 1.015 . . . . 0.0 110.895 -179.531 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.5 mtmt -69.23 -42.78 75.22 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-N 115.178 -0.919 . . . . 0.0 113.143 175.655 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 41.7 mttm -54.28 -53.8 48.83 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.519 0.328 . . . . 0.0 110.359 174.317 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -62.78 -57.14 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 178.339 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 60.2 p -116.4 -57.24 2.22 Favored 'General case' 0 CA--C 1.522 -0.117 0 CA-C-O 121.185 0.517 . . . . 0.0 110.897 -169.136 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 130.29 -15.19 5.57 Favored Glycine 0 CA--C 1.532 1.136 0 CA-C-N 114.874 -1.057 . . . . 0.0 112.07 -161.325 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 58.0 p -79.11 63.28 3.73 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 118.659 1.229 . . . . 0.0 111.049 -171.853 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -69.0 2.3 8.8 Favored Glycine 0 CA--C 1.533 1.187 0 O-C-N 121.517 -0.739 . . . . 0.0 114.916 -164.556 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 30.8 mt-30 -85.93 105.52 16.46 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 119.158 1.479 . . . . 0.0 107.375 -177.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -158.45 -172.81 26.06 Favored Glycine 0 CA--C 1.524 0.645 0 CA-C-O 121.148 0.304 . . . . 0.0 112.908 -172.349 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 4.4 ttmm -159.84 143.34 14.24 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 125.398 1.479 . . . . 0.0 107.658 -174.55 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' CYS . . . . . 0.501 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -89.39 151.43 22.05 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 177.41 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 56.7 tp60 -125.31 116.9 22.66 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 105.079 -2.193 . . . . 0.0 105.079 172.506 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 66.04 -82.37 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 118.911 0.778 . . . . 0.0 111.481 168.487 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -157.9 43.29 0.31 Allowed 'General case' 0 N--CA 1.444 -0.727 0 C-N-CA 128.423 2.689 . . . . 0.0 109.649 171.214 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 26.5 mp0 -141.65 178.42 7.48 Favored 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 128.006 2.522 . . . . 0.0 105.091 172.802 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.408 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 0.9 OUTLIER -159.27 152.47 22.31 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 119.185 0.902 . . . . 0.0 110.16 -164.444 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 8.8 mtt180 -146.29 132.87 19.81 Favored 'General case' 0 C--O 1.227 -0.09 0 CA-C-O 118.415 -0.802 . . . . 0.0 110.087 -167.354 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -102.91 164.17 11.78 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 123.712 0.805 . . . . 0.0 111.225 168.273 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 71.4 t80 . . . . . 0 N--CA 1.451 -0.392 0 C-N-CA 126.816 2.046 . . . . 0.0 109.384 177.98 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.5 pt? . . . . . 0 N--CA 1.448 -0.57 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -136.87 178.25 5.08 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.018 0 N-CA-C 107.429 -1.322 . . . . 0.0 107.429 -166.421 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 49.6 t0 -130.19 102.29 6.16 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 154.301 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -130.97 148.31 33.06 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 N-CA-C 105.995 -1.854 . . . . 0.0 105.995 148.79 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 42.7 mttm -64.57 115.46 5.21 Favored 'General case' 0 N--CA 1.444 -0.735 0 C-N-CA 123.828 0.851 . . . . 0.0 110.866 -170.043 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.548 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -73.22 119.55 17.62 Favored 'General case' 0 CA--C 1.511 -0.536 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 175.296 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -79.79 -22.88 42.57 Favored 'General case' 0 N--CA 1.449 -0.496 0 O-C-N 125.495 1.747 . . . . 0.0 109.078 156.067 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 178.97 154.17 0.41 Allowed 'General case' 0 C--N 1.344 0.344 0 C-N-CA 125.405 1.482 . . . . 0.0 108.751 -175.247 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.514 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 19.0 m -52.79 -38.71 61.52 Favored 'General case' 0 C--O 1.231 0.105 0 C-N-CA 123.321 0.649 . . . . 0.0 112.38 171.655 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.31 -22.28 64.75 Favored 'General case' 0 N--CA 1.445 -0.68 0 C-N-CA 122.721 0.408 . . . . 0.0 111.925 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.07 -51.11 34.51 Favored 'General case' 0 C--O 1.22 -0.489 0 CA-C-O 121.329 0.585 . . . . 0.0 109.506 176.063 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 20.8 m -47.6 -28.61 2.41 Favored 'General case' 0 CA--C 1.51 -0.579 0 C-N-CA 126.361 1.864 . . . . 0.0 110.444 -179.122 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 27.0 m0 -61.79 -68.55 0.31 Allowed 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 173.463 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -50.99 -32.47 21.25 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 117.945 -1.026 . . . . 0.0 112.308 174.852 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.01 -51.19 67.78 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 120.88 1.673 . . . . 0.0 110.831 173.715 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 2.0 t -60.79 -35.84 77.48 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 121.444 0.64 . . . . 0.0 109.813 178.646 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.3 mtpt -63.19 -50.61 69.66 Favored 'General case' 0 N--CA 1.44 -0.941 0 O-C-N 121.477 -0.765 . . . . 0.0 110.331 176.132 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 39.6 tptt -52.12 -45.3 64.87 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 124.452 1.101 . . . . 0.0 111.205 178.708 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 43.6 t -75.01 -63.14 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.428 -1.561 0 C-N-CA 124.646 1.178 . . . . 0.0 109.732 -178.328 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -110.3 -35.12 6.16 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.817 0.847 . . . . 0.0 112.421 -166.999 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 108.76 -23.21 24.49 Favored Glycine 0 CA--C 1.532 1.106 0 N-CA-C 110.6 -1.0 . . . . 0.0 110.6 -170.321 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 13.6 m -81.91 66.63 7.57 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 125.595 1.558 . . . . 0.0 110.046 -167.242 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -67.49 47.61 0.29 Allowed Glycine 0 CA--C 1.54 1.64 0 N-CA-C 117.98 1.952 . . . . 0.0 117.98 -160.6 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -132.38 98.61 4.43 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 119.951 1.875 . . . . 0.0 110.594 -163.606 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -159.17 -163.6 13.36 Favored Glycine 0 CA--C 1.525 0.702 0 CA-C-O 119.838 -0.423 . . . . 0.0 113.339 -172.92 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -158.65 160.17 36.2 Favored 'General case' 0 C--O 1.232 0.184 0 C-N-CA 126.997 2.119 . . . . 0.0 107.636 169.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' CYS . . . . . 0.548 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -91.13 160.89 15.33 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 178.406 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -136.96 126.02 24.44 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 173.262 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 6.2 m120 64.43 -82.64 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.647 1.179 . . . . 0.0 110.616 174.53 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -163.63 43.89 0.11 Allowed 'General case' 0 N--CA 1.441 -0.899 0 C-N-CA 127.47 2.308 . . . . 0.0 106.155 172.093 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -139.79 -177.82 5.14 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 129.911 3.285 . . . . 0.0 103.84 175.278 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.442 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.5 m -150.11 160.41 43.68 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 120.328 1.422 . . . . 0.0 111.897 -171.57 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 51.3 mtp180 -144.94 147.96 33.3 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 124.139 0.975 . . . . 0.0 108.385 -172.29 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 48.0 t -133.95 159.71 39.9 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.45 -0.474 0 CA-C-N 118.464 0.574 . . . . 0.0 110.858 -173.985 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.6 pt? . . . . . 0 N--CA 1.454 -0.257 0 N-CA-C 106.317 -1.735 . . . . 0.0 106.317 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.3 pt -145.35 151.47 15.04 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.48 0 N-CA-C 104.828 -2.286 . . . . 0.0 104.828 -152.024 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -108.65 86.91 2.37 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 170.382 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 19.6 m -121.16 135.84 60.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 114.052 -1.431 . . . . 0.0 108.249 157.569 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -73.03 95.44 2.01 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 124.082 0.953 . . . . 0.0 111.525 -167.62 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.489 ' HB3' ' HB2' ' A' ' 29' ' ' CYS . 1.6 p -64.92 131.04 45.6 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.706 -177.76 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -87.15 -25.72 23.95 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 124.26 0.975 . . . . 0.0 109.468 151.151 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -164.09 167.62 20.07 Favored 'General case' 0 C--O 1.223 -0.291 0 C-N-CA 123.748 0.819 . . . . 0.0 109.186 -178.383 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.445 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 1.7 p -59.13 -37.48 77.32 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 125.15 1.38 . . . . 0.0 112.179 174.877 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.5 p -56.25 -36.33 68.42 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 121.287 0.565 . . . . 0.0 111.581 -176.496 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -39.59 -53.37 2.13 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 125.37 1.468 . . . . 0.0 111.947 168.002 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.7 m -67.94 -31.07 70.56 Favored 'General case' 0 N--CA 1.439 -0.996 0 C-N-CA 127.76 2.424 . . . . 0.0 108.813 -173.365 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 33.3 m0 -65.1 -63.36 1.12 Allowed 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 106.227 -1.768 . . . . 0.0 106.227 176.954 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 1.3 p -53.69 -31.02 46.31 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 119.026 -0.512 . . . . 0.0 111.573 177.062 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.8 -57.54 10.52 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 119.371 0.987 . . . . 0.0 110.72 174.3 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -58.85 -34.77 71.97 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 122.171 0.986 . . . . 0.0 110.583 -178.739 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.9 mtpm? -62.54 -55.46 27.16 Favored 'General case' 0 N--CA 1.438 -1.037 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.912 176.651 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 85.1 mttt -48.22 -50.25 30.11 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 124.175 0.99 . . . . 0.0 111.481 -179.475 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -68.65 -71.34 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 118.58 0.627 . . . . 0.0 110.907 174.618 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 88.3 m -104.43 -35.79 7.79 Favored 'General case' 0 N--CA 1.435 -1.223 0 C-N-CA 123.96 0.904 . . . . 0.0 110.74 -159.191 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 112.02 -16.4 25.36 Favored Glycine 0 CA--C 1.532 1.126 0 C-N-CA 123.374 0.512 . . . . 0.0 111.982 -175.08 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.7 p -80.84 63.91 5.41 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 126.557 1.943 . . . . 0.0 110.031 -166.918 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -72.54 41.64 0.82 Allowed Glycine 0 CA--C 1.537 1.44 0 N-CA-C 117.57 1.788 . . . . 0.0 117.57 -155.893 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -120.87 135.17 55.25 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 119.955 1.877 . . . . 0.0 109.214 -177.785 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 175.52 -166.42 37.82 Favored Glycine 0 CA--C 1.524 0.633 0 N-CA-C 111.189 -0.764 . . . . 0.0 111.189 -177.719 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 4.3 mptt -157.89 156.2 30.94 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 125.363 1.465 . . . . 0.0 108.676 171.602 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' CYS . . . . . 0.489 ' HB2' ' HB3' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -90.53 160.84 15.76 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 -179.746 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -137.88 131.2 30.64 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 105.518 -2.03 . . . . 0.0 105.518 170.543 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 31.4 t30 67.58 -93.05 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 118.984 0.811 . . . . 0.0 110.089 165.402 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 24.3 m120 -154.95 58.51 0.67 Allowed 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 127.888 2.475 . . . . 0.0 105.367 160.787 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 17.1 mp0 -149.25 178.37 8.81 Favored 'General case' 0 N--CA 1.444 -0.733 0 C-N-CA 129.762 3.225 . . . . 0.0 103.711 177.218 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.448 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.3 m -155.4 165.22 37.29 Favored 'General case' 0 CA--C 1.506 -0.726 0 O-C-N 120.899 -1.126 . . . . 0.0 110.055 -171.24 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -141.9 146.34 35.61 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 175.946 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 20.2 m -84.35 -129.65 0.03 OUTLIER 'General case' 0 N--CA 1.439 -1.0 0 N-CA-C 108.058 -1.09 . . . . 0.0 108.058 164.552 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 3.8 p90 . . . . . 0 N--CA 1.449 -0.508 0 C-N-CA 124.01 0.924 . . . . 0.0 108.853 -173.998 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.5 pp . . . . . 0 N--CA 1.456 -0.163 0 N-CA-C 111.818 0.303 . . . . 0.0 111.818 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -130.09 -168.76 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.903 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 -174.954 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.5 t0 -135.5 105.44 6.22 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-O 120.745 0.307 . . . . 0.0 110.599 156.859 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -142.7 136.65 27.38 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.21 0 N-CA-C 109.295 -0.632 . . . . 0.0 109.295 152.235 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 55.1 pttt -46.31 114.52 0.82 Allowed 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 125.648 1.579 . . . . 0.0 112.001 176.951 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.503 ' HB3' ' HB2' ' A' ' 29' ' ' CYS . 5.2 p -88.39 134.73 33.75 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 118.004 0.365 . . . . 0.0 111.838 177.156 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -90.39 -21.33 22.01 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 153.67 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -164.89 166.68 19.37 Favored 'General case' 0 C--O 1.223 -0.303 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 -178.809 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.405 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 1.9 p -59.75 -39.24 84.14 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 124.519 1.127 . . . . 0.0 111.737 172.403 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.5 p -56.06 -36.29 67.9 Favored 'General case' 0 N--CA 1.451 -0.381 0 O-C-N 121.969 -0.457 . . . . 0.0 111.448 -176.381 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -39.18 -55.25 1.68 Allowed 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.159 1.384 . . . . 0.0 111.486 167.58 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 13.8 m -64.97 -31.45 72.69 Favored 'General case' 0 N--CA 1.438 -1.025 0 C-N-CA 128.186 2.595 . . . . 0.0 108.824 -173.268 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 33.2 m0 -64.02 -67.0 0.47 Allowed 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 105.837 -1.912 . . . . 0.0 105.837 178.501 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -52.44 -32.84 41.34 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 123.265 0.626 . . . . 0.0 111.843 177.732 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.95 -54.88 35.67 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 119.519 1.054 . . . . 0.0 110.147 175.668 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.7 t -59.94 -34.74 73.66 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-O 120.865 0.364 . . . . 0.0 110.643 179.312 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.413 ' CG ' ' HA3' ' A' ' 25' ' ' GLY . 4.8 mtpm? -63.36 -55.14 26.96 Favored 'General case' 0 N--CA 1.438 -1.046 0 O-C-N 122.314 -0.241 . . . . 0.0 110.833 176.571 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -53.22 -48.29 68.27 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 123.311 0.645 . . . . 0.0 111.079 178.774 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 40.8 t -70.79 -51.23 38.0 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.485 0 C-N-CA 123.997 0.919 . . . . 0.0 110.191 -176.355 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -129.03 -34.16 1.93 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.778 0.831 . . . . 0.0 112.341 -157.945 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 118.16 -31.94 5.46 Favored Glycine 0 CA--C 1.533 1.156 0 C-N-CA 124.588 1.09 . . . . 0.0 112.342 176.514 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 49.5 m -85.53 81.69 8.58 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 126.254 1.822 . . . . 0.0 110.253 -166.268 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.413 ' HA3' ' CG ' ' A' ' 19' ' ' LYS . . . -76.53 47.46 2.42 Favored Glycine 0 CA--C 1.536 1.363 0 CA-C-O 118.72 -1.045 . . . . 0.0 115.355 -164.482 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -119.52 122.57 41.94 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 119.341 1.571 . . . . 0.0 108.739 -178.93 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -173.35 -169.14 35.42 Favored Glycine 0 CA--C 1.522 0.522 0 CA-C-N 119.162 0.892 . . . . 0.0 112.233 -174.897 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -161.8 145.34 12.34 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 177.2 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' CYS . . . . . 0.503 ' HB2' ' HB3' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -88.37 152.27 22.03 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 179.265 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 31.0 tp60 -127.59 108.69 10.99 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 105.67 -1.974 . . . . 0.0 105.67 -179.436 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 65.64 -79.69 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 119.233 0.924 . . . . 0.0 111.44 172.279 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -159.31 43.08 0.23 Allowed 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 129.327 3.051 . . . . 0.0 110.758 169.178 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -133.9 -171.56 2.76 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 105.97 -1.863 . . . . 0.0 105.97 157.226 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.458 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.2 m -145.03 162.35 37.16 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 119.254 0.934 . . . . 0.0 111.079 -172.52 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 41.3 mtp180 -142.9 153.36 43.03 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 -174.934 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 49.1 t -135.3 148.39 49.49 Favored 'General case' 0 C--N 1.33 -0.267 0 O-C-N 124.437 1.086 . . . . 0.0 110.891 -175.78 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 88.3 t80 . . . . . 0 C--O 1.234 0.276 0 C-N-CA 126.837 2.055 . . . . 0.0 109.433 -172.11 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.4 pt? . . . . . 0 N--CA 1.447 -0.618 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -132.9 166.05 30.57 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.878 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 -161.465 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 22.0 p-10 -117.53 24.96 10.75 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 125.52 1.528 . . . . 0.0 112.115 -169.522 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 21.3 t -117.02 133.35 64.04 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 C-N-CA 123.811 0.844 . . . . 0.0 110.127 -179.702 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt -46.31 146.14 1.48 Allowed 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 126.853 2.061 . . . . 0.0 114.491 -176.416 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.532 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -104.56 129.49 52.64 Favored 'General case' 0 CA--C 1.511 -0.539 0 C-N-CA 123.034 0.533 . . . . 0.0 110.221 167.89 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -94.66 -10.74 30.9 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 157.694 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -174.98 168.75 3.47 Favored 'General case' 0 C--N 1.342 0.264 0 C-N-CA 126.154 1.782 . . . . 0.0 107.499 -179.436 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.456 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 2.6 p -64.82 -42.99 94.53 Favored 'General case' 0 C--N 1.333 -0.122 0 C-N-CA 125.81 1.644 . . . . 0.0 111.462 169.385 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.4 p -55.11 -38.88 68.72 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 122.094 -0.379 . . . . 0.0 110.824 -177.297 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -35.31 -55.91 0.63 Allowed 'General case' 0 C--O 1.222 -0.349 0 C-N-CA 125.329 1.451 . . . . 0.0 112.097 166.848 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 18.8 m -64.07 -31.2 72.31 Favored 'General case' 0 N--CA 1.439 -1.016 0 C-N-CA 127.986 2.514 . . . . 0.0 108.491 -170.729 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 29.8 m0 -66.41 -63.26 1.11 Allowed 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 106.927 -1.508 . . . . 0.0 106.927 178.433 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -53.8 -31.75 50.11 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.458 0.703 . . . . 0.0 111.533 175.754 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.72 -56.72 10.53 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 119.775 1.171 . . . . 0.0 109.862 178.117 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -57.49 -35.81 70.68 Favored 'General case' 0 CA--C 1.514 -0.421 0 CA-C-O 121.028 0.442 . . . . 0.0 110.758 179.654 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.455 ' CG ' ' HA3' ' A' ' 25' ' ' GLY . 18.9 mtmm -63.55 -58.14 7.93 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.416 175.879 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 7.4 mtpm? -54.0 -39.83 66.42 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 123.514 0.725 . . . . 0.0 111.825 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 42.6 t -73.93 -62.2 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.5 0 C-N-CA 123.953 0.901 . . . . 0.0 109.022 179.071 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.2 m -117.02 -43.55 2.85 Favored 'General case' 0 N--CA 1.439 -0.984 0 C-N-CA 124.083 0.953 . . . . 0.0 110.902 -161.312 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 124.13 -21.34 6.94 Favored Glycine 0 CA--C 1.534 1.241 0 C-N-CA 124.873 1.225 . . . . 0.0 112.376 -176.091 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 9.7 t -86.22 72.88 10.31 Favored 'General case' 0 C--O 1.227 -0.126 0 O-C-N 121.474 -1.015 . . . . 0.0 109.102 -164.953 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.455 ' HA3' ' CG ' ' A' ' 19' ' ' LYS . . . -73.72 38.45 0.9 Allowed Glycine 0 CA--C 1.533 1.184 0 N-CA-C 117.369 1.708 . . . . 0.0 117.369 -160.495 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 61.0 mt-30 -116.16 122.68 45.79 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 126.394 1.877 . . . . 0.0 108.625 -176.914 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -174.8 -166.47 32.72 Favored Glycine 0 CA--C 1.521 0.458 0 CA-C-N 119.298 0.954 . . . . 0.0 111.869 -177.414 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 78.1 tttt -166.69 150.3 7.03 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 175.323 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' CYS . . . . . 0.532 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -88.23 161.35 17.25 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 -177.817 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -138.9 115.96 10.95 Favored 'General case' 0 N--CA 1.441 -0.876 0 N-CA-C 106.707 -1.59 . . . . 0.0 106.707 173.529 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 73.27 -75.58 0.07 Allowed 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.432 0.693 . . . . 0.0 111.493 165.616 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -168.48 46.94 0.04 OUTLIER 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 129.739 3.216 . . . . 0.0 109.418 167.316 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -144.01 -170.21 3.28 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 104.991 -2.225 . . . . 0.0 104.991 160.223 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.422 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 3.9 m -150.76 159.48 44.5 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 119.268 0.94 . . . . 0.0 110.235 -170.0 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 51.1 mtt-85 -136.11 152.38 50.78 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 124.599 1.159 . . . . 0.0 109.934 179.038 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 41.2 t -131.99 167.86 18.92 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 124.1 0.875 . . . . 0.0 111.281 -172.684 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 86.0 m-85 . . . . . 0 C--O 1.233 0.191 0 C-N-CA 127.132 2.173 . . . . 0.0 109.135 172.074 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.1 pt? . . . . . 0 N--CA 1.447 -0.622 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -133.24 -175.29 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.974 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 -168.476 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -143.71 91.78 2.28 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 121.625 0.726 . . . . 0.0 110.179 162.759 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 94.8 t -135.73 140.95 43.38 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 161.697 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.22 104.29 0.08 Allowed 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 125.79 1.636 . . . . 0.0 113.183 -177.19 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.92 130.71 42.34 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 167.107 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 29.6 m-85 -88.7 -21.72 23.75 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 123.752 0.821 . . . . 0.0 109.438 150.4 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -167.55 168.6 12.69 Favored 'General case' 0 C--O 1.224 -0.283 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 -175.887 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.3 p -62.89 -41.98 99.61 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 125.478 1.511 . . . . 0.0 111.973 174.747 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.41 ' HA ' ' CD2' ' A' ' 15' ' ' TRP . 23.0 t -57.1 -35.57 69.59 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 121.683 -0.635 . . . . 0.0 111.376 -174.303 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -35.63 -55.48 0.69 Allowed 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.387 1.475 . . . . 0.0 112.645 163.94 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 11.6 m -65.94 -31.41 72.32 Favored 'General case' 0 N--CA 1.439 -1.011 0 C-N-CA 127.892 2.477 . . . . 0.0 109.01 -173.88 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.41 ' CD2' ' HA ' ' A' ' 12' ' ' SER . 35.4 m0 -64.87 -63.37 1.13 Allowed 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 106.421 -1.696 . . . . 0.0 106.421 177.471 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -53.65 -33.0 53.7 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 122.865 0.466 . . . . 0.0 111.685 176.96 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.86 -55.49 29.23 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 119.265 0.938 . . . . 0.0 110.267 175.34 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -60.13 -34.08 73.03 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 121.097 0.475 . . . . 0.0 110.373 178.586 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.45 ' CG ' ' HA3' ' A' ' 25' ' ' GLY . 30.1 mtmt -64.15 -50.81 66.73 Favored 'General case' 0 N--CA 1.44 -0.967 0 O-C-N 121.35 -0.844 . . . . 0.0 110.456 178.311 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 10.2 mtpm? -57.97 -39.73 78.88 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.795 178.779 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 38.3 t -72.32 -60.51 2.35 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.403 0 C-N-CA 123.802 0.841 . . . . 0.0 109.551 179.323 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.9 t -118.24 -39.96 3.0 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.171 0.988 . . . . 0.0 112.578 -165.835 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 120.52 -25.36 7.33 Favored Glycine 0 CA--C 1.532 1.128 0 C-N-CA 123.896 0.76 . . . . 0.0 111.648 -178.172 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.9 t -87.83 75.27 8.92 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 124.048 0.939 . . . . 0.0 108.996 -167.058 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.45 ' HA3' ' CG ' ' A' ' 19' ' ' LYS . . . -71.95 54.47 1.38 Allowed Glycine 0 CA--C 1.534 1.234 0 N-CA-C 116.891 1.516 . . . . 0.0 116.891 -161.009 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -129.62 123.03 30.26 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 120.278 2.039 . . . . 0.0 111.171 -173.013 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -175.55 -168.99 36.72 Favored Glycine 0 CA--C 1.527 0.837 0 CA-C-N 118.273 0.488 . . . . 0.0 112.256 -176.648 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -149.06 158.78 44.45 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 125.987 1.715 . . . . 0.0 107.651 165.097 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' CYS . . . . . 0.427 ' HA ' ' HA ' ' A' ' 34' ' ' CYS . 0.4 OUTLIER -86.94 153.73 21.36 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 179.98 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 2.2 tp60 -124.5 106.8 10.45 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 176.512 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 73.88 -85.31 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.409 0 O-C-N 121.752 -0.593 . . . . 0.0 109.836 167.301 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 34.3 m120 -152.73 46.19 0.71 Allowed 'General case' 0 C--O 1.224 -0.266 0 C-N-CA 127.323 2.249 . . . . 0.0 107.289 161.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 5.2 mp0 -135.44 -175.84 4.07 Favored 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 128.597 2.759 . . . . 0.0 103.994 169.909 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.427 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 0.9 OUTLIER -153.41 154.33 34.24 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 119.947 1.249 . . . . 0.0 110.545 -170.151 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 66.6 mtp180 -144.05 111.74 6.09 Favored 'General case' 0 CA--C 1.506 -0.724 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.338 -168.022 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -76.39 168.31 20.28 Favored 'General case' 0 N--CA 1.438 -1.032 0 CA-C-O 121.798 0.809 . . . . 0.0 110.384 166.797 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 1.4 p90 . . . . . 0 N--CA 1.443 -0.8 0 C-N-CA 124.913 1.285 . . . . 0.0 111.25 177.674 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.2 pt? . . . . . 0 N--CA 1.445 -0.68 0 N-CA-C 107.294 -1.373 . . . . 0.0 107.294 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -136.53 158.28 37.48 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.25 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 -162.585 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -86.44 -17.92 33.04 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 125.061 1.344 . . . . 0.0 112.012 -171.619 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 63.2 t -70.09 134.44 30.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 C-N-CA 119.994 -0.682 . . . . 0.0 110.756 -159.862 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 56.8 pttt -53.6 102.2 0.05 Allowed 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.331 1.452 . . . . 0.0 112.611 -178.028 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.448 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -62.6 131.41 48.96 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 169.995 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -90.67 -17.2 27.23 Favored 'General case' 0 CA--C 1.535 0.402 0 O-C-N 124.684 1.24 . . . . 0.0 109.659 157.495 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 173.54 156.41 0.12 Allowed 'General case' 0 C--N 1.343 0.323 0 C-N-CA 126.41 1.884 . . . . 0.0 107.518 -175.88 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 35.4 m -47.6 -38.4 14.47 Favored 'General case' 0 CA--C 1.528 0.131 0 C-N-CA 124.151 0.98 . . . . 0.0 113.581 174.949 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.0 p -60.98 -28.59 69.12 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 121.892 -0.505 . . . . 0.0 112.005 -179.195 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 7.6 tm-20 -55.5 -52.89 62.16 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.178 0.591 . . . . 0.0 109.435 173.788 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 15.1 m -55.94 -28.17 55.7 Favored 'General case' 0 N--CA 1.442 -0.862 0 C-N-CA 127.726 2.41 . . . . 0.0 109.705 -176.216 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 37.4 m0 -66.68 -66.5 0.55 Allowed 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 107.039 -1.467 . . . . 0.0 107.039 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -50.89 -33.52 24.42 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 118.368 -0.825 . . . . 0.0 111.112 174.181 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.35 -58.75 5.12 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 120.056 1.298 . . . . 0.0 111.534 177.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -60.81 -30.26 69.97 Favored 'General case' 0 CA--C 1.519 -0.232 0 O-C-N 121.511 -0.743 . . . . 0.0 110.886 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -65.97 -48.73 70.31 Favored 'General case' 0 N--CA 1.442 -0.859 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.747 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.1 tmtt? -60.3 -37.64 81.15 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 124.453 1.101 . . . . 0.0 110.774 177.693 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 29.8 t -72.17 -62.0 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.428 -1.543 0 C-N-CA 124.05 0.94 . . . . 0.0 108.497 177.865 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.3 m -122.06 -49.87 2.06 Favored 'General case' 0 N--CA 1.431 -1.395 0 C-N-CA 123.922 0.889 . . . . 0.0 110.684 -163.196 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 134.18 -20.95 3.94 Favored Glycine 0 CA--C 1.536 1.389 0 C-N-CA 123.926 0.774 . . . . 0.0 112.253 -170.237 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 30.9 m -82.83 63.09 6.76 Favored 'General case' 0 C--O 1.228 -0.079 0 C-N-CA 125.205 1.402 . . . . 0.0 111.084 -164.783 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -65.99 1.26 4.92 Favored Glycine 0 CA--C 1.536 1.371 0 N-CA-C 116.297 1.279 . . . . 0.0 116.297 -162.795 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -89.56 105.48 17.82 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 119.629 1.714 . . . . 0.0 108.401 -173.432 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -158.85 -174.0 27.99 Favored Glycine 0 C--N 1.333 0.397 0 O-C-N 122.27 -0.269 . . . . 0.0 112.712 -171.624 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -151.33 154.98 37.77 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 124.753 1.221 . . . . 0.0 108.109 173.317 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' CYS . . . . . 0.448 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -87.77 161.04 17.8 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 176.951 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 45.9 tt0 -136.01 127.63 28.89 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 105.164 -2.161 . . . . 0.0 105.164 170.881 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 68.71 -89.45 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 118.797 0.726 . . . . 0.0 110.555 168.333 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 36.6 m120 -161.27 55.28 0.28 Allowed 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 130.129 3.372 . . . . 0.0 104.065 165.011 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -145.99 175.47 10.42 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 130.855 3.662 . . . . 0.0 102.794 176.58 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.404 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.2 m -156.84 157.85 35.68 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-N 120.06 1.3 . . . . 0.0 110.809 -168.863 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 15.2 mtp180 -144.15 145.3 32.02 Favored 'General case' 0 CA--C 1.512 -0.497 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 -170.736 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 8.4 p -132.89 151.53 52.02 Favored 'General case' 0 CA--C 1.515 -0.384 0 O-C-N 124.244 0.965 . . . . 0.0 110.733 169.969 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.448 -0.526 0 C-N-CA 123.92 0.888 . . . . 0.0 112.322 -173.202 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.2 pt? . . . . . 0 N--CA 1.446 -0.627 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -130.42 174.52 12.71 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.003 0 N-CA-C 106.574 -1.639 . . . . 0.0 106.574 -175.813 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -132.59 71.27 1.47 Allowed 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 122.163 0.982 . . . . 0.0 110.653 175.974 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 64.7 t -131.37 136.37 57.65 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 114.357 -1.292 . . . . 0.0 109.032 167.193 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 60.0 pttt -45.95 113.64 0.65 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 126.156 1.782 . . . . 0.0 112.618 179.681 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.415 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -74.09 136.67 43.02 Favored 'General case' 0 CA--C 1.516 -0.351 0 C-N-CA 120.103 -0.639 . . . . 0.0 109.859 170.123 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 7.2 t80 -100.73 -8.18 23.03 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 161.066 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 174.08 165.12 0.2 Allowed 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 126.941 2.096 . . . . 0.0 106.461 -175.668 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.6 m -62.33 -36.26 81.66 Favored 'General case' 0 C--O 1.226 -0.182 0 C-N-CA 122.73 0.412 . . . . 0.0 111.961 170.43 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.5 p -59.09 -37.75 77.89 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 122.131 -0.356 . . . . 0.0 110.652 -179.529 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -42.58 -55.3 3.57 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.165 0.986 . . . . 0.0 110.63 170.99 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 25.5 m -56.56 -31.11 63.88 Favored 'General case' 0 N--CA 1.444 -0.763 0 C-N-CA 127.174 2.19 . . . . 0.0 109.678 -173.88 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 34.2 m0 -65.74 -63.47 1.08 Allowed 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 -179.214 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -51.62 -36.37 45.58 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-O 118.691 -0.671 . . . . 0.0 111.031 173.565 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.74 -57.58 10.46 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 119.632 1.106 . . . . 0.0 110.863 -178.611 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -59.04 -35.31 73.1 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-O 121.37 0.605 . . . . 0.0 110.55 178.497 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.461 ' CG ' ' HA3' ' A' ' 25' ' ' GLY . 8.1 mtmt -62.55 -45.46 92.84 Favored 'General case' 0 N--CA 1.441 -0.909 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 178.621 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -54.91 -52.39 63.05 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 122.957 0.503 . . . . 0.0 111.231 176.585 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -67.38 -65.32 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 118.47 0.577 . . . . 0.0 112.093 178.713 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 62.2 p -105.25 -50.02 3.33 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 122.546 0.338 . . . . 0.0 110.703 -170.635 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 126.46 -10.36 7.24 Favored Glycine 0 CA--C 1.532 1.126 0 CA-C-N 115.464 -0.789 . . . . 0.0 112.224 -161.713 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.5 m -78.66 57.49 2.05 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 118.674 1.237 . . . . 0.0 112.347 -165.772 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.461 ' HA3' ' CG ' ' A' ' 19' ' ' LYS . . . -74.2 30.55 0.97 Allowed Glycine 0 CA--C 1.533 1.199 0 N-CA-C 117.093 1.597 . . . . 0.0 117.093 -154.075 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -122.79 123.76 41.78 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 119.57 1.685 . . . . 0.0 108.069 -172.373 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -179.11 -170.86 41.59 Favored Glycine 0 CA--C 1.526 0.757 0 CA-C-N 118.921 0.782 . . . . 0.0 112.743 -175.101 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -147.49 159.47 43.69 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 125.526 1.53 . . . . 0.0 108.337 166.494 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 34' ' ' CYS . 0.1 OUTLIER -88.37 141.18 28.75 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.775 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 11.3 tp60 -102.58 99.54 9.55 Favored 'General case' 0 N--CA 1.445 -0.713 0 N-CA-C 105.595 -2.002 . . . . 0.0 105.595 171.373 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 69.4 -77.62 0.05 Allowed 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 119.182 0.901 . . . . 0.0 112.32 166.318 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -153.95 39.11 0.47 Allowed 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 128.458 2.703 . . . . 0.0 110.933 168.449 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -136.86 -177.77 4.89 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 104.219 -2.511 . . . . 0.0 104.219 166.539 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.1 m -151.1 153.7 35.55 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 119.861 1.209 . . . . 0.0 110.639 -167.53 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 75.9 mtp180 -144.67 110.85 5.5 Favored 'General case' 0 CA--C 1.507 -0.693 0 C-N-CA 123.666 0.787 . . . . 0.0 109.475 -163.74 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 4.6 m -91.15 -154.99 0.38 Allowed 'General case' 0 N--CA 1.441 -0.875 0 CA-C-N 114.685 -1.143 . . . . 0.0 110.484 -178.839 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.451 -0.409 0 C-N-CA 124.857 1.263 . . . . 0.0 109.481 -175.915 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.6 pt? . . . . . 0 N--CA 1.45 -0.438 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.411 HD11 HG12 ' A' ' 6' ' ' VAL . 0.7 OUTLIER -145.48 157.77 13.01 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.619 0 N-CA-C 105.978 -1.86 . . . . 0.0 105.978 -157.842 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -118.35 33.17 5.76 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 123.139 0.576 . . . . 0.0 110.759 -169.997 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.411 HG12 HD11 ' A' ' 4' ' ' ILE . 1.4 p -77.99 127.36 38.55 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.175 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 170.349 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 53.3 pttt -43.84 101.83 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.31 1.444 . . . . 0.0 111.287 171.364 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.454 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.1 OUTLIER -68.8 133.47 48.36 Favored 'General case' 0 CA--C 1.517 -0.306 0 C-N-CA 119.414 -0.914 . . . . 0.0 110.32 177.492 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -98.05 -8.14 28.39 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.416 158.274 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 176.24 166.24 0.43 Allowed 'General case' 0 C--O 1.225 -0.202 0 C-N-CA 126.137 1.775 . . . . 0.0 107.15 -177.273 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.8 m -61.58 -35.35 77.58 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 118.334 0.515 . . . . 0.0 112.041 172.852 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.8 p -58.79 -32.56 69.44 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 121.666 -0.646 . . . . 0.0 111.61 -179.004 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -44.26 -52.71 7.28 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 124.092 0.957 . . . . 0.0 111.136 169.257 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 8.9 m -67.04 -30.69 70.84 Favored 'General case' 0 N--CA 1.44 -0.962 0 C-N-CA 127.677 2.391 . . . . 0.0 108.514 -172.554 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 34.2 m0 -64.95 -65.55 0.66 Allowed 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 106.0 -1.852 . . . . 0.0 106.0 176.921 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 4.0 p -54.22 -31.32 52.84 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 123.006 0.522 . . . . 0.0 111.755 179.022 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.48 -55.03 20.1 Favored 'General case' 0 N--CA 1.457 -0.092 0 CA-C-N 119.394 0.997 . . . . 0.0 110.432 175.606 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -60.96 -31.8 71.35 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-O 120.952 0.406 . . . . 0.0 110.086 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.437 ' CG ' ' HA3' ' A' ' 25' ' ' GLY . 22.9 mtpp -65.79 -53.45 40.17 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-O 121.377 0.608 . . . . 0.0 110.967 174.795 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? -54.15 -38.77 65.86 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.385 179.006 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 78.8 t -77.7 -66.72 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.425 -1.689 0 C-N-CA 124.027 0.931 . . . . 0.0 109.622 176.627 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 29.3 p -95.36 -50.8 4.86 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 123.157 0.583 . . . . 0.0 111.557 -169.733 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 122.31 -28.28 5.84 Favored Glycine 0 CA--C 1.531 1.047 0 C-N-CA 125.264 1.412 . . . . 0.0 110.783 -166.947 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -89.28 80.22 6.91 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.895 1.278 . . . . 0.0 109.184 -165.976 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.437 ' HA3' ' CG ' ' A' ' 19' ' ' LYS . . . -76.14 40.22 1.46 Allowed Glycine 0 CA--C 1.532 1.151 0 N-CA-C 117.175 1.63 . . . . 0.0 117.175 -156.534 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 61.2 mt-30 -115.5 116.68 28.6 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 120.104 1.952 . . . . 0.0 110.814 -171.066 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -170.19 -169.88 33.87 Favored Glycine 0 C--N 1.339 0.709 0 N-CA-C 111.453 -0.659 . . . . 0.0 111.453 -178.765 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 45.2 mtpt -150.97 156.46 41.2 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 124.722 1.209 . . . . 0.0 108.732 169.888 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' CYS . . . . . 0.454 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -88.83 162.91 15.92 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 178.345 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 -141.77 125.99 17.47 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 106.858 -1.534 . . . . 0.0 106.858 168.178 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 7.2 m120 66.03 -78.13 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.943 0.897 . . . . 0.0 111.589 169.211 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -165.26 44.43 0.08 Allowed 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 129.782 3.233 . . . . 0.0 109.64 168.655 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 93.8 mt-30 -134.4 179.98 5.94 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 127.611 2.364 . . . . 0.0 105.23 168.874 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.449 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.4 m -153.57 157.61 39.98 Favored 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 -177.704 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 8.1 mtt180 -146.12 128.6 15.98 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 118.022 -0.989 . . . . 0.0 109.502 -170.549 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -103.45 167.71 9.63 Favored 'General case' 0 C--N 1.343 0.306 0 CA-C-O 121.885 0.85 . . . . 0.0 112.209 171.545 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.451 -0.377 0 C-N-CA 126.076 1.75 . . . . 0.0 111.107 -176.948 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.3 pt? . . . . . 0 N--CA 1.447 -0.587 0 N-CA-C 109.211 -0.662 . . . . 0.0 109.211 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -138.89 166.17 22.85 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.186 0 N-CA-C 106.794 -1.558 . . . . 0.0 106.794 -163.714 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 46.9 t0 -127.42 81.8 2.04 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 122.047 0.927 . . . . 0.0 109.055 166.072 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 93.3 t -122.13 133.89 67.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 N-CA-C 106.2 -1.778 . . . . 0.0 106.2 156.595 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -62.1 108.58 1.09 Allowed 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 124.514 1.126 . . . . 0.0 111.464 -174.082 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.491 ' HB3' ' HB2' ' A' ' 29' ' ' CYS . 11.4 p -63.54 128.24 34.93 Favored 'General case' 0 CA--C 1.516 -0.354 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.711 176.637 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -71.83 -38.14 70.22 Favored 'General case' 0 N--CA 1.45 -0.446 0 O-C-N 124.421 1.076 . . . . 0.0 108.108 153.499 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -169.17 160.31 9.62 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.666 1.187 . . . . 0.0 108.386 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.531 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 21.8 m -47.06 -40.52 15.14 Favored 'General case' 0 C--O 1.226 -0.16 0 C-N-CA 124.383 1.073 . . . . 0.0 112.378 173.401 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.08 -23.6 65.59 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-O 119.096 -0.478 . . . . 0.0 112.112 -177.809 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -69.9 -48.14 59.78 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 119.235 0.925 . . . . 0.0 109.674 174.414 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 21.3 m -47.84 -28.16 2.46 Favored 'General case' 0 CA--C 1.511 -0.522 0 C-N-CA 125.937 1.695 . . . . 0.0 110.596 -179.372 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 37.1 m0 -64.81 -65.85 0.62 Allowed 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 177.547 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -51.4 -31.95 24.48 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-O 117.918 -1.039 . . . . 0.0 111.464 172.173 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.42 -63.31 1.27 Allowed 'General case' 0 C--N 1.342 0.245 0 CA-C-N 121.018 1.735 . . . . 0.0 111.265 176.47 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -57.68 -30.94 65.86 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 121.906 0.86 . . . . 0.0 110.848 -178.5 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.7 mtmm -66.49 -49.45 66.56 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 173.875 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 67.4 mttt -51.98 -53.26 43.62 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.25 1.02 . . . . 0.0 109.95 177.434 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -63.04 -40.88 90.72 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 179.287 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -151.6 -49.15 0.11 Allowed 'General case' 0 N--CA 1.447 -0.613 0 O-C-N 121.419 -0.8 . . . . 0.0 111.768 -164.82 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 144.52 -15.14 2.04 Favored Glycine 0 CA--C 1.53 0.979 0 C-N-CA 120.721 -0.752 . . . . 0.0 114.154 -178.114 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 9.3 m -79.79 59.12 3.02 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 124.059 0.943 . . . . 0.0 111.682 -163.802 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -70.87 12.01 2.3 Favored Glycine 0 CA--C 1.532 1.152 0 N-CA-C 116.339 1.295 . . . . 0.0 116.339 -157.428 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -105.22 108.06 19.37 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 119.16 1.48 . . . . 0.0 107.042 -172.83 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -167.03 -170.37 31.82 Favored Glycine 0 C--N 1.336 0.575 0 N-CA-C 111.966 -0.454 . . . . 0.0 111.966 -168.39 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 78.2 mttt -156.22 154.91 31.51 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 124.922 1.289 . . . . 0.0 108.631 177.978 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' CYS . . . . . 0.531 ' HB3' ' HA ' ' A' ' 11' ' ' SER . 0.5 OUTLIER -91.35 160.09 15.66 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 176.419 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -140.81 120.9 13.74 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 106.231 -1.766 . . . . 0.0 106.231 176.334 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 70.84 -84.96 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 118.25 0.477 . . . . 0.0 110.078 168.901 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -162.34 56.36 0.23 Allowed 'General case' 0 N--CA 1.462 0.131 0 C-N-CA 129.175 2.99 . . . . 0.0 104.793 162.079 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 5.6 mp0 -143.09 -178.96 6.1 Favored 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 128.882 2.873 . . . . 0.0 103.796 170.017 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.419 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.2 m -157.39 158.5 36.02 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 119.595 1.089 . . . . 0.0 109.998 -169.674 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 58.1 mtt-85 -144.81 153.32 41.51 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 124.555 1.142 . . . . 0.0 110.096 -176.109 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 8.7 p -139.07 163.33 32.7 Favored 'General case' 0 CA--C 1.521 -0.164 0 O-C-N 124.389 1.056 . . . . 0.0 111.088 170.609 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.533 0.294 0 C-N-CA 123.807 0.843 . . . . 0.0 112.194 -171.606 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.6 pt? . . . . . 0 N--CA 1.452 -0.361 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -145.26 158.74 13.36 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.338 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 -158.464 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -123.5 41.62 3.43 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 121.881 0.848 . . . . 0.0 111.516 -174.726 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 97.5 t -87.19 129.14 39.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 166.747 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 52.8 pttt -49.53 101.48 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 126.211 1.805 . . . . 0.0 113.363 179.292 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.479 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -66.47 127.07 30.89 Favored 'General case' 0 CA--C 1.515 -0.378 0 C-N-CA 123.0 0.52 . . . . 0.0 110.591 170.358 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 87.2 m-85 -96.94 -12.43 23.41 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 125.198 1.561 . . . . 0.0 109.979 153.734 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -177.15 153.42 0.97 Allowed 'General case' 0 C--N 1.343 0.318 0 C-N-CA 124.483 1.113 . . . . 0.0 109.212 -177.582 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.444 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 1.9 p -54.52 -41.22 69.4 Favored 'General case' 0 N--CA 1.457 -0.12 0 C-N-CA 125.31 1.444 . . . . 0.0 111.199 171.513 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.5 p -59.3 -25.08 63.84 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -178.486 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -60.0 -57.38 13.11 Favored 'General case' 0 C--O 1.223 -0.312 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 173.63 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 11.7 m -48.56 -31.4 6.48 Favored 'General case' 0 CA--C 1.508 -0.646 0 C-N-CA 129.008 2.923 . . . . 0.0 109.964 -175.446 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 33.8 m0 -62.58 -63.82 1.11 Allowed 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 175.807 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -48.11 -39.77 21.45 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 123.263 0.625 . . . . 0.0 111.922 173.487 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.29 -56.72 18.14 Favored 'General case' 0 C--N 1.328 -0.327 0 O-C-N 121.681 -0.637 . . . . 0.0 110.546 178.553 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -59.75 -35.56 74.84 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.595 0.712 . . . . 0.0 110.549 179.076 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 4.3 mtmp? -64.5 -44.63 90.31 Favored 'General case' 0 N--CA 1.439 -1.011 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.438 177.838 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.43 -54.43 32.28 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 124.226 1.011 . . . . 0.0 109.785 178.791 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -67.58 -62.95 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.325 0 N-CA-C 112.087 0.402 . . . . 0.0 112.087 178.226 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 70.7 p -103.6 -49.51 3.66 Favored 'General case' 0 CA--C 1.522 -0.099 0 C-N-CA 122.779 0.431 . . . . 0.0 110.806 -167.199 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 118.65 -18.1 10.89 Favored Glycine 0 CA--C 1.532 1.1 0 CA-C-N 115.151 -0.932 . . . . 0.0 111.401 -163.692 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 24.5 m -79.56 67.31 5.28 Favored 'General case' 0 C--O 1.227 -0.123 0 C-N-CA 124.467 1.107 . . . . 0.0 110.285 -169.348 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -72.44 40.67 0.76 Allowed Glycine 0 CA--C 1.539 1.584 0 N-CA-C 117.036 1.574 . . . . 0.0 117.036 -160.207 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 63.1 mt-30 -117.09 120.53 38.6 Favored 'General case' 0 C--O 1.224 -0.282 0 C-N-CA 125.739 1.616 . . . . 0.0 108.942 -172.381 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -175.2 -168.39 35.67 Favored Glycine 0 C--N 1.335 0.524 0 CA-C-N 119.622 1.101 . . . . 0.0 111.508 -178.021 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 81.4 mttt -153.77 160.83 42.41 Favored 'General case' 0 CA--C 1.522 -0.101 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 165.414 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' CYS . . . . . 0.479 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -89.18 165.57 14.38 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 177.051 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -141.32 141.58 33.87 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 106.264 -1.754 . . . . 0.0 106.264 165.323 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 18.9 t30 61.68 -93.43 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 118.591 0.632 . . . . 0.0 111.07 167.546 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.0 m120 -153.35 55.37 0.75 Allowed 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 127.632 2.373 . . . . 0.0 106.224 162.167 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 17.1 mp0 -148.12 176.82 9.9 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 129.966 3.306 . . . . 0.0 104.442 -176.991 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.461 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.4 m -156.81 155.1 30.96 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 119.54 1.064 . . . . 0.0 110.126 -171.914 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 -142.2 134.84 28.24 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 123.847 0.859 . . . . 0.0 109.248 -170.264 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 49.0 t -111.32 158.05 19.47 Favored 'General case' 0 C--N 1.341 0.228 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 -174.914 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 16.8 m-30 . . . . . 0 N--CA 1.454 -0.258 0 C-N-CA 125.481 1.512 . . . . 0.0 109.64 -175.302 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.4 pt? . . . . . 0 N--CA 1.451 -0.402 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -137.1 162.6 33.75 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.15 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 -167.128 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -90.56 -16.91 27.9 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 124.501 1.12 . . . . 0.0 112.621 -172.122 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 58.3 t -75.19 134.57 29.07 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 CA-C-N 118.795 0.725 . . . . 0.0 111.757 -157.294 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.2 tmtt? -37.7 106.31 0.05 OUTLIER 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 127.578 2.351 . . . . 0.0 112.104 173.04 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.499 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -75.28 135.22 40.95 Favored 'General case' 0 CA--C 1.515 -0.388 0 C-N-CA 120.332 -0.547 . . . . 0.0 109.915 168.907 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -95.12 -16.37 22.66 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 158.512 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 178.51 166.43 0.83 Allowed 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 106.099 -1.815 . . . . 0.0 106.099 -172.726 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.9 p -61.31 -39.37 90.22 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 124.06 0.944 . . . . 0.0 111.48 172.733 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.6 p -56.77 -40.94 76.78 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 122.773 0.429 . . . . 0.0 111.046 -177.495 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -40.66 -56.87 2.02 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.634 1.174 . . . . 0.0 111.078 170.546 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 23.7 m -57.95 -28.37 64.25 Favored 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 128.026 2.53 . . . . 0.0 109.73 -173.311 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 33.2 m0 -64.65 -66.15 0.58 Allowed 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 107.186 -1.413 . . . . 0.0 107.186 177.534 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -51.67 -33.14 32.54 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 118.085 -0.959 . . . . 0.0 111.696 174.409 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.82 -54.38 36.01 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 120.107 1.321 . . . . 0.0 110.709 175.916 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 5.1 t -58.12 -37.16 74.06 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.071 0.463 . . . . 0.0 110.46 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.42 ' CG ' ' HA3' ' A' ' 25' ' ' GLY . 40.3 mtmt -63.5 -58.71 6.15 Favored 'General case' 0 N--CA 1.44 -0.943 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.706 177.079 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 64.3 mmtt -49.53 -47.11 49.13 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.303 1.041 . . . . 0.0 111.835 178.076 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 44.0 t -70.87 -60.02 2.86 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.77 0 C-N-CA 123.962 0.905 . . . . 0.0 109.15 -178.102 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.2 m -118.58 -41.54 2.81 Favored 'General case' 0 N--CA 1.439 -1.004 0 C-N-CA 123.591 0.756 . . . . 0.0 110.987 -161.103 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 120.83 -21.42 8.41 Favored Glycine 0 CA--C 1.533 1.215 0 C-N-CA 124.908 1.242 . . . . 0.0 112.372 -177.737 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 21.5 m -88.17 61.08 6.09 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 124.709 1.204 . . . . 0.0 110.322 -160.628 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.42 ' HA3' ' CG ' ' A' ' 19' ' ' LYS . . . -64.13 23.39 0.09 OUTLIER Glycine 0 CA--C 1.54 1.623 0 N-CA-C 120.414 2.926 . . . . 0.0 120.414 -152.614 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -108.38 118.2 36.16 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 121.129 2.465 . . . . 0.0 109.903 -176.3 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -163.99 -170.49 28.98 Favored Glycine 0 CA--C 1.528 0.875 0 N-CA-C 112.157 -0.377 . . . . 0.0 112.157 -174.559 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -156.38 156.08 33.26 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 125.159 1.384 . . . . 0.0 107.879 174.073 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' CYS . . . . . 0.499 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 0.0 OUTLIER -92.14 160.57 15.13 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 178.485 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.8 tp-100 -133.62 126.69 31.41 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 105.896 -1.89 . . . . 0.0 105.896 165.659 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.2 t30 69.04 -78.91 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 164.79 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -166.63 44.86 0.06 Allowed 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 130.411 3.484 . . . . 0.0 108.894 170.388 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -147.61 179.35 7.75 Favored 'General case' 0 N--CA 1.442 -0.825 0 C-N-CA 128.875 2.87 . . . . 0.0 104.167 177.453 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.432 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 5.0 m -153.94 164.75 37.9 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 119.894 1.224 . . . . 0.0 110.399 -169.422 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 73.4 mtp180 -140.0 152.93 46.68 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 125.651 1.58 . . . . 0.0 108.976 -178.685 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 36.8 t -132.59 162.63 30.8 Favored 'General case' 0 C--O 1.224 -0.26 0 O-C-N 124.652 1.22 . . . . 0.0 109.34 178.791 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.534 0.355 0 CA-C-N 118.651 0.66 . . . . 0.0 111.365 -177.294 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.457 -0.097 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -140.42 160.67 25.02 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.373 0 N-CA-C 104.932 -2.247 . . . . 0.0 104.932 -171.487 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -123.33 41.88 3.36 Favored 'General case' 0 C--N 1.332 -0.19 0 C-N-CA 123.077 0.551 . . . . 0.0 110.677 -171.734 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 95.9 t -96.45 135.97 28.83 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 170.358 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.67 106.7 0.27 Allowed 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.815 1.246 . . . . 0.0 112.372 -177.748 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.432 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -65.19 127.29 31.08 Favored 'General case' 0 CA--C 1.515 -0.367 0 C-N-CA 122.587 0.355 . . . . 0.0 110.259 168.005 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -85.21 -19.19 32.06 Favored 'General case' 0 CA--C 1.538 0.519 0 O-C-N 124.403 1.064 . . . . 0.0 109.237 155.309 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -175.39 171.51 2.85 Favored 'General case' 0 C--O 1.221 -0.406 0 C-N-CA 125.486 1.515 . . . . 0.0 108.11 -179.243 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.44 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 20.0 m -62.86 -37.94 88.86 Favored 'General case' 0 N--CA 1.464 0.254 0 O-C-N 121.72 -0.612 . . . . 0.0 111.934 170.688 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.2 p -57.99 -34.36 69.9 Favored 'General case' 0 N--CA 1.452 -0.361 0 O-C-N 121.768 -0.582 . . . . 0.0 110.999 -178.138 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -40.24 -54.69 2.31 Favored 'General case' 0 C--O 1.225 -0.225 0 C-N-CA 124.42 1.088 . . . . 0.0 111.567 167.939 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 19.1 m -64.93 -30.06 71.03 Favored 'General case' 0 N--CA 1.44 -0.949 0 C-N-CA 127.394 2.278 . . . . 0.0 108.438 -171.019 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 28.9 m0 -64.9 -65.72 0.64 Allowed 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 106.178 -1.786 . . . . 0.0 106.178 176.916 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -51.46 -33.6 31.73 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 118.604 -0.712 . . . . 0.0 112.149 176.75 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.48 -54.88 25.57 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 119.902 1.228 . . . . 0.0 110.259 177.376 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -60.29 -34.1 73.29 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 120.794 0.33 . . . . 0.0 110.343 179.835 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 39.1 mtmt -65.16 -53.9 37.85 Favored 'General case' 0 N--CA 1.439 -0.999 0 C-N-CA 122.483 0.313 . . . . 0.0 110.839 176.267 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -48.32 -49.49 33.89 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 123.569 0.748 . . . . 0.0 110.71 176.786 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 65.3 t -73.15 -56.07 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.697 0 C-N-CA 124.289 1.036 . . . . 0.0 110.299 -175.477 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 11.9 t -138.91 18.85 2.65 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 113.588 0.959 . . . . 0.0 113.588 -162.517 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.09 -27.53 0.54 Allowed Glycine 0 CA--C 1.542 1.74 0 O-C-N 120.566 -1.334 . . . . 0.0 115.132 176.763 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 10.1 t -84.72 73.52 10.58 Favored 'General case' 0 C--O 1.226 -0.171 0 O-C-N 121.488 -1.007 . . . . 0.0 109.539 -162.986 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -72.04 35.77 0.63 Allowed Glycine 0 CA--C 1.536 1.398 0 N-CA-C 117.013 1.565 . . . . 0.0 117.013 -162.439 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -111.56 109.74 19.81 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 119.952 1.876 . . . . 0.0 109.454 -173.724 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -161.8 -169.19 24.78 Favored Glycine 0 CA--C 1.527 0.784 0 CA-C-N 118.736 0.698 . . . . 0.0 113.565 -173.558 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 19.2 ttmm -165.98 142.59 5.2 Favored 'General case' 0 CA--C 1.519 -0.246 0 C-N-CA 125.192 1.397 . . . . 0.0 107.748 -178.724 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' CYS . . . . . 0.451 ' HA ' ' HA ' ' A' ' 34' ' ' CYS . 0.1 OUTLIER -86.08 149.04 25.42 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 109.217 -0.661 . . . . 0.0 109.217 -177.901 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 21.1 tp60 -116.22 111.3 19.98 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 105.056 -2.202 . . . . 0.0 105.056 174.555 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 63.32 -92.37 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 119.598 1.09 . . . . 0.0 109.731 172.002 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 21.8 m120 -147.68 55.18 1.07 Allowed 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 126.02 1.728 . . . . 0.0 107.891 165.193 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.4 mp0 -141.55 175.76 9.42 Favored 'General case' 0 N--CA 1.445 -0.715 0 C-N-CA 130.752 3.621 . . . . 0.0 103.177 171.944 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.451 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 0.8 OUTLIER -147.9 155.82 42.01 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-N 120.725 1.602 . . . . 0.0 110.759 -171.46 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 63.0 mtp180 -139.51 151.88 46.49 Favored 'General case' 0 CA--C 1.509 -0.619 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 -171.141 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 47.5 t -143.37 141.45 30.92 Favored 'General case' 0 C--N 1.332 -0.179 0 O-C-N 124.543 1.152 . . . . 0.0 110.817 -172.181 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 72.9 t80 . . . . . 0 N--CA 1.453 -0.298 0 C-N-CA 126.021 1.728 . . . . 0.0 109.834 -170.343 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.6 pt? . . . . . 0 CA--C 1.522 -0.104 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.47 HD11 HG12 ' A' ' 6' ' ' VAL . 0.9 OUTLIER -139.39 162.05 27.34 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.184 0 C-N-CA 126.085 1.754 . . . . 0.0 106.702 -166.332 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -88.42 -15.82 34.47 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 124.03 0.932 . . . . 0.0 113.216 -169.965 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.47 HG12 HD11 ' A' ' 4' ' ' ILE . 0.8 OUTLIER -67.46 139.46 20.89 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 C-N-CA 119.369 -0.932 . . . . 0.0 112.31 -156.318 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 34.3 mttt -65.55 95.63 0.23 Allowed 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.758 1.223 . . . . 0.0 111.645 -174.093 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.496 ' HB3' ' HB2' ' A' ' 29' ' ' CYS . 1.4 p -67.09 133.21 49.41 Favored 'General case' 0 CA--C 1.517 -0.31 0 O-C-N 123.109 0.255 . . . . 0.0 111.12 176.953 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 52.8 m-85 -85.47 -27.79 25.45 Favored 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 124.047 0.842 . . . . 0.0 109.295 150.856 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -169.79 160.71 8.8 Favored 'General case' 0 C--O 1.223 -0.333 0 C-N-CA 123.813 0.845 . . . . 0.0 109.833 -179.756 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.439 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 66.8 m -46.56 -38.28 9.21 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 114.161 1.171 . . . . 0.0 114.161 175.069 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.8 p -58.02 -27.73 63.81 Favored 'General case' 0 N--CA 1.449 -0.475 0 O-C-N 121.634 -0.666 . . . . 0.0 112.161 -179.769 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -54.49 -47.05 73.5 Favored 'General case' 0 C--O 1.219 -0.503 0 C-N-CA 124.333 1.053 . . . . 0.0 111.345 170.561 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.412 ' SG ' ' CA ' ' A' ' 29' ' ' CYS . 6.3 m -67.47 -33.16 74.56 Favored 'General case' 0 CA--C 1.498 -1.027 0 C-N-CA 125.922 1.689 . . . . 0.0 107.614 -175.987 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 33.4 m0 -64.55 -65.79 0.63 Allowed 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 106.53 -1.656 . . . . 0.0 106.53 177.951 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 21.4 p -55.87 -29.76 60.43 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 118.583 -0.723 . . . . 0.0 111.999 -179.523 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.25 -54.76 18.0 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 119.298 0.953 . . . . 0.0 111.27 175.598 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.8 t -60.0 -36.92 78.23 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-O 121.55 0.691 . . . . 0.0 110.089 179.814 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 75.0 mttt -60.82 -54.39 45.69 Favored 'General case' 0 N--CA 1.436 -1.141 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.938 174.135 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -43.98 -53.89 5.85 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 124.198 0.999 . . . . 0.0 111.001 177.948 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 91.7 t -77.32 -60.43 2.31 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.836 0 C-N-CA 124.543 1.137 . . . . 0.0 109.775 -173.237 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 30.8 p -103.52 -42.13 5.77 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 122.788 0.435 . . . . 0.0 111.95 -167.76 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 110.29 -16.5 29.63 Favored Glycine 0 CA--C 1.536 1.365 0 C-N-CA 124.567 1.08 . . . . 0.0 111.234 -165.534 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 3.5 m -82.75 65.33 7.82 Favored 'General case' 0 C--O 1.224 -0.252 0 C-N-CA 124.276 1.03 . . . . 0.0 110.339 -165.558 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -74.27 34.86 0.94 Allowed Glycine 0 CA--C 1.538 1.508 0 N-CA-C 117.856 1.902 . . . . 0.0 117.856 -155.132 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 57.4 mt-30 -113.65 124.83 53.24 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 119.891 1.845 . . . . 0.0 109.428 -177.05 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -170.73 -168.21 32.17 Favored Glycine 0 CA--C 1.523 0.559 0 CA-C-N 119.161 0.891 . . . . 0.0 112.529 -175.944 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -159.81 142.03 13.33 Favored 'General case' 0 CA--C 1.52 -0.207 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 175.718 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' CYS . . . . . 0.496 ' HB2' ' HB3' ' A' ' 8' ' ' CYS . 0.5 OUTLIER -86.54 157.52 19.73 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 108.188 -1.041 . . . . 0.0 108.188 -179.514 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 15.5 tt0 -136.67 123.93 21.86 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 105.383 -2.08 . . . . 0.0 105.383 176.86 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 22.2 t30 68.5 -92.75 0.03 OUTLIER 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 118.805 0.73 . . . . 0.0 109.795 167.244 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 24.3 m120 -154.46 57.05 0.7 Allowed 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 127.561 2.344 . . . . 0.0 105.691 160.486 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.7 mp0 -144.69 175.44 10.16 Favored 'General case' 0 N--CA 1.445 -0.68 0 C-N-CA 130.356 3.463 . . . . 0.0 103.097 175.954 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.2 m -149.91 161.85 41.48 Favored 'General case' 0 CA--C 1.504 -0.792 0 O-C-N 120.636 -1.29 . . . . 0.0 110.629 -173.819 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 49.6 mtp180 -139.63 150.72 45.29 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 -175.292 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 49.3 t -137.48 146.98 44.9 Favored 'General case' 0 N--CA 1.463 0.218 0 O-C-N 124.4 1.062 . . . . 0.0 110.398 -173.034 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 87.3 t80 . . . . . 0 N--CA 1.452 -0.328 0 C-N-CA 126.617 1.967 . . . . 0.0 109.344 -171.346 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.1 pt? . . . . . 0 N--CA 1.448 -0.54 0 N-CA-C 105.738 -1.949 . . . . 0.0 105.738 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -132.31 -176.45 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 N-CA-C 107.745 -1.205 . . . . 0.0 107.745 -175.226 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -137.39 84.92 2.09 Favored 'General case' 0 N--CA 1.457 -0.097 0 CA-C-O 121.89 0.852 . . . . 0.0 110.928 163.821 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 94.6 t -128.35 136.43 60.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 N-CA-C 105.382 -2.081 . . . . 0.0 105.382 156.313 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -70.42 115.74 9.95 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 123.765 0.826 . . . . 0.0 110.932 -168.381 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.493 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -68.69 125.38 26.37 Favored 'General case' 0 CA--C 1.514 -0.419 0 C-N-CA 122.661 0.385 . . . . 0.0 110.304 177.114 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -77.66 -27.13 50.82 Favored 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 124.61 1.194 . . . . 0.0 109.588 151.118 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -179.7 153.91 0.57 Allowed 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 124.417 1.087 . . . . 0.0 108.796 -172.847 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 36.7 m -49.51 -38.85 32.01 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 124.027 0.931 . . . . 0.0 113.04 173.911 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.3 p -62.12 -20.36 63.98 Favored 'General case' 0 N--CA 1.445 -0.71 0 C-N-CA 122.775 0.43 . . . . 0.0 112.127 -178.383 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.07 -50.74 18.3 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-N 118.509 0.595 . . . . 0.0 109.622 176.09 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 17.7 m -46.35 -28.65 1.39 Allowed 'General case' 0 CA--C 1.51 -0.575 0 C-N-CA 126.91 2.084 . . . . 0.0 110.52 -179.496 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 29.6 m0 -60.56 -71.43 0.14 Allowed 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 114.524 -1.217 . . . . 0.0 108.107 172.509 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -50.14 -31.04 12.5 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 124.109 0.964 . . . . 0.0 112.284 175.066 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.06 -54.77 32.81 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 120.273 1.397 . . . . 0.0 110.887 173.167 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 2.5 t -58.22 -35.72 72.09 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.863 0.84 . . . . 0.0 110.286 179.781 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 33.4 mtpt -63.22 -50.61 69.57 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.313 175.245 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -48.43 -55.41 10.96 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.91 0.884 . . . . 0.0 110.644 177.528 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -66.16 -61.35 1.73 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 179.05 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 81.9 p -107.78 -46.6 3.76 Favored 'General case' 0 C--N 1.338 0.107 0 CA-C-O 120.877 0.37 . . . . 0.0 111.16 -166.789 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 117.3 -16.94 12.71 Favored Glycine 0 CA--C 1.531 1.074 0 CA-C-N 115.295 -0.866 . . . . 0.0 111.303 -164.94 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 43.3 t -78.35 62.42 3.0 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 125.327 1.451 . . . . 0.0 110.683 -168.543 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -68.48 28.03 0.27 Allowed Glycine 0 CA--C 1.54 1.646 0 N-CA-C 118.369 2.108 . . . . 0.0 118.369 -157.642 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 58.2 mt-30 -113.06 108.07 16.82 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 120.584 2.192 . . . . 0.0 110.258 -173.473 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -157.44 -168.2 19.57 Favored Glycine 0 C--N 1.339 0.722 0 CA-C-O 119.872 -0.404 . . . . 0.0 112.599 -174.879 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -156.37 157.97 36.57 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 126.206 1.802 . . . . 0.0 107.718 170.872 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' CYS . . . . . 0.493 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -89.51 162.82 15.5 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 108.725 -0.842 . . . . 0.0 108.725 178.108 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 20.4 tt0 -139.24 121.16 15.54 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 106.733 -1.58 . . . . 0.0 106.733 168.294 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 72.27 -88.22 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 123.051 0.54 . . . . 0.0 109.884 170.508 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.7 m120 -159.06 52.81 0.39 Allowed 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 128.55 2.74 . . . . 0.0 105.566 161.78 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 36.3 mt-30 -137.19 -175.19 3.97 Favored 'General case' 0 N--CA 1.444 -0.728 0 C-N-CA 128.933 2.893 . . . . 0.0 103.358 163.577 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.456 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.6 m -153.86 165.98 34.35 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 119.317 0.962 . . . . 0.0 110.321 -171.088 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 29.1 mtp180 -147.74 152.88 38.51 Favored 'General case' 0 CA--C 1.516 -0.357 0 C-N-CA 124.747 1.219 . . . . 0.0 108.326 -168.585 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 48.7 t -145.34 148.2 33.14 Favored 'General case' 0 C--N 1.328 -0.35 0 O-C-N 124.48 1.112 . . . . 0.0 109.491 -174.398 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.536 0.408 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -169.503 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.3 pt? . . . . . 0 N--CA 1.452 -0.351 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -143.09 159.06 17.8 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.25 0 N-CA-C 106.298 -1.741 . . . . 0.0 106.298 -169.244 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -100.95 8.89 42.84 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 -164.014 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 93.3 t -78.7 136.2 24.36 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 O-C-N 121.687 -0.633 . . . . 0.0 110.68 -170.705 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -61.9 95.41 0.06 Allowed 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 125.419 1.488 . . . . 0.0 111.198 -177.177 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.48 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -61.38 120.18 9.96 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.557 170.851 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -83.18 -20.59 34.37 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 124.983 1.427 . . . . 0.0 109.941 151.821 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -178.83 150.19 0.48 Allowed 'General case' 0 C--N 1.341 0.239 0 C-N-CA 124.432 1.093 . . . . 0.0 109.123 -175.187 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.417 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 57.9 m -47.81 -35.61 10.42 Favored 'General case' 0 C--N 1.333 -0.129 0 C-N-CA 124.787 1.235 . . . . 0.0 113.754 173.079 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.0 p -61.24 -28.56 69.25 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 179.643 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -55.13 -54.65 40.46 Favored 'General case' 0 C--O 1.226 -0.175 0 C-N-CA 123.204 0.602 . . . . 0.0 109.507 174.563 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 11.4 m -55.02 -31.46 61.07 Favored 'General case' 0 N--CA 1.443 -0.811 0 C-N-CA 128.684 2.794 . . . . 0.0 109.253 -174.273 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 39.0 m0 -63.46 -68.34 0.35 Allowed 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 178.474 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -51.07 -32.23 21.43 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 118.345 -0.836 . . . . 0.0 112.163 175.483 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.54 -52.77 63.09 Favored 'General case' 0 C--N 1.339 0.136 0 CA-C-N 120.174 1.352 . . . . 0.0 110.326 174.807 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.8 t -62.46 -35.06 78.12 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 121.247 0.546 . . . . 0.0 110.434 179.3 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 41.7 mtpt -61.94 -51.92 66.15 Favored 'General case' 0 N--CA 1.44 -0.949 0 CA-C-O 121.788 0.804 . . . . 0.0 109.666 176.803 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.6 tptm -56.69 -42.41 79.04 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.19 -0.913 . . . . 0.0 111.493 -179.214 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 37.5 t -70.52 -59.49 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.357 0 C-N-CA 124.059 0.944 . . . . 0.0 109.447 179.195 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.7 t -117.63 -46.48 2.66 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.855 0.862 . . . . 0.0 111.966 -166.366 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 125.72 -25.04 5.68 Favored Glycine 0 CA--C 1.53 0.972 0 N-CA-C 111.162 -0.775 . . . . 0.0 111.162 -175.818 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 31.2 t -78.76 73.54 5.31 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 125.413 1.485 . . . . 0.0 108.821 -172.867 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -70.91 39.91 0.54 Allowed Glycine 0 CA--C 1.54 1.619 0 N-CA-C 116.294 1.278 . . . . 0.0 116.294 -168.451 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 64.2 mt-30 -114.79 115.75 27.52 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 126.217 1.807 . . . . 0.0 108.353 -174.911 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -170.93 -162.87 24.01 Favored Glycine 0 C--N 1.333 0.366 0 CA-C-N 119.524 1.056 . . . . 0.0 111.257 -176.74 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 4.6 pttp -167.06 164.81 15.91 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 165.319 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' CYS . . . . . 0.48 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -87.39 172.11 10.07 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 119.999 -0.68 . . . . 0.0 110.153 -176.653 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -145.31 121.67 10.95 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 105.098 -2.186 . . . . 0.0 105.098 172.53 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 64.5 t30 68.86 -93.4 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 119.372 0.987 . . . . 0.0 110.23 169.723 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 26.1 m120 -153.8 52.03 0.69 Allowed 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 128.315 2.646 . . . . 0.0 106.002 161.532 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -139.17 177.58 7.8 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 131.07 3.748 . . . . 0.0 102.609 175.238 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.447 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.3 m -150.56 163.68 37.88 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-N 120.624 1.556 . . . . 0.0 111.647 -173.083 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 50.7 mtp180 -142.39 150.8 41.15 Favored 'General case' 0 CA--C 1.512 -0.518 0 C-N-CA 124.061 0.944 . . . . 0.0 109.686 -170.395 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 52.5 t -141.21 133.88 28.67 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 124.658 1.224 . . . . 0.0 112.694 -174.668 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 . . . . . 0 N--CA 1.451 -0.379 0 C-N-CA 126.573 1.949 . . . . 0.0 109.715 178.129 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.4 pt? . . . . . 0 N--CA 1.451 -0.402 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -137.07 162.57 33.87 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.18 0 N-CA-C 107.108 -1.441 . . . . 0.0 107.108 -167.095 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -90.56 -16.91 27.9 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 124.501 1.12 . . . . 0.0 112.621 -172.147 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 58.6 t -75.21 134.59 29.01 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 CA-C-N 118.795 0.725 . . . . 0.0 111.799 -157.321 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.2 tmtt? -37.7 106.31 0.05 OUTLIER 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 127.578 2.351 . . . . 0.0 112.104 173.067 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.499 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -75.28 135.22 40.95 Favored 'General case' 0 CA--C 1.515 -0.388 0 C-N-CA 120.332 -0.547 . . . . 0.0 109.915 168.907 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -95.12 -16.37 22.66 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 158.512 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 178.51 166.43 0.83 Allowed 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 106.099 -1.815 . . . . 0.0 106.099 -172.726 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.9 p -61.31 -39.33 90.09 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 124.06 0.944 . . . . 0.0 111.48 172.733 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.6 p -56.83 -40.96 76.99 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 122.86 0.464 . . . . 0.0 111.0 -177.455 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -40.66 -56.87 2.02 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.634 1.174 . . . . 0.0 111.078 170.546 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 23.7 m -57.95 -28.37 64.25 Favored 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 128.026 2.53 . . . . 0.0 109.73 -173.311 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 33.2 m0 -64.65 -66.15 0.58 Allowed 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 107.186 -1.413 . . . . 0.0 107.186 177.534 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -51.67 -33.14 32.54 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 118.085 -0.959 . . . . 0.0 111.696 174.409 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.85 -54.33 36.69 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 120.107 1.321 . . . . 0.0 110.742 175.903 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 5.1 t -58.12 -37.16 74.06 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.071 0.463 . . . . 0.0 110.46 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.419 ' CG ' ' HA3' ' A' ' 25' ' ' GLY . 40.3 mtmt -63.5 -58.71 6.15 Favored 'General case' 0 N--CA 1.44 -0.943 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.706 177.079 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 64.3 mmtt -49.55 -47.12 49.3 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.324 1.05 . . . . 0.0 111.772 178.11 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 43.7 t -70.87 -60.02 2.86 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.77 0 C-N-CA 123.962 0.905 . . . . 0.0 109.15 -178.08 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.2 m -118.58 -41.54 2.81 Favored 'General case' 0 N--CA 1.439 -1.004 0 C-N-CA 123.591 0.756 . . . . 0.0 110.987 -161.103 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 120.81 -21.36 8.44 Favored Glycine 0 CA--C 1.534 1.24 0 C-N-CA 124.925 1.25 . . . . 0.0 112.336 -177.778 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 21.5 m -88.22 61.12 6.09 Favored 'General case' 0 C--O 1.223 -0.297 0 C-N-CA 124.709 1.204 . . . . 0.0 110.331 -160.653 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.419 ' HA3' ' CG ' ' A' ' 19' ' ' LYS . . . -64.15 23.39 0.09 OUTLIER Glycine 0 CA--C 1.54 1.623 0 N-CA-C 120.414 2.926 . . . . 0.0 120.414 -152.626 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -108.38 118.2 36.16 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 121.129 2.465 . . . . 0.0 109.903 -176.3 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -164.04 -170.51 29.06 Favored Glycine 0 CA--C 1.528 0.876 0 N-CA-C 112.195 -0.362 . . . . 0.0 112.195 -174.589 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -156.34 156.08 33.33 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 125.138 1.375 . . . . 0.0 107.879 174.121 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' CYS . . . . . 0.499 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 0.0 OUTLIER -92.14 160.57 15.13 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 178.485 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.8 tp-100 -133.62 126.69 31.41 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 105.896 -1.89 . . . . 0.0 105.896 165.659 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.2 t30 69.04 -78.91 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 164.79 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -166.63 44.86 0.06 Allowed 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 130.411 3.484 . . . . 0.0 108.894 170.388 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -147.61 179.35 7.75 Favored 'General case' 0 N--CA 1.442 -0.825 0 C-N-CA 128.875 2.87 . . . . 0.0 104.167 177.453 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.432 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 5.0 m -153.94 164.75 37.9 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 119.894 1.224 . . . . 0.0 110.399 -169.422 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 73.4 mtp180 -140.0 152.93 46.68 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 125.651 1.58 . . . . 0.0 108.976 -178.685 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 36.8 t -132.59 162.63 30.8 Favored 'General case' 0 C--O 1.224 -0.26 0 O-C-N 124.652 1.22 . . . . 0.0 109.34 178.791 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.534 0.355 0 CA-C-N 118.651 0.66 . . . . 0.0 111.365 -177.294 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.456 -0.169 0 N-CA-C 111.992 0.367 . . . . 0.0 111.992 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -126.1 167.09 21.13 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.995 0 N-CA-C 105.843 -1.91 . . . . 0.0 105.843 176.973 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -127.72 57.04 1.54 Allowed 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 122.0 0.905 . . . . 0.0 109.892 -177.197 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 43.6 t -128.37 143.8 39.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 N-CA-C 108.231 -1.025 . . . . 0.0 108.231 167.187 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -55.37 132.77 48.94 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 125.19 1.396 . . . . 0.0 113.312 -174.351 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.459 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -86.2 139.1 31.36 Favored 'General case' 0 CA--C 1.516 -0.363 0 C-N-CA 123.12 0.568 . . . . 0.0 109.672 164.107 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -91.01 -20.65 21.87 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 124.171 0.92 . . . . 0.0 109.543 154.497 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -178.91 173.47 1.2 Allowed 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 126.972 2.109 . . . . 0.0 106.273 -172.902 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 31.3 m -64.15 -32.86 74.6 Favored 'General case' 0 N--CA 1.462 0.135 0 C-N-CA 123.668 0.787 . . . . 0.0 112.631 173.332 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -54.12 -54.62 37.0 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 122.134 0.969 . . . . 0.0 110.723 -172.885 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.5 mp0 -32.57 -57.64 0.34 Allowed 'General case' 0 N--CA 1.429 -1.514 0 C-N-CA 128.07 2.548 . . . . 0.0 114.285 168.577 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 14.5 m -54.17 -29.28 45.04 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 126.376 1.87 . . . . 0.0 109.679 -175.839 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 30.9 m0 -66.92 -66.54 0.54 Allowed 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 106.214 -1.772 . . . . 0.0 106.214 -179.694 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -50.36 -32.34 17.08 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 124.018 0.927 . . . . 0.0 111.392 174.815 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.85 -56.42 19.54 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 119.578 1.081 . . . . 0.0 109.732 175.056 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -60.15 -34.05 73.02 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-O 121.048 0.451 . . . . 0.0 111.057 179.478 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 32.6 mtpt -63.72 -54.58 33.2 Favored 'General case' 0 N--CA 1.442 -0.847 0 O-C-N 121.618 -0.676 . . . . 0.0 111.103 176.793 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -57.19 -39.27 75.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.521 178.904 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 31.8 t -73.32 -67.89 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.431 -1.4 0 C-N-CA 124.293 1.037 . . . . 0.0 109.218 179.745 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -107.29 -40.23 5.45 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 122.956 0.502 . . . . 0.0 112.063 -170.481 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 117.61 -15.97 12.64 Favored Glycine 0 CA--C 1.532 1.152 0 C-N-CA 124.608 1.099 . . . . 0.0 110.822 -166.975 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 30.4 t -82.22 64.82 7.07 Favored 'General case' 0 CA--C 1.527 0.094 0 C-N-CA 124.353 1.061 . . . . 0.0 110.092 -166.568 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -70.97 38.38 0.52 Allowed Glycine 0 CA--C 1.535 1.339 0 N-CA-C 117.916 1.926 . . . . 0.0 117.916 -160.06 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 -121.04 114.07 20.96 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 120.071 1.936 . . . . 0.0 108.58 -179.189 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -158.22 -177.69 31.55 Favored Glycine 0 CA--C 1.523 0.534 0 N-CA-C 111.52 -0.632 . . . . 0.0 111.52 -175.498 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -153.35 145.29 23.62 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 106.922 -1.51 . . . . 0.0 106.922 177.637 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' CYS . . . . . 0.459 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -88.51 165.88 14.57 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 178.663 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -138.77 118.33 12.98 Favored 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 105.656 -1.979 . . . . 0.0 105.656 171.749 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 63.46 -89.32 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.455 0.702 . . . . 0.0 110.556 172.549 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.2 m120 -153.25 53.65 0.75 Allowed 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 127.001 2.121 . . . . 0.0 107.07 168.142 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -143.62 166.17 25.58 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 103.036 -2.949 . . . . 0.0 103.036 173.038 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.427 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.2 m -143.12 158.31 43.73 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 120.853 1.66 . . . . 0.0 110.257 -174.436 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 33.5 mtp180 -142.82 154.12 43.87 Favored 'General case' 0 CA--C 1.514 -0.433 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 -172.024 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 41.8 t -133.4 140.71 47.49 Favored 'General case' 0 C--N 1.328 -0.331 0 O-C-N 124.16 0.913 . . . . 0.0 110.15 -172.504 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 82.8 t80 . . . . . 0 N--CA 1.455 -0.222 0 C-N-CA 125.568 1.547 . . . . 0.0 109.81 -163.258 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.535 ' HA ' ' HG3' ' A' ' 35' ' ' ARG . 2.5 pt? . . . . . 0 N--CA 1.453 -0.294 0 N-CA-C 114.926 1.454 . . . . 0.0 114.926 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -138.98 154.2 25.7 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.495 0 N-CA-C 104.348 -2.464 . . . . 0.0 104.348 -165.559 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -122.89 35.16 4.94 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 119.635 1.107 . . . . 0.0 111.089 -171.252 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.3 p -77.43 136.98 23.22 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-N 116.141 -0.481 . . . . 0.0 109.774 172.979 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 37.5 mtpt -66.16 96.01 0.31 Allowed 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.453 1.101 . . . . 0.0 112.221 -175.985 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.526 ' HB3' ' HB2' ' A' ' 29' ' ' CYS . 1.9 p -61.95 131.42 49.64 Favored 'General case' 0 CA--C 1.519 -0.213 0 O-C-N 123.789 0.681 . . . . 0.0 110.847 176.571 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 81.8 m-85 -88.36 -26.64 22.09 Favored 'General case' 0 N--CA 1.444 -0.771 0 C-N-CA 125.627 1.571 . . . . 0.0 108.749 155.194 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -165.87 160.27 16.73 Favored 'General case' 0 C--N 1.344 0.364 0 C-N-CA 123.548 0.739 . . . . 0.0 109.815 179.622 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.513 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 1.9 p -58.26 -41.24 83.81 Favored 'General case' 0 C--N 1.333 -0.118 0 C-N-CA 123.924 0.889 . . . . 0.0 111.404 173.713 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.39 -24.98 63.89 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 122.81 0.444 . . . . 0.0 111.672 -178.332 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 45.1 tt0 -61.85 -44.56 96.58 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 121.708 -0.62 . . . . 0.0 111.204 172.428 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 29.0 m -59.6 -27.91 66.71 Favored 'General case' 0 N--CA 1.439 -0.993 0 C-N-CA 125.687 1.595 . . . . 0.0 108.871 -177.079 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 36.5 m0 -65.98 -67.5 0.44 Allowed 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 107.444 -1.317 . . . . 0.0 107.444 178.91 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -53.26 -28.32 27.03 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.921 0.889 . . . . 0.0 111.57 175.019 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.02 -55.65 17.71 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 119.549 1.068 . . . . 0.0 110.23 174.87 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.2 t -61.08 -32.82 72.47 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 110.439 -0.208 . . . . 0.0 110.439 -179.434 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.6 mtmp? -63.41 -61.39 2.38 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-O 121.156 0.503 . . . . 0.0 110.853 174.782 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 17.1 pttm -59.52 -31.31 69.27 Favored 'General case' 0 N--CA 1.44 -0.964 0 N-CA-C 112.403 0.52 . . . . 0.0 112.403 -174.874 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 53.9 t -79.42 -57.57 5.03 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.514 0 C-N-CA 124.281 1.032 . . . . 0.0 109.865 176.309 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 13.2 t -140.64 25.34 2.19 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 113.753 1.02 . . . . 0.0 113.753 -162.844 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.35 -24.19 0.27 Allowed Glycine 0 CA--C 1.537 1.465 0 O-C-N 120.902 -1.123 . . . . 0.0 115.247 177.219 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 47.4 m -87.92 64.98 8.12 Favored 'General case' 0 C--O 1.223 -0.324 0 O-C-N 121.122 -1.223 . . . . 0.0 110.603 -155.803 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -66.79 23.49 0.18 Allowed Glycine 0 CA--C 1.538 1.513 0 N-CA-C 119.589 2.596 . . . . 0.0 119.589 -154.966 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -111.7 121.91 46.39 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 120.736 2.268 . . . . 0.0 109.709 -175.078 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -170.82 -166.08 29.15 Favored Glycine 0 C--N 1.337 0.613 0 CA-C-N 118.742 0.701 . . . . 0.0 111.832 -177.675 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.63 155.54 21.94 Favored 'General case' 0 CA--C 1.52 -0.177 0 C-N-CA 124.8 1.24 . . . . 0.0 108.586 174.51 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' CYS . . . . . 0.526 ' HB2' ' HB3' ' A' ' 8' ' ' CYS . 0.2 OUTLIER -91.37 166.15 13.04 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 -178.594 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -148.79 121.64 8.73 Favored 'General case' 0 C--O 1.22 -0.483 0 N-CA-C 105.345 -2.095 . . . . 0.0 105.345 -179.197 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 57.65 -94.94 0.05 Allowed 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.913 1.233 . . . . 0.0 109.717 178.733 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 21.0 m120 -147.22 61.47 1.17 Allowed 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 126.509 1.924 . . . . 0.0 106.926 165.348 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 21.4 mp0 -147.09 173.64 12.3 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 129.5 3.12 . . . . 0.0 105.062 177.547 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.468 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.7 m -150.52 157.08 42.59 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 -176.683 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.535 ' HG3' ' HA ' ' A' ' 3' ' ' LEU . 0.0 OUTLIER -148.06 143.26 27.07 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 124.213 1.005 . . . . 0.0 109.036 -174.053 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 40.7 t -131.45 148.25 52.63 Favored 'General case' 0 C--N 1.338 0.09 0 O-C-N 123.853 0.72 . . . . 0.0 110.47 -164.385 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 87.7 t80 . . . . . 0 N--CA 1.455 -0.218 0 C-N-CA 125.901 1.68 . . . . 0.0 109.722 -168.276 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.533 ' HA ' ' HG3' ' A' ' 35' ' ' ARG . 2.5 pt? . . . . . 0 N--CA 1.454 -0.275 0 N-CA-C 115.184 1.55 . . . . 0.0 115.184 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -136.17 159.2 38.78 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.66 0 N-CA-C 103.984 -2.598 . . . . 0.0 103.984 -170.589 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -137.27 47.53 2.1 Favored 'General case' 0 C--N 1.328 -0.354 0 O-C-N 120.901 -1.124 . . . . 0.0 109.234 -173.085 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 87.7 t -97.6 139.35 20.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 171.534 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.72 105.91 0.18 Allowed 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -175.22 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.526 ' HB3' ' HB2' ' A' ' 29' ' ' CYS . 1.2 p -67.64 133.84 50.08 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 169.437 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -78.86 -33.33 45.95 Favored 'General case' 0 N--CA 1.454 -0.236 0 O-C-N 124.335 1.022 . . . . 0.0 109.003 151.613 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -172.76 156.86 3.59 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 124.213 1.005 . . . . 0.0 108.374 -175.33 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.472 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 58.8 m -46.94 -45.88 21.03 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 124.488 1.115 . . . . 0.0 112.617 175.523 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.3 m -63.83 -11.7 29.61 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 -177.464 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.9 -48.41 31.03 Favored 'General case' 0 C--O 1.215 -0.74 0 CA-C-N 119.29 0.95 . . . . 0.0 109.271 168.427 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 18.4 m -48.71 -29.91 4.97 Favored 'General case' 0 CA--C 1.513 -0.473 0 C-N-CA 125.944 1.698 . . . . 0.0 110.1 -178.606 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 42.2 m0 -62.31 -68.09 0.36 Allowed 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 107.01 -1.478 . . . . 0.0 107.01 175.925 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -52.89 -28.51 23.54 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 117.789 -1.101 . . . . 0.0 112.444 173.931 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.3 -53.46 52.49 Favored 'General case' 0 C--O 1.228 -0.065 0 CA-C-N 121.306 1.866 . . . . 0.0 109.903 174.7 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -61.95 -34.14 75.56 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.122 178.535 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 40.8 mtmt -65.31 -52.15 55.93 Favored 'General case' 0 N--CA 1.445 -0.695 0 O-C-N 121.835 -0.541 . . . . 0.0 111.502 176.904 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 65.6 mttt -49.76 -45.95 50.05 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.243 1.417 . . . . 0.0 109.938 177.995 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 95.1 t -76.79 -69.84 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.424 -1.732 0 C-N-CA 124.252 1.021 . . . . 0.0 109.887 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 47.0 p -98.31 -49.04 4.83 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 122.457 0.303 . . . . 0.0 111.445 -169.975 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 123.35 -17.52 7.91 Favored Glycine 0 CA--C 1.533 1.207 0 C-N-CA 124.961 1.267 . . . . 0.0 111.193 -163.434 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 5.0 m -81.9 64.66 6.69 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 124.483 1.113 . . . . 0.0 110.612 -165.387 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -71.77 38.93 0.63 Allowed Glycine 0 CA--C 1.539 1.539 0 N-CA-C 118.26 2.064 . . . . 0.0 118.26 -155.998 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -123.27 133.03 54.21 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 120.312 2.056 . . . . 0.0 109.171 -175.605 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 179.01 -164.31 32.51 Favored Glycine 0 CA--C 1.524 0.647 0 CA-C-N 119.24 0.927 . . . . 0.0 111.181 -177.375 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.75 158.07 32.9 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 123.946 0.898 . . . . 0.0 109.108 166.806 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' CYS . . . . . 0.526 ' HB2' ' HB3' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -91.98 165.32 13.27 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 -178.95 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 -146.42 115.8 7.09 Favored 'General case' 0 N--CA 1.444 -0.761 0 N-CA-C 105.644 -1.984 . . . . 0.0 105.644 179.184 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 71.48 -83.3 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 118.743 0.701 . . . . 0.0 110.325 170.059 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 36.3 m120 -162.35 55.58 0.23 Allowed 'General case' 0 N--CA 1.463 0.181 0 C-N-CA 130.026 3.33 . . . . 0.0 104.639 164.102 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -143.93 174.44 10.84 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 129.278 3.031 . . . . 0.0 103.431 177.009 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.448 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.2 m -154.41 158.67 40.37 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-N 120.525 1.511 . . . . 0.0 108.952 -173.456 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.533 ' HG3' ' HA ' ' A' ' 3' ' ' LEU . 0.0 OUTLIER -147.56 140.58 25.03 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 123.594 0.758 . . . . 0.0 109.684 -173.519 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 41.1 t -122.58 148.55 45.09 Favored 'General case' 0 C--N 1.34 0.195 0 C-N-CA 123.816 0.846 . . . . 0.0 110.49 -168.283 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 90.9 t80 . . . . . 0 N--CA 1.452 -0.359 0 C-N-CA 126.101 1.76 . . . . 0.0 109.846 -173.747 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.442 ' HA ' ' HG2' ' A' ' 35' ' ' ARG . 2.4 pt? . . . . . 0 N--CA 1.448 -0.537 0 N-CA-C 110.49 -0.189 . . . . 0.0 110.49 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -145.05 160.21 13.67 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.219 0 N-CA-C 106.403 -1.702 . . . . 0.0 106.403 -163.131 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -120.42 32.58 5.95 Favored 'General case' 0 C--N 1.332 -0.159 0 C-N-CA 123.542 0.737 . . . . 0.0 110.737 -173.378 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 97.0 t -82.88 133.87 28.15 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 N-CA-C 108.115 -1.069 . . . . 0.0 108.115 171.681 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.1 mtpp -65.26 94.24 0.16 Allowed 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 125.701 1.6 . . . . 0.0 112.057 -173.606 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.498 ' HB3' ' HB2' ' A' ' 29' ' ' CYS . 1.7 p -58.44 136.02 57.38 Favored 'General case' 0 N--CA 1.464 0.238 0 O-C-N 123.436 0.46 . . . . 0.0 110.616 173.517 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 82.0 m-85 -91.09 -27.25 18.7 Favored 'General case' 0 N--CA 1.445 -0.697 0 C-N-CA 126.592 1.957 . . . . 0.0 108.306 152.666 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -158.68 162.05 37.17 Favored 'General case' 0 C--N 1.344 0.329 0 CA-C-N 118.605 0.639 . . . . 0.0 110.834 179.087 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.502 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 1.8 p -61.88 -45.07 95.36 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 124.875 1.27 . . . . 0.0 111.234 173.003 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.9 p -55.04 -32.25 61.72 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 121.178 0.513 . . . . 0.0 111.092 -178.147 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 48.7 tt0 -51.98 -48.78 64.23 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 123.607 0.763 . . . . 0.0 111.937 172.493 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 32.9 m -56.62 -30.42 63.25 Favored 'General case' 0 N--CA 1.444 -0.774 0 C-N-CA 126.606 1.962 . . . . 0.0 109.006 -177.985 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 32.2 m0 -64.56 -64.08 0.97 Allowed 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 107.494 -1.299 . . . . 0.0 107.494 179.832 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -51.6 -35.41 41.39 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 118.385 -0.817 . . . . 0.0 111.463 173.563 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.66 -56.15 18.0 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 119.872 1.214 . . . . 0.0 110.559 -179.038 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -57.71 -36.55 72.14 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.37 0.605 . . . . 0.0 110.472 179.32 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.452 ' CG ' ' HA3' ' A' ' 25' ' ' GLY . 1.7 mtmp? -62.8 -50.74 69.8 Favored 'General case' 0 N--CA 1.435 -1.202 0 CA-C-N 115.589 -0.732 . . . . 0.0 112.442 177.507 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 65.9 mmtt -50.22 -52.99 31.29 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 123.66 0.784 . . . . 0.0 111.024 178.272 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -67.93 -63.95 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 CA-C-N 118.177 0.444 . . . . 0.0 111.651 177.537 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.9 m -116.92 -37.79 3.54 Favored 'General case' 0 N--CA 1.442 -0.838 0 C-N-CA 123.581 0.753 . . . . 0.0 110.465 -155.652 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 116.94 -14.83 13.92 Favored Glycine 0 CA--C 1.531 1.055 0 C-N-CA 123.196 0.427 . . . . 0.0 113.183 -178.757 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.7 t -82.04 67.29 7.98 Favored 'General case' 0 N--CA 1.465 0.313 0 O-C-N 121.601 -0.94 . . . . 0.0 109.621 -166.663 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.452 ' HA3' ' CG ' ' A' ' 19' ' ' LYS . . . -74.08 37.08 0.93 Allowed Glycine 0 CA--C 1.537 1.457 0 N-CA-C 116.964 1.546 . . . . 0.0 116.964 -159.407 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -122.65 126.71 48.16 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 125.814 1.645 . . . . 0.0 107.522 -175.481 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -179.37 -172.43 43.54 Favored Glycine 0 CA--C 1.525 0.663 0 CA-C-N 119.246 0.93 . . . . 0.0 111.922 -176.091 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.28 157.13 42.73 Favored 'General case' 0 C--O 1.232 0.135 0 C-N-CA 125.62 1.568 . . . . 0.0 107.457 166.878 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 29' ' ' CYS . . . . . 0.502 ' HB3' ' HA ' ' A' ' 11' ' ' SER . 0.5 OUTLIER -89.74 151.63 21.73 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 178.474 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 54.7 tp60 -124.09 112.88 17.65 Favored 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 105.923 -1.88 . . . . 0.0 105.923 177.85 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 62.95 -89.77 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 119.256 0.934 . . . . 0.0 110.099 174.567 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -150.28 56.22 0.94 Allowed 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 126.713 2.005 . . . . 0.0 107.916 164.128 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -135.55 179.75 6.14 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 129.313 3.045 . . . . 0.0 103.953 166.047 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.455 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.2 m -150.43 147.44 27.55 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-N 119.457 1.026 . . . . 0.0 109.319 -178.265 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.442 ' HG2' ' HA ' ' A' ' 3' ' ' LEU . 41.7 mtt180 -140.18 136.59 33.61 Favored 'General case' 0 CA--C 1.513 -0.464 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 -173.407 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.8 t -126.16 167.46 15.38 Favored 'General case' 0 C--O 1.225 -0.187 0 O-C-N 124.577 1.173 . . . . 0.0 110.103 -162.929 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 28.6 t80 . . . . . 0 N--CA 1.452 -0.333 0 C-N-CA 124.394 1.078 . . . . 0.0 109.429 166.65 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.1 pt? . . . . . 0 CA--C 1.519 -0.219 0 N-CA-C 112.759 0.652 . . . . 0.0 112.759 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -132.15 171.13 18.57 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.208 0 N-CA-C 106.17 -1.789 . . . . 0.0 106.17 -170.382 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -133.42 83.44 2.05 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-O 122.26 1.028 . . . . 0.0 110.249 168.451 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 93.5 t -125.78 138.67 53.74 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 CA-C-N 113.956 -1.474 . . . . 0.0 107.374 160.819 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -68.58 106.25 2.52 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 124.495 1.118 . . . . 0.0 111.32 -169.34 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.522 ' HB3' ' HB2' ' A' ' 29' ' ' CYS . 5.8 p -66.67 130.44 43.18 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 120.784 0.326 . . . . 0.0 110.965 174.301 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -78.95 -36.21 41.99 Favored 'General case' 0 N--CA 1.442 -0.832 0 C-N-CA 125.351 1.46 . . . . 0.0 108.124 148.069 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -161.47 154.71 21.17 Favored 'General case' 0 C--O 1.222 -0.359 0 CA-C-N 118.44 0.563 . . . . 0.0 112.008 -177.451 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.507 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 27.9 m -50.75 -41.08 56.19 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 123.862 0.865 . . . . 0.0 112.583 173.606 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.31 -20.08 57.82 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 123.058 0.543 . . . . 0.0 112.292 -179.0 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 70.7 tt0 -72.03 -44.03 64.03 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 124.083 0.953 . . . . 0.0 110.79 176.05 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 20.8 m -55.16 -29.48 57.87 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 126.635 1.974 . . . . 0.0 108.874 179.21 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 36.1 m0 -64.83 -68.42 0.36 Allowed 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 179.288 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -54.71 -26.51 34.21 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 123.909 0.884 . . . . 0.0 111.557 175.938 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.14 -55.5 18.33 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 119.943 1.247 . . . . 0.0 109.806 174.003 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 3.8 t -55.16 -38.68 68.59 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.974 0.892 . . . . 0.0 110.278 178.579 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.9 mtmt -63.23 -53.6 50.5 Favored 'General case' 0 N--CA 1.434 -1.235 0 CA-C-N 115.159 -0.928 . . . . 0.0 110.519 177.133 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -52.98 -40.96 64.13 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 116.924 -1.512 . . . . 0.0 113.119 -179.007 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -67.98 -60.74 2.18 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 CA-C-N 119.314 0.961 . . . . 0.0 111.318 169.665 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 47.5 p -113.54 -65.96 1.13 Allowed 'General case' 0 N--CA 1.458 -0.065 0 CA-C-O 121.306 0.575 . . . . 0.0 110.45 -168.168 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 148.17 -23.05 1.41 Allowed Glycine 0 CA--C 1.529 0.963 0 CA-C-N 115.137 -0.938 . . . . 0.0 113.171 -170.757 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.2 p -82.44 72.36 9.51 Favored 'General case' 0 C--N 1.333 -0.139 0 O-C-N 121.553 -0.969 . . . . 0.0 109.666 -168.875 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -70.51 50.91 0.83 Allowed Glycine 0 CA--C 1.537 1.452 0 N-CA-C 117.034 1.574 . . . . 0.0 117.034 -163.057 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 54.9 mt-30 -131.53 101.9 5.7 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 125.421 1.488 . . . . 0.0 109.788 -165.188 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -161.82 -165.85 19.49 Favored Glycine 0 CA--C 1.525 0.681 0 CA-C-N 118.242 0.474 . . . . 0.0 113.467 -170.798 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 20.6 ttmm -162.98 144.91 10.14 Favored 'General case' 0 C--O 1.232 0.164 0 N-CA-C 107.403 -1.332 . . . . 0.0 107.403 178.853 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 29' ' ' CYS . . . . . 0.522 ' HB2' ' HB3' ' A' ' 8' ' ' CYS . 0.5 OUTLIER -87.64 162.19 17.27 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 -179.54 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.4 tp-100 -143.27 132.71 23.47 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 106.929 -1.508 . . . . 0.0 106.929 171.221 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 64.08 -91.26 0.03 OUTLIER 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 123.214 0.606 . . . . 0.0 109.975 170.065 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 23.2 m120 -155.42 62.92 0.61 Allowed 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 127.608 2.363 . . . . 0.0 105.781 158.234 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 17.2 mp0 -147.69 179.46 7.68 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 130.951 3.701 . . . . 0.0 103.983 174.267 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.444 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.5 m -152.84 161.17 42.89 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 121.11 -0.994 . . . . 0.0 109.572 -174.598 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.8 mtt85 -138.05 152.83 49.2 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 124.416 1.086 . . . . 0.0 109.26 179.406 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 53.5 t -136.45 137.72 40.72 Favored 'General case' 0 CA--C 1.522 -0.132 0 C-N-CA 124.317 1.047 . . . . 0.0 108.314 179.828 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.141 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 -153.933 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.8 pt? . . . . . 0 N--CA 1.453 -0.306 0 N-CA-C 106.592 -1.633 . . . . 0.0 106.592 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -139.41 159.21 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.176 0 N-CA-C 106.432 -1.692 . . . . 0.0 106.432 -174.212 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -92.89 -9.67 39.33 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.253 1.021 . . . . 0.0 112.244 -171.5 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 59.2 t -72.09 134.37 30.01 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 C-N-CA 119.953 -0.699 . . . . 0.0 110.55 -160.777 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -58.08 101.2 0.07 Allowed 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 125.568 1.547 . . . . 0.0 111.531 -174.385 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.464 ' HB3' ' HB2' ' A' ' 29' ' ' CYS . 0.5 OUTLIER -68.25 129.13 39.0 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 109.265 -0.642 . . . . 0.0 109.265 168.869 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -91.7 -16.8 26.41 Favored 'General case' 0 N--CA 1.454 -0.258 0 O-C-N 124.353 1.033 . . . . 0.0 109.316 150.437 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -169.7 148.15 3.59 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 123.701 0.801 . . . . 0.0 109.069 -178.698 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.517 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 27.1 m -47.37 -39.64 15.65 Favored 'General case' 0 N--CA 1.46 0.034 0 C-N-CA 124.551 1.14 . . . . 0.0 112.092 170.899 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.2 p -61.37 -22.93 65.41 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-O 118.889 -0.577 . . . . 0.0 112.25 -177.933 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.86 -47.88 56.9 Favored 'General case' 0 C--O 1.216 -0.678 0 CA-C-N 119.437 1.017 . . . . 0.0 109.283 174.372 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 27.5 m -47.9 -28.32 2.6 Favored 'General case' 0 CA--C 1.512 -0.513 0 C-N-CA 126.227 1.811 . . . . 0.0 110.441 -177.486 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 39.0 m0 -64.34 -67.79 0.4 Allowed 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.339 -1.3 . . . . 0.0 107.735 176.633 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -52.24 -27.95 16.81 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-O 118.164 -0.922 . . . . 0.0 111.725 172.878 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.07 -61.57 1.97 Allowed 'General case' 0 C--N 1.339 0.151 0 CA-C-N 121.035 1.743 . . . . 0.0 110.986 175.929 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -57.81 -30.41 65.68 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.249 0.547 . . . . 0.0 110.533 179.295 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.7 mtmt -67.89 -49.72 60.36 Favored 'General case' 0 N--CA 1.443 -0.79 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 172.742 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 51.6 mttt -50.21 -49.64 52.07 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 124.695 1.198 . . . . 0.0 109.789 178.771 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -67.45 -67.21 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 CA-C-N 118.146 0.43 . . . . 0.0 111.412 173.762 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 18.5 m -114.26 -49.46 2.84 Favored 'General case' 0 N--CA 1.438 -1.046 0 C-N-CA 123.255 0.622 . . . . 0.0 110.425 -158.045 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 133.16 -15.79 4.74 Favored Glycine 0 CA--C 1.533 1.189 0 C-N-CA 123.013 0.339 . . . . 0.0 112.829 -171.729 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.0 m -79.27 61.74 3.44 Favored 'General case' 0 C--O 1.225 -0.191 0 C-N-CA 124.393 1.077 . . . . 0.0 111.868 -164.624 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -70.67 1.6 21.16 Favored Glycine 0 CA--C 1.536 1.36 0 N-CA-C 116.159 1.223 . . . . 0.0 116.159 -158.71 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 60.0 mt-30 -90.66 110.81 21.98 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 119.846 1.823 . . . . 0.0 108.14 -176.631 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -164.44 -161.93 14.45 Favored Glycine 0 C--N 1.337 0.638 0 CA-C-N 118.741 0.701 . . . . 0.0 114.672 -170.879 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 6.9 mttp -169.29 150.58 4.35 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 123.935 0.894 . . . . 0.0 109.175 -175.179 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 29' ' ' CYS . . . . . 0.517 ' HB3' ' HA ' ' A' ' 11' ' ' SER . 0.1 OUTLIER -94.32 160.47 14.66 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.932 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.0 tt0 -134.6 131.69 38.14 Favored 'General case' 0 N--CA 1.444 -0.767 0 N-CA-C 105.296 -2.113 . . . . 0.0 105.296 165.974 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 21.1 t30 67.22 -90.81 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 118.713 0.688 . . . . 0.0 110.574 163.522 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 31.1 m120 -156.16 53.83 0.56 Allowed 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 127.968 2.507 . . . . 0.0 106.107 164.032 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 25.0 mp0 -151.05 176.9 10.7 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 129.391 3.076 . . . . 0.0 103.818 -179.802 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.6 m -160.41 167.84 26.46 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 120.21 1.368 . . . . 0.0 111.137 -165.47 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 33.6 mtp180 -146.58 160.83 41.66 Favored 'General case' 0 CA--C 1.518 -0.266 0 C-N-CA 125.054 1.342 . . . . 0.0 109.255 179.809 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 29.0 p -131.32 177.89 7.13 Favored 'General case' 0 CA--C 1.513 -0.445 0 O-C-N 124.507 1.129 . . . . 0.0 109.88 162.399 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 3.8 p90 . . . . . 0 N--CA 1.446 -0.633 0 C-N-CA 124.197 0.999 . . . . 0.0 111.879 -172.356 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.2 pt? . . . . . 0 N--CA 1.452 -0.371 0 CA-C-O 120.533 0.206 . . . . 0.0 110.582 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -143.61 158.92 16.74 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.205 0 N-CA-C 106.063 -1.828 . . . . 0.0 106.063 -160.551 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -120.39 30.22 7.06 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 121.745 0.783 . . . . 0.0 112.352 -174.226 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 52.4 t -85.79 134.42 27.26 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 171.787 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.6 mptt -69.82 107.29 3.46 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 125.443 1.497 . . . . 0.0 112.056 -165.181 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.501 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -63.3 126.16 26.51 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 123.896 0.878 . . . . 0.0 109.968 171.219 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -82.73 -21.55 34.72 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 124.873 1.358 . . . . 0.0 109.173 153.128 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -175.64 179.24 1.45 Allowed 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 126.174 1.79 . . . . 0.0 106.588 -176.156 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 39.7 m -70.98 -34.02 70.99 Favored 'General case' 0 N--CA 1.461 0.104 0 C-N-CA 125.497 1.519 . . . . 0.0 113.093 173.779 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -52.88 -56.3 16.84 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-O 122.065 0.936 . . . . 0.0 110.963 -172.36 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . 0.269 8.4 mp0 -20.97 -59.44 0.03 OUTLIER 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 128.93 2.892 . . . . 0.0 115.761 159.4 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 31.6 m -61.08 -27.29 68.25 Favored 'General case' 0 N--CA 1.442 -0.828 0 C-N-CA 125.706 1.602 . . . . 0.0 109.09 -172.295 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 35.9 m0 -69.7 -64.85 0.8 Allowed 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 -179.007 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -52.78 -30.79 34.96 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 124.049 0.939 . . . . 0.0 110.869 174.76 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.22 -57.98 8.71 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 119.385 0.993 . . . . 0.0 110.329 173.615 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -59.21 -32.21 69.73 Favored 'General case' 0 CA--C 1.521 -0.15 0 O-C-N 121.989 -0.444 . . . . 0.0 111.063 -179.461 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.465 ' CG ' ' HA3' ' A' ' 25' ' ' GLY . 30.6 mtmt -64.95 -57.09 9.65 Favored 'General case' 0 N--CA 1.437 -1.122 0 CA-C-O 120.797 0.332 . . . . 0.0 111.1 176.2 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.2 mtpt -56.46 -38.27 71.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.591 -179.858 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 40.6 t -70.03 -61.94 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.427 -1.615 0 C-N-CA 123.848 0.859 . . . . 0.0 109.172 176.948 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.2 m -120.6 -45.69 2.4 Favored 'General case' 0 N--CA 1.436 -1.137 0 C-N-CA 123.628 0.771 . . . . 0.0 111.16 -162.877 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 126.26 -20.05 6.3 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 124.636 1.112 . . . . 0.0 111.997 -173.376 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 31.0 t -84.23 65.58 8.89 Favored 'General case' 0 C--N 1.333 -0.145 0 C-N-CA 124.691 1.197 . . . . 0.0 109.636 -166.136 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.465 ' HA3' ' CG ' ' A' ' 19' ' ' LYS . . . -71.03 40.27 0.55 Allowed Glycine 0 CA--C 1.533 1.183 0 N-CA-C 117.539 1.776 . . . . 0.0 117.539 -160.084 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -129.19 123.95 33.34 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 120.093 1.947 . . . . 0.0 109.261 -175.186 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -177.05 -166.22 33.64 Favored Glycine 0 C--N 1.335 0.507 0 N-CA-C 110.109 -1.196 . . . . 0.0 110.109 -175.543 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 6.7 mtmp? -153.89 166.02 34.26 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 124.492 1.117 . . . . 0.0 108.074 164.435 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 29' ' ' CYS . . . . . 0.501 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -85.58 165.06 17.37 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 176.845 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -136.95 128.81 29.09 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 105.703 -1.962 . . . . 0.0 105.703 165.117 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 67.68 -89.9 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 123.238 0.615 . . . . 0.0 110.397 166.577 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 31.9 m120 -154.58 58.38 0.69 Allowed 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 127.314 2.246 . . . . 0.0 105.899 161.256 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 19.7 mp0 -151.15 176.45 11.17 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 129.288 3.035 . . . . 0.0 104.18 179.121 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.455 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.7 m -154.83 153.99 32.05 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-N 120.324 1.42 . . . . 0.0 110.73 -169.743 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 17.4 mtt180 -145.11 128.26 16.67 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 124.048 0.939 . . . . 0.0 110.204 -168.731 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -99.79 161.71 13.45 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 123.332 0.653 . . . . 0.0 111.453 178.039 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.454 -0.232 0 C-N-CA 123.811 0.844 . . . . 0.0 111.284 -171.272 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.3 pt? . . . . . 0 N--CA 1.447 -0.582 0 N-CA-C 106.439 -1.689 . . . . 0.0 106.439 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -131.73 -175.63 1.49 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.726 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 -165.742 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -141.58 83.81 1.88 Allowed 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 122.081 0.943 . . . . 0.0 110.86 161.07 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 80.5 t -130.14 134.57 62.51 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 N-CA-C 105.6 -2.0 . . . . 0.0 105.6 160.554 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.0 mptt -68.91 111.19 4.8 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 124.642 1.177 . . . . 0.0 110.263 -169.333 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.503 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -61.23 126.96 29.26 Favored 'General case' 0 CA--C 1.515 -0.376 0 C-N-CA 122.725 0.41 . . . . 0.0 110.191 175.518 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -89.67 -15.77 31.91 Favored 'General case' 0 N--CA 1.449 -0.488 0 O-C-N 125.003 1.439 . . . . 0.0 109.598 157.51 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 179.33 153.05 0.42 Allowed 'General case' 0 C--N 1.344 0.359 0 C-N-CA 125.485 1.514 . . . . 0.0 108.604 -177.146 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.523 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 24.4 m -54.95 -37.48 66.51 Favored 'General case' 0 N--CA 1.462 0.165 0 C-N-CA 123.056 0.542 . . . . 0.0 112.162 171.906 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.45 -23.18 64.22 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-O 119.427 -0.32 . . . . 0.0 111.765 179.076 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -67.46 -50.78 57.66 Favored 'General case' 0 C--O 1.217 -0.627 0 CA-C-N 118.655 0.661 . . . . 0.0 109.562 175.071 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 23.7 m -49.32 -27.31 3.79 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 126.108 1.763 . . . . 0.0 110.655 -177.108 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 31.2 m0 -63.36 -65.96 0.61 Allowed 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 114.821 -1.081 . . . . 0.0 108.192 173.271 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -52.95 -31.51 40.85 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-O 117.716 -1.135 . . . . 0.0 111.585 174.084 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.47 -55.46 27.43 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 121.686 2.039 . . . . 0.0 110.477 173.801 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 2.0 t -54.53 -37.46 65.41 Favored 'General case' 0 CA--C 1.527 0.087 0 C-N-CA 123.088 0.555 . . . . 0.0 109.858 178.259 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.7 mtpt -66.7 -54.24 25.16 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-O 121.351 0.596 . . . . 0.0 111.784 177.563 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 20.1 mtpp -53.75 -38.65 64.61 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 124.659 1.184 . . . . 0.0 110.25 -179.413 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 54.1 t -76.07 -61.63 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.426 -1.632 0 C-N-CA 124.734 1.214 . . . . 0.0 110.051 177.715 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 11.4 t -134.52 13.47 3.77 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 114.166 1.173 . . . . 0.0 114.166 -162.753 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 76.17 -26.19 1.53 Allowed Glycine 0 CA--C 1.537 1.424 0 O-C-N 120.317 -1.489 . . . . 0.0 114.259 178.658 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.4 m -81.17 62.8 5.26 Favored 'General case' 0 C--O 1.223 -0.333 0 C-N-CA 125.451 1.5 . . . . 0.0 111.511 -162.621 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -66.73 49.44 0.22 Allowed Glycine 0 CA--C 1.54 1.647 0 N-CA-C 119.023 2.369 . . . . 0.0 119.023 -156.807 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -130.92 118.71 21.08 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 120.477 2.139 . . . . 0.0 109.945 -173.419 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -172.98 -164.95 29.21 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 111.357 -0.697 . . . . 0.0 111.357 -177.378 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 58.4 mttt -160.56 161.13 32.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 124.882 1.273 . . . . 0.0 108.582 169.531 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 29' ' ' CYS . . . . . 0.523 ' HB3' ' HA ' ' A' ' 11' ' ' SER . 0.1 OUTLIER -92.18 162.34 14.36 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 -177.674 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.7 tp-100 -133.55 133.72 42.47 Favored 'General case' 0 N--CA 1.444 -0.733 0 N-CA-C 106.069 -1.826 . . . . 0.0 106.069 166.407 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 63.55 -87.63 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 117.971 0.35 . . . . 0.0 111.64 168.084 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -161.02 63.94 0.29 Allowed 'General case' 0 C--O 1.227 -0.118 0 C-N-CA 129.681 3.192 . . . . 0.0 104.169 165.259 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -161.64 174.58 13.11 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 129.279 3.032 . . . . 0.0 103.007 -177.759 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.415 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.7 m -153.65 160.61 42.44 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 121.199 1.818 . . . . 0.0 111.075 -169.112 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 63.8 mtp180 -139.43 151.12 45.99 Favored 'General case' 0 CA--C 1.511 -0.554 0 C-N-CA 125.351 1.461 . . . . 0.0 108.812 178.559 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -154.5 154.32 32.95 Favored 'General case' 0 C--N 1.333 -0.124 0 O-C-N 124.117 0.886 . . . . 0.0 112.562 -178.885 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.243 0 CA-C-O 120.962 0.41 . . . . 0.0 111.037 -174.171 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 18.8 m-85 . . . . . 0 N--CA 1.451 -0.387 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -76.37 126.28 8.11 Favored Glycine 0 N--CA 1.445 -0.766 0 N-CA-C 108.272 -1.931 . . . . 0.0 108.272 173.6 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -141.76 130.93 23.38 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 118.776 1.288 . . . . 0.0 109.659 164.81 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -136.14 167.38 24.68 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.171 0 N-CA-C 106.563 -1.644 . . . . 0.0 106.563 -164.342 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -129.68 88.38 2.67 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 122.193 0.997 . . . . 0.0 108.718 162.837 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 99.1 t -133.23 137.9 52.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 159.571 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.4 mptt -41.04 107.66 0.08 Allowed 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 127.217 2.207 . . . . 0.0 112.746 178.526 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.501 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -68.16 133.57 49.11 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 167.231 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -93.62 -15.07 25.74 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 158.154 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 176.25 155.91 0.23 Allowed 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 125.902 1.681 . . . . 0.0 107.832 -175.82 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 40.6 m -51.46 -39.62 57.83 Favored 'General case' 0 C--O 1.227 -0.12 0 C-N-CA 123.006 0.522 . . . . 0.0 111.724 171.843 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.9 p -62.8 -20.21 64.79 Favored 'General case' 0 N--CA 1.445 -0.716 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -178.439 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.25 -49.2 36.87 Favored 'General case' 0 C--O 1.218 -0.569 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 175.107 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 20.3 m -46.63 -29.64 1.94 Allowed 'General case' 0 CA--C 1.503 -0.853 0 C-N-CA 126.106 1.762 . . . . 0.0 110.138 178.534 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 31.5 m0 -63.59 -66.06 0.59 Allowed 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 176.517 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -51.37 -35.95 40.98 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 118.455 -0.783 . . . . 0.0 111.75 174.776 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.08 -57.05 11.92 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 120.243 1.383 . . . . 0.0 111.376 177.601 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 17.7 m -58.8 -33.78 70.75 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 122.232 1.015 . . . . 0.0 110.895 -179.531 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.5 mtmt -69.23 -42.78 75.22 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-N 115.178 -0.919 . . . . 0.0 113.143 175.655 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 41.7 mttm -54.28 -53.8 48.83 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.519 0.328 . . . . 0.0 110.359 174.317 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -62.78 -57.14 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 178.339 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 60.2 p -116.4 -57.24 2.22 Favored 'General case' 0 CA--C 1.522 -0.117 0 CA-C-O 121.185 0.517 . . . . 0.0 110.897 -169.136 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 130.29 -15.19 5.57 Favored Glycine 0 CA--C 1.532 1.136 0 CA-C-N 114.874 -1.057 . . . . 0.0 112.07 -161.325 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 58.0 p -79.11 63.28 3.73 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 118.659 1.229 . . . . 0.0 111.049 -171.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -69.0 2.3 8.8 Favored Glycine 0 CA--C 1.533 1.187 0 O-C-N 121.517 -0.739 . . . . 0.0 114.916 -164.556 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 30.8 mt-30 -85.93 105.52 16.46 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 119.158 1.479 . . . . 0.0 107.375 -177.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -158.45 -172.81 26.06 Favored Glycine 0 CA--C 1.524 0.645 0 CA-C-O 121.148 0.304 . . . . 0.0 112.908 -172.349 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 4.4 ttmm -159.84 143.34 14.24 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 125.398 1.479 . . . . 0.0 107.658 -174.55 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.501 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -89.39 151.43 22.05 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 177.41 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 56.7 tp60 -125.31 116.9 22.66 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 105.079 -2.193 . . . . 0.0 105.079 172.506 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 66.04 -82.37 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 118.911 0.778 . . . . 0.0 111.481 168.487 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -157.9 43.29 0.31 Allowed 'General case' 0 N--CA 1.444 -0.727 0 C-N-CA 128.423 2.689 . . . . 0.0 109.649 171.214 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 26.5 mp0 -141.65 178.42 7.48 Favored 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 128.006 2.522 . . . . 0.0 105.091 172.802 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.408 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 0.9 OUTLIER -159.27 152.47 22.31 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 119.185 0.902 . . . . 0.0 110.16 -164.444 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 8.8 mtt180 -146.29 132.87 19.81 Favored 'General case' 0 C--O 1.227 -0.09 0 CA-C-O 118.415 -0.802 . . . . 0.0 110.087 -167.354 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -102.91 164.17 11.78 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 123.712 0.805 . . . . 0.0 111.225 168.273 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 71.4 t80 . . . . . 0 N--CA 1.451 -0.392 0 C-N-CA 126.816 2.046 . . . . 0.0 109.384 177.98 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 . . . . . 0 N--CA 1.452 -0.327 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -59.81 117.1 10.17 Favored Glycine 0 N--CA 1.443 -0.84 0 N-CA-C 111.847 -0.501 . . . . 0.0 111.847 163.306 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -132.07 130.42 41.25 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 157.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -136.87 178.25 5.08 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.018 0 N-CA-C 107.429 -1.322 . . . . 0.0 107.429 -166.421 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 49.6 t0 -130.19 102.29 6.16 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 154.301 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -130.97 148.31 33.06 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 N-CA-C 105.995 -1.854 . . . . 0.0 105.995 148.79 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 42.7 mttm -64.57 115.46 5.21 Favored 'General case' 0 N--CA 1.444 -0.735 0 C-N-CA 123.828 0.851 . . . . 0.0 110.866 -170.043 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.548 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -73.22 119.55 17.62 Favored 'General case' 0 CA--C 1.511 -0.536 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 175.296 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -79.79 -22.88 42.57 Favored 'General case' 0 N--CA 1.449 -0.496 0 O-C-N 125.495 1.747 . . . . 0.0 109.078 156.067 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 178.97 154.17 0.41 Allowed 'General case' 0 C--N 1.344 0.344 0 C-N-CA 125.405 1.482 . . . . 0.0 108.751 -175.247 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.514 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 19.0 m -52.79 -38.71 61.52 Favored 'General case' 0 C--O 1.231 0.105 0 C-N-CA 123.321 0.649 . . . . 0.0 112.38 171.655 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.31 -22.28 64.75 Favored 'General case' 0 N--CA 1.445 -0.68 0 C-N-CA 122.721 0.408 . . . . 0.0 111.925 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.07 -51.11 34.51 Favored 'General case' 0 C--O 1.22 -0.489 0 CA-C-O 121.329 0.585 . . . . 0.0 109.506 176.063 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 20.8 m -47.6 -28.61 2.41 Favored 'General case' 0 CA--C 1.51 -0.579 0 C-N-CA 126.361 1.864 . . . . 0.0 110.444 -179.122 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 27.0 m0 -61.79 -68.55 0.31 Allowed 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 173.463 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -50.99 -32.47 21.25 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 117.945 -1.026 . . . . 0.0 112.308 174.852 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.01 -51.19 67.78 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 120.88 1.673 . . . . 0.0 110.831 173.715 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 2.0 t -60.79 -35.84 77.48 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 121.444 0.64 . . . . 0.0 109.813 178.646 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.3 mtpt -63.19 -50.61 69.66 Favored 'General case' 0 N--CA 1.44 -0.941 0 O-C-N 121.477 -0.765 . . . . 0.0 110.331 176.132 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 39.6 tptt -52.12 -45.3 64.87 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 124.452 1.101 . . . . 0.0 111.205 178.708 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 43.6 t -75.01 -63.14 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.428 -1.561 0 C-N-CA 124.646 1.178 . . . . 0.0 109.732 -178.328 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -110.3 -35.12 6.16 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.817 0.847 . . . . 0.0 112.421 -166.999 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 108.76 -23.21 24.49 Favored Glycine 0 CA--C 1.532 1.106 0 N-CA-C 110.6 -1.0 . . . . 0.0 110.6 -170.321 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 13.6 m -81.91 66.63 7.57 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 125.595 1.558 . . . . 0.0 110.046 -167.242 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -67.49 47.61 0.29 Allowed Glycine 0 CA--C 1.54 1.64 0 N-CA-C 117.98 1.952 . . . . 0.0 117.98 -160.6 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -132.38 98.61 4.43 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 119.951 1.875 . . . . 0.0 110.594 -163.606 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -159.17 -163.6 13.36 Favored Glycine 0 CA--C 1.525 0.702 0 CA-C-O 119.838 -0.423 . . . . 0.0 113.339 -172.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -158.65 160.17 36.2 Favored 'General case' 0 C--O 1.232 0.184 0 C-N-CA 126.997 2.119 . . . . 0.0 107.636 169.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.548 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -91.13 160.89 15.33 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 178.406 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -136.96 126.02 24.44 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 173.262 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 6.2 m120 64.43 -82.64 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.647 1.179 . . . . 0.0 110.616 174.53 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -163.63 43.89 0.11 Allowed 'General case' 0 N--CA 1.441 -0.899 0 C-N-CA 127.47 2.308 . . . . 0.0 106.155 172.093 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -139.79 -177.82 5.14 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 129.911 3.285 . . . . 0.0 103.84 175.278 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.442 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.5 m -150.11 160.41 43.68 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 120.328 1.422 . . . . 0.0 111.897 -171.57 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 51.3 mtp180 -144.94 147.96 33.3 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 124.139 0.975 . . . . 0.0 108.385 -172.29 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 48.0 t -133.95 159.71 39.9 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.45 -0.474 0 CA-C-N 118.464 0.574 . . . . 0.0 110.858 -173.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 25.1 p90 . . . . . 0 N--CA 1.452 -0.373 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -61.88 123.19 30.94 Favored Glycine 0 CA--C 1.522 0.511 0 CA-C-O 117.894 -1.504 . . . . 0.0 110.082 172.238 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -132.67 122.89 25.33 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 106.317 -1.735 . . . . 0.0 106.317 159.525 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.3 pt -145.35 151.47 15.04 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.48 0 N-CA-C 104.828 -2.286 . . . . 0.0 104.828 -152.024 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -108.65 86.91 2.37 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 170.382 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 19.6 m -121.16 135.84 60.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 114.052 -1.431 . . . . 0.0 108.249 157.569 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -73.03 95.44 2.01 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 124.082 0.953 . . . . 0.0 111.525 -167.62 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.489 ' HB3' ' HB2' ' A' ' 29' ' ' CYS . 1.6 p -64.92 131.04 45.6 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.706 -177.76 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -87.15 -25.72 23.95 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 124.26 0.975 . . . . 0.0 109.468 151.151 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -164.09 167.62 20.07 Favored 'General case' 0 C--O 1.223 -0.291 0 C-N-CA 123.748 0.819 . . . . 0.0 109.186 -178.383 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.445 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 1.7 p -59.13 -37.48 77.32 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 125.15 1.38 . . . . 0.0 112.179 174.877 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.5 p -56.25 -36.33 68.42 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 121.287 0.565 . . . . 0.0 111.581 -176.496 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -39.59 -53.37 2.13 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 125.37 1.468 . . . . 0.0 111.947 168.002 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.7 m -67.94 -31.07 70.56 Favored 'General case' 0 N--CA 1.439 -0.996 0 C-N-CA 127.76 2.424 . . . . 0.0 108.813 -173.365 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 33.3 m0 -65.1 -63.36 1.12 Allowed 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 106.227 -1.768 . . . . 0.0 106.227 176.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 1.3 p -53.69 -31.02 46.31 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 119.026 -0.512 . . . . 0.0 111.573 177.062 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.8 -57.54 10.52 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 119.371 0.987 . . . . 0.0 110.72 174.3 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -58.85 -34.77 71.97 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 122.171 0.986 . . . . 0.0 110.583 -178.739 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.9 mtpm? -62.54 -55.46 27.16 Favored 'General case' 0 N--CA 1.438 -1.037 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.912 176.651 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 85.1 mttt -48.22 -50.25 30.11 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 124.175 0.99 . . . . 0.0 111.481 -179.475 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -68.65 -71.34 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 118.58 0.627 . . . . 0.0 110.907 174.618 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 88.3 m -104.43 -35.79 7.79 Favored 'General case' 0 N--CA 1.435 -1.223 0 C-N-CA 123.96 0.904 . . . . 0.0 110.74 -159.191 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 112.02 -16.4 25.36 Favored Glycine 0 CA--C 1.532 1.126 0 C-N-CA 123.374 0.512 . . . . 0.0 111.982 -175.08 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.7 p -80.84 63.91 5.41 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 126.557 1.943 . . . . 0.0 110.031 -166.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -72.54 41.64 0.82 Allowed Glycine 0 CA--C 1.537 1.44 0 N-CA-C 117.57 1.788 . . . . 0.0 117.57 -155.893 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -120.87 135.17 55.25 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 119.955 1.877 . . . . 0.0 109.214 -177.785 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 175.52 -166.42 37.82 Favored Glycine 0 CA--C 1.524 0.633 0 N-CA-C 111.189 -0.764 . . . . 0.0 111.189 -177.719 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 4.3 mptt -157.89 156.2 30.94 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 125.363 1.465 . . . . 0.0 108.676 171.602 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.489 ' HB2' ' HB3' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -90.53 160.84 15.76 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 -179.746 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -137.88 131.2 30.64 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 105.518 -2.03 . . . . 0.0 105.518 170.543 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 31.4 t30 67.58 -93.05 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 118.984 0.811 . . . . 0.0 110.089 165.402 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 24.3 m120 -154.95 58.51 0.67 Allowed 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 127.888 2.475 . . . . 0.0 105.367 160.787 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 17.1 mp0 -149.25 178.37 8.81 Favored 'General case' 0 N--CA 1.444 -0.733 0 C-N-CA 129.762 3.225 . . . . 0.0 103.711 177.218 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.448 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.3 m -155.4 165.22 37.29 Favored 'General case' 0 CA--C 1.506 -0.726 0 O-C-N 120.899 -1.126 . . . . 0.0 110.055 -171.24 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -141.9 146.34 35.61 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 175.946 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 20.2 m -84.35 -129.65 0.03 OUTLIER 'General case' 0 N--CA 1.439 -1.0 0 N-CA-C 108.058 -1.09 . . . . 0.0 108.058 164.552 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 3.8 p90 . . . . . 0 N--CA 1.449 -0.508 0 C-N-CA 124.01 0.924 . . . . 0.0 108.853 -173.998 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 15.4 m-85 . . . . . 0 CA--C 1.532 0.282 0 CA-C-O 121.371 0.605 . . . . 0.0 111.804 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 125.33 -154.96 18.62 Favored Glycine 0 C--N 1.335 0.522 0 C-N-CA 124.768 1.175 . . . . 0.0 111.032 172.469 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.5 pp -91.55 150.54 21.15 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 123.219 0.608 . . . . 0.0 111.818 -172.018 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -130.09 -168.76 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.903 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 -174.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.5 t0 -135.5 105.44 6.22 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-O 120.745 0.307 . . . . 0.0 110.599 156.859 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -142.7 136.65 27.38 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.21 0 N-CA-C 109.295 -0.632 . . . . 0.0 109.295 152.235 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 55.1 pttt -46.31 114.52 0.82 Allowed 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 125.648 1.579 . . . . 0.0 112.001 176.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.503 ' HB3' ' HB2' ' A' ' 29' ' ' CYS . 5.2 p -88.39 134.73 33.75 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 118.004 0.365 . . . . 0.0 111.838 177.156 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -90.39 -21.33 22.01 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 153.67 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -164.89 166.68 19.37 Favored 'General case' 0 C--O 1.223 -0.303 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 -178.809 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.405 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 1.9 p -59.75 -39.24 84.14 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 124.519 1.127 . . . . 0.0 111.737 172.403 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.5 p -56.06 -36.29 67.9 Favored 'General case' 0 N--CA 1.451 -0.381 0 O-C-N 121.969 -0.457 . . . . 0.0 111.448 -176.381 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -39.18 -55.25 1.68 Allowed 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.159 1.384 . . . . 0.0 111.486 167.58 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 13.8 m -64.97 -31.45 72.69 Favored 'General case' 0 N--CA 1.438 -1.025 0 C-N-CA 128.186 2.595 . . . . 0.0 108.824 -173.268 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 33.2 m0 -64.02 -67.0 0.47 Allowed 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 105.837 -1.912 . . . . 0.0 105.837 178.501 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -52.44 -32.84 41.34 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 123.265 0.626 . . . . 0.0 111.843 177.732 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.95 -54.88 35.67 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 119.519 1.054 . . . . 0.0 110.147 175.668 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.7 t -59.94 -34.74 73.66 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-O 120.865 0.364 . . . . 0.0 110.643 179.312 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.413 ' CG ' ' HA3' ' A' ' 25' ' ' GLY . 4.8 mtpm? -63.36 -55.14 26.96 Favored 'General case' 0 N--CA 1.438 -1.046 0 O-C-N 122.314 -0.241 . . . . 0.0 110.833 176.571 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -53.22 -48.29 68.27 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 123.311 0.645 . . . . 0.0 111.079 178.774 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 40.8 t -70.79 -51.23 38.0 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.485 0 C-N-CA 123.997 0.919 . . . . 0.0 110.191 -176.355 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -129.03 -34.16 1.93 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.778 0.831 . . . . 0.0 112.341 -157.945 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 118.16 -31.94 5.46 Favored Glycine 0 CA--C 1.533 1.156 0 C-N-CA 124.588 1.09 . . . . 0.0 112.342 176.514 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 49.5 m -85.53 81.69 8.58 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 126.254 1.822 . . . . 0.0 110.253 -166.268 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.413 ' HA3' ' CG ' ' A' ' 19' ' ' LYS . . . -76.53 47.46 2.42 Favored Glycine 0 CA--C 1.536 1.363 0 CA-C-O 118.72 -1.045 . . . . 0.0 115.355 -164.482 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -119.52 122.57 41.94 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 119.341 1.571 . . . . 0.0 108.739 -178.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -173.35 -169.14 35.42 Favored Glycine 0 CA--C 1.522 0.522 0 CA-C-N 119.162 0.892 . . . . 0.0 112.233 -174.897 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -161.8 145.34 12.34 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 177.2 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.503 ' HB2' ' HB3' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -88.37 152.27 22.03 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 179.265 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 31.0 tp60 -127.59 108.69 10.99 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 105.67 -1.974 . . . . 0.0 105.67 -179.436 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 65.64 -79.69 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 119.233 0.924 . . . . 0.0 111.44 172.279 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -159.31 43.08 0.23 Allowed 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 129.327 3.051 . . . . 0.0 110.758 169.178 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -133.9 -171.56 2.76 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 105.97 -1.863 . . . . 0.0 105.97 157.226 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.458 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.2 m -145.03 162.35 37.16 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 119.254 0.934 . . . . 0.0 111.079 -172.52 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 41.3 mtp180 -142.9 153.36 43.03 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 -174.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 49.1 t -135.3 148.39 49.49 Favored 'General case' 0 C--N 1.33 -0.267 0 O-C-N 124.437 1.086 . . . . 0.0 110.891 -175.78 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 88.3 t80 . . . . . 0 C--O 1.234 0.276 0 C-N-CA 126.837 2.055 . . . . 0.0 109.433 -172.11 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.456 -0.169 0 CA-C-O 122.282 1.039 . . . . 0.0 109.366 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -87.32 138.53 15.42 Favored Glycine 0 N--CA 1.445 -0.728 0 C-N-CA 127.285 2.374 . . . . 0.0 108.18 172.051 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -142.03 131.17 23.32 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 118.403 1.102 . . . . 0.0 108.074 171.577 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -132.9 166.05 30.57 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.878 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 -161.465 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 22.0 p-10 -117.53 24.96 10.75 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 125.52 1.528 . . . . 0.0 112.115 -169.522 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 21.3 t -117.02 133.35 64.04 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 C-N-CA 123.811 0.844 . . . . 0.0 110.127 -179.702 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt -46.31 146.14 1.48 Allowed 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 126.853 2.061 . . . . 0.0 114.491 -176.416 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.532 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -104.56 129.49 52.64 Favored 'General case' 0 CA--C 1.511 -0.539 0 C-N-CA 123.034 0.533 . . . . 0.0 110.221 167.89 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -94.66 -10.74 30.9 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 157.694 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -174.98 168.75 3.47 Favored 'General case' 0 C--N 1.342 0.264 0 C-N-CA 126.154 1.782 . . . . 0.0 107.499 -179.436 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.456 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 2.6 p -64.82 -42.99 94.53 Favored 'General case' 0 C--N 1.333 -0.122 0 C-N-CA 125.81 1.644 . . . . 0.0 111.462 169.385 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.4 p -55.11 -38.88 68.72 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 122.094 -0.379 . . . . 0.0 110.824 -177.297 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -35.31 -55.91 0.63 Allowed 'General case' 0 C--O 1.222 -0.349 0 C-N-CA 125.329 1.451 . . . . 0.0 112.097 166.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 18.8 m -64.07 -31.2 72.31 Favored 'General case' 0 N--CA 1.439 -1.016 0 C-N-CA 127.986 2.514 . . . . 0.0 108.491 -170.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 29.8 m0 -66.41 -63.26 1.11 Allowed 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 106.927 -1.508 . . . . 0.0 106.927 178.433 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -53.8 -31.75 50.11 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.458 0.703 . . . . 0.0 111.533 175.754 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.72 -56.72 10.53 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 119.775 1.171 . . . . 0.0 109.862 178.117 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -57.49 -35.81 70.68 Favored 'General case' 0 CA--C 1.514 -0.421 0 CA-C-O 121.028 0.442 . . . . 0.0 110.758 179.654 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.455 ' CG ' ' HA3' ' A' ' 25' ' ' GLY . 18.9 mtmm -63.55 -58.14 7.93 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.416 175.879 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 7.4 mtpm? -54.0 -39.83 66.42 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 123.514 0.725 . . . . 0.0 111.825 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 42.6 t -73.93 -62.2 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.5 0 C-N-CA 123.953 0.901 . . . . 0.0 109.022 179.071 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.2 m -117.02 -43.55 2.85 Favored 'General case' 0 N--CA 1.439 -0.984 0 C-N-CA 124.083 0.953 . . . . 0.0 110.902 -161.312 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 124.13 -21.34 6.94 Favored Glycine 0 CA--C 1.534 1.241 0 C-N-CA 124.873 1.225 . . . . 0.0 112.376 -176.091 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 9.7 t -86.22 72.88 10.31 Favored 'General case' 0 C--O 1.227 -0.126 0 O-C-N 121.474 -1.015 . . . . 0.0 109.102 -164.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.455 ' HA3' ' CG ' ' A' ' 19' ' ' LYS . . . -73.72 38.45 0.9 Allowed Glycine 0 CA--C 1.533 1.184 0 N-CA-C 117.369 1.708 . . . . 0.0 117.369 -160.495 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 61.0 mt-30 -116.16 122.68 45.79 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 126.394 1.877 . . . . 0.0 108.625 -176.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -174.8 -166.47 32.72 Favored Glycine 0 CA--C 1.521 0.458 0 CA-C-N 119.298 0.954 . . . . 0.0 111.869 -177.414 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 78.1 tttt -166.69 150.3 7.03 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 175.323 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.532 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -88.23 161.35 17.25 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 -177.817 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -138.9 115.96 10.95 Favored 'General case' 0 N--CA 1.441 -0.876 0 N-CA-C 106.707 -1.59 . . . . 0.0 106.707 173.529 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 73.27 -75.58 0.07 Allowed 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.432 0.693 . . . . 0.0 111.493 165.616 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -168.48 46.94 0.04 OUTLIER 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 129.739 3.216 . . . . 0.0 109.418 167.316 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -144.01 -170.21 3.28 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 104.991 -2.225 . . . . 0.0 104.991 160.223 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.422 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 3.9 m -150.76 159.48 44.5 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 119.268 0.94 . . . . 0.0 110.235 -170.0 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 51.1 mtt-85 -136.11 152.38 50.78 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 124.599 1.159 . . . . 0.0 109.934 179.038 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 41.2 t -131.99 167.86 18.92 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 124.1 0.875 . . . . 0.0 111.281 -172.684 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 86.0 m-85 . . . . . 0 C--O 1.233 0.191 0 C-N-CA 127.132 2.173 . . . . 0.0 109.135 172.074 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 34.6 m-85 . . . . . 0 N--CA 1.45 -0.455 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -46.0 134.28 9.62 Favored Glycine 0 CA--C 1.53 1.023 0 C-N-CA 123.629 0.633 . . . . 0.0 112.228 173.746 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -147.71 132.89 18.34 Favored 'General case' 0 N--CA 1.447 -0.622 0 O-C-N 122.115 -0.638 . . . . 0.0 109.448 159.089 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -133.24 -175.29 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.974 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 -168.476 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -143.71 91.78 2.28 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 121.625 0.726 . . . . 0.0 110.179 162.759 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 94.8 t -135.73 140.95 43.38 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 161.697 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.22 104.29 0.08 Allowed 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 125.79 1.636 . . . . 0.0 113.183 -177.19 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.92 130.71 42.34 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 167.107 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 29.6 m-85 -88.7 -21.72 23.75 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 123.752 0.821 . . . . 0.0 109.438 150.4 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -167.55 168.6 12.69 Favored 'General case' 0 C--O 1.224 -0.283 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 -175.887 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.3 p -62.89 -41.98 99.61 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 125.478 1.511 . . . . 0.0 111.973 174.747 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.41 ' HA ' ' CD2' ' A' ' 15' ' ' TRP . 23.0 t -57.1 -35.57 69.59 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 121.683 -0.635 . . . . 0.0 111.376 -174.303 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -35.63 -55.48 0.69 Allowed 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.387 1.475 . . . . 0.0 112.645 163.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 11.6 m -65.94 -31.41 72.32 Favored 'General case' 0 N--CA 1.439 -1.011 0 C-N-CA 127.892 2.477 . . . . 0.0 109.01 -173.88 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.41 ' CD2' ' HA ' ' A' ' 12' ' ' SER . 35.4 m0 -64.87 -63.37 1.13 Allowed 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 106.421 -1.696 . . . . 0.0 106.421 177.471 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -53.65 -33.0 53.7 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 122.865 0.466 . . . . 0.0 111.685 176.96 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.86 -55.49 29.23 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 119.265 0.938 . . . . 0.0 110.267 175.34 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -60.13 -34.08 73.03 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 121.097 0.475 . . . . 0.0 110.373 178.586 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.45 ' CG ' ' HA3' ' A' ' 25' ' ' GLY . 30.1 mtmt -64.15 -50.81 66.73 Favored 'General case' 0 N--CA 1.44 -0.967 0 O-C-N 121.35 -0.844 . . . . 0.0 110.456 178.311 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 10.2 mtpm? -57.97 -39.73 78.88 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.795 178.779 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 38.3 t -72.32 -60.51 2.35 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.403 0 C-N-CA 123.802 0.841 . . . . 0.0 109.551 179.323 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.9 t -118.24 -39.96 3.0 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.171 0.988 . . . . 0.0 112.578 -165.835 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 120.52 -25.36 7.33 Favored Glycine 0 CA--C 1.532 1.128 0 C-N-CA 123.896 0.76 . . . . 0.0 111.648 -178.172 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.9 t -87.83 75.27 8.92 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 124.048 0.939 . . . . 0.0 108.996 -167.058 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.45 ' HA3' ' CG ' ' A' ' 19' ' ' LYS . . . -71.95 54.47 1.38 Allowed Glycine 0 CA--C 1.534 1.234 0 N-CA-C 116.891 1.516 . . . . 0.0 116.891 -161.009 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -129.62 123.03 30.26 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 120.278 2.039 . . . . 0.0 111.171 -173.013 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -175.55 -168.99 36.72 Favored Glycine 0 CA--C 1.527 0.837 0 CA-C-N 118.273 0.488 . . . . 0.0 112.256 -176.648 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -149.06 158.78 44.45 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 125.987 1.715 . . . . 0.0 107.651 165.097 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.427 ' HA ' ' HA ' ' A' ' 34' ' ' CYS . 0.4 OUTLIER -86.94 153.73 21.36 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 179.98 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 2.2 tp60 -124.5 106.8 10.45 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 176.512 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 73.88 -85.31 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.409 0 O-C-N 121.752 -0.593 . . . . 0.0 109.836 167.301 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 34.3 m120 -152.73 46.19 0.71 Allowed 'General case' 0 C--O 1.224 -0.266 0 C-N-CA 127.323 2.249 . . . . 0.0 107.289 161.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 5.2 mp0 -135.44 -175.84 4.07 Favored 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 128.597 2.759 . . . . 0.0 103.994 169.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.427 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 0.9 OUTLIER -153.41 154.33 34.24 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 119.947 1.249 . . . . 0.0 110.545 -170.151 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 66.6 mtp180 -144.05 111.74 6.09 Favored 'General case' 0 CA--C 1.506 -0.724 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.338 -168.022 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -76.39 168.31 20.28 Favored 'General case' 0 N--CA 1.438 -1.032 0 CA-C-O 121.798 0.809 . . . . 0.0 110.384 166.797 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 1.4 p90 . . . . . 0 N--CA 1.443 -0.8 0 C-N-CA 124.913 1.285 . . . . 0.0 111.25 177.674 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.451 -0.385 0 CA-C-O 121.265 0.555 . . . . 0.0 110.424 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -44.97 136.12 6.62 Favored Glycine 0 CA--C 1.527 0.782 0 C-N-CA 124.836 1.208 . . . . 0.0 110.992 156.08 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -137.46 126.58 24.45 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 107.294 -1.373 . . . . 0.0 107.294 147.433 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -136.53 158.28 37.48 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.25 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 -162.585 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -86.44 -17.92 33.04 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 125.061 1.344 . . . . 0.0 112.012 -171.619 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 63.2 t -70.09 134.44 30.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 C-N-CA 119.994 -0.682 . . . . 0.0 110.756 -159.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 56.8 pttt -53.6 102.2 0.05 Allowed 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.331 1.452 . . . . 0.0 112.611 -178.028 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.448 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -62.6 131.41 48.96 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 169.995 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -90.67 -17.2 27.23 Favored 'General case' 0 CA--C 1.535 0.402 0 O-C-N 124.684 1.24 . . . . 0.0 109.659 157.495 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 173.54 156.41 0.12 Allowed 'General case' 0 C--N 1.343 0.323 0 C-N-CA 126.41 1.884 . . . . 0.0 107.518 -175.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 35.4 m -47.6 -38.4 14.47 Favored 'General case' 0 CA--C 1.528 0.131 0 C-N-CA 124.151 0.98 . . . . 0.0 113.581 174.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.0 p -60.98 -28.59 69.12 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 121.892 -0.505 . . . . 0.0 112.005 -179.195 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 7.6 tm-20 -55.5 -52.89 62.16 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.178 0.591 . . . . 0.0 109.435 173.788 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 15.1 m -55.94 -28.17 55.7 Favored 'General case' 0 N--CA 1.442 -0.862 0 C-N-CA 127.726 2.41 . . . . 0.0 109.705 -176.216 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 37.4 m0 -66.68 -66.5 0.55 Allowed 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 107.039 -1.467 . . . . 0.0 107.039 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -50.89 -33.52 24.42 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 118.368 -0.825 . . . . 0.0 111.112 174.181 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.35 -58.75 5.12 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 120.056 1.298 . . . . 0.0 111.534 177.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -60.81 -30.26 69.97 Favored 'General case' 0 CA--C 1.519 -0.232 0 O-C-N 121.511 -0.743 . . . . 0.0 110.886 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -65.97 -48.73 70.31 Favored 'General case' 0 N--CA 1.442 -0.859 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.747 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.1 tmtt? -60.3 -37.64 81.15 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 124.453 1.101 . . . . 0.0 110.774 177.693 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 29.8 t -72.17 -62.0 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.428 -1.543 0 C-N-CA 124.05 0.94 . . . . 0.0 108.497 177.865 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.3 m -122.06 -49.87 2.06 Favored 'General case' 0 N--CA 1.431 -1.395 0 C-N-CA 123.922 0.889 . . . . 0.0 110.684 -163.196 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 134.18 -20.95 3.94 Favored Glycine 0 CA--C 1.536 1.389 0 C-N-CA 123.926 0.774 . . . . 0.0 112.253 -170.237 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 30.9 m -82.83 63.09 6.76 Favored 'General case' 0 C--O 1.228 -0.079 0 C-N-CA 125.205 1.402 . . . . 0.0 111.084 -164.783 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -65.99 1.26 4.92 Favored Glycine 0 CA--C 1.536 1.371 0 N-CA-C 116.297 1.279 . . . . 0.0 116.297 -162.795 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -89.56 105.48 17.82 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 119.629 1.714 . . . . 0.0 108.401 -173.432 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -158.85 -174.0 27.99 Favored Glycine 0 C--N 1.333 0.397 0 O-C-N 122.27 -0.269 . . . . 0.0 112.712 -171.624 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -151.33 154.98 37.77 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 124.753 1.221 . . . . 0.0 108.109 173.317 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.448 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -87.77 161.04 17.8 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 176.951 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 45.9 tt0 -136.01 127.63 28.89 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 105.164 -2.161 . . . . 0.0 105.164 170.881 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 68.71 -89.45 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 118.797 0.726 . . . . 0.0 110.555 168.333 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 36.6 m120 -161.27 55.28 0.28 Allowed 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 130.129 3.372 . . . . 0.0 104.065 165.011 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -145.99 175.47 10.42 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 130.855 3.662 . . . . 0.0 102.794 176.58 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.404 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.2 m -156.84 157.85 35.68 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-N 120.06 1.3 . . . . 0.0 110.809 -168.863 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 15.2 mtp180 -144.15 145.3 32.02 Favored 'General case' 0 CA--C 1.512 -0.497 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 -170.736 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 8.4 p -132.89 151.53 52.02 Favored 'General case' 0 CA--C 1.515 -0.384 0 O-C-N 124.244 0.965 . . . . 0.0 110.733 169.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.448 -0.526 0 C-N-CA 123.92 0.888 . . . . 0.0 112.322 -173.202 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 4.1 t80 . . . . . 0 N--CA 1.456 -0.148 0 CA-C-O 121.778 0.799 . . . . 0.0 110.061 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -54.83 162.71 4.23 Favored Glycine 0 CA--C 1.527 0.835 0 C-N-CA 125.893 1.711 . . . . 0.0 112.196 178.664 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -148.38 129.05 14.14 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 156.095 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -130.42 174.52 12.71 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.003 0 N-CA-C 106.574 -1.639 . . . . 0.0 106.574 -175.813 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -132.59 71.27 1.47 Allowed 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 122.163 0.982 . . . . 0.0 110.653 175.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 64.7 t -131.37 136.37 57.65 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 114.357 -1.292 . . . . 0.0 109.032 167.193 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 60.0 pttt -45.95 113.64 0.65 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 126.156 1.782 . . . . 0.0 112.618 179.681 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.415 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -74.09 136.67 43.02 Favored 'General case' 0 CA--C 1.516 -0.351 0 C-N-CA 120.103 -0.639 . . . . 0.0 109.859 170.123 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 7.2 t80 -100.73 -8.18 23.03 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 161.066 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 174.08 165.12 0.2 Allowed 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 126.941 2.096 . . . . 0.0 106.461 -175.668 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.6 m -62.33 -36.26 81.66 Favored 'General case' 0 C--O 1.226 -0.182 0 C-N-CA 122.73 0.412 . . . . 0.0 111.961 170.43 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.5 p -59.09 -37.75 77.89 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 122.131 -0.356 . . . . 0.0 110.652 -179.529 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -42.58 -55.3 3.57 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.165 0.986 . . . . 0.0 110.63 170.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 25.5 m -56.56 -31.11 63.88 Favored 'General case' 0 N--CA 1.444 -0.763 0 C-N-CA 127.174 2.19 . . . . 0.0 109.678 -173.88 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 34.2 m0 -65.74 -63.47 1.08 Allowed 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 -179.214 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -51.62 -36.37 45.58 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-O 118.691 -0.671 . . . . 0.0 111.031 173.565 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.74 -57.58 10.46 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 119.632 1.106 . . . . 0.0 110.863 -178.611 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -59.04 -35.31 73.1 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-O 121.37 0.605 . . . . 0.0 110.55 178.497 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.461 ' CG ' ' HA3' ' A' ' 25' ' ' GLY . 8.1 mtmt -62.55 -45.46 92.84 Favored 'General case' 0 N--CA 1.441 -0.909 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 178.621 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -54.91 -52.39 63.05 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 122.957 0.503 . . . . 0.0 111.231 176.585 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -67.38 -65.32 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 118.47 0.577 . . . . 0.0 112.093 178.713 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 62.2 p -105.25 -50.02 3.33 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 122.546 0.338 . . . . 0.0 110.703 -170.635 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 126.46 -10.36 7.24 Favored Glycine 0 CA--C 1.532 1.126 0 CA-C-N 115.464 -0.789 . . . . 0.0 112.224 -161.713 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.5 m -78.66 57.49 2.05 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 118.674 1.237 . . . . 0.0 112.347 -165.772 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.461 ' HA3' ' CG ' ' A' ' 19' ' ' LYS . . . -74.2 30.55 0.97 Allowed Glycine 0 CA--C 1.533 1.199 0 N-CA-C 117.093 1.597 . . . . 0.0 117.093 -154.075 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -122.79 123.76 41.78 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 119.57 1.685 . . . . 0.0 108.069 -172.373 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -179.11 -170.86 41.59 Favored Glycine 0 CA--C 1.526 0.757 0 CA-C-N 118.921 0.782 . . . . 0.0 112.743 -175.101 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -147.49 159.47 43.69 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 125.526 1.53 . . . . 0.0 108.337 166.494 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 34' ' ' CYS . 0.1 OUTLIER -88.37 141.18 28.75 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.775 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 11.3 tp60 -102.58 99.54 9.55 Favored 'General case' 0 N--CA 1.445 -0.713 0 N-CA-C 105.595 -2.002 . . . . 0.0 105.595 171.373 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 69.4 -77.62 0.05 Allowed 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 119.182 0.901 . . . . 0.0 112.32 166.318 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -153.95 39.11 0.47 Allowed 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 128.458 2.703 . . . . 0.0 110.933 168.449 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -136.86 -177.77 4.89 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 104.219 -2.511 . . . . 0.0 104.219 166.539 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.1 m -151.1 153.7 35.55 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 119.861 1.209 . . . . 0.0 110.639 -167.53 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 75.9 mtp180 -144.67 110.85 5.5 Favored 'General case' 0 CA--C 1.507 -0.693 0 C-N-CA 123.666 0.787 . . . . 0.0 109.475 -163.74 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 4.6 m -91.15 -154.99 0.38 Allowed 'General case' 0 N--CA 1.441 -0.875 0 CA-C-N 114.685 -1.143 . . . . 0.0 110.484 -178.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.451 -0.409 0 C-N-CA 124.857 1.263 . . . . 0.0 109.481 -175.915 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 9.6 t80 . . . . . 0 N--CA 1.454 -0.259 0 CA-C-O 121.884 0.849 . . . . 0.0 109.217 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -58.24 128.74 48.3 Favored Glycine 0 N--CA 1.447 -0.576 0 N-CA-C 107.814 -2.114 . . . . 0.0 107.814 155.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -138.02 125.81 22.44 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 119.155 1.478 . . . . 0.0 109.218 168.657 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.411 HD11 HG12 ' A' ' 6' ' ' VAL . 0.7 OUTLIER -145.48 157.77 13.01 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.619 0 N-CA-C 105.978 -1.86 . . . . 0.0 105.978 -157.842 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -118.35 33.17 5.76 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 123.139 0.576 . . . . 0.0 110.759 -169.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.411 HG12 HD11 ' A' ' 4' ' ' ILE . 1.4 p -77.99 127.36 38.55 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.175 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 170.349 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 53.3 pttt -43.84 101.83 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.31 1.444 . . . . 0.0 111.287 171.364 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.454 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.1 OUTLIER -68.8 133.47 48.36 Favored 'General case' 0 CA--C 1.517 -0.306 0 C-N-CA 119.414 -0.914 . . . . 0.0 110.32 177.492 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -98.05 -8.14 28.39 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.416 158.274 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 176.24 166.24 0.43 Allowed 'General case' 0 C--O 1.225 -0.202 0 C-N-CA 126.137 1.775 . . . . 0.0 107.15 -177.273 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.8 m -61.58 -35.35 77.58 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 118.334 0.515 . . . . 0.0 112.041 172.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.8 p -58.79 -32.56 69.44 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 121.666 -0.646 . . . . 0.0 111.61 -179.004 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -44.26 -52.71 7.28 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 124.092 0.957 . . . . 0.0 111.136 169.257 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 8.9 m -67.04 -30.69 70.84 Favored 'General case' 0 N--CA 1.44 -0.962 0 C-N-CA 127.677 2.391 . . . . 0.0 108.514 -172.554 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 34.2 m0 -64.95 -65.55 0.66 Allowed 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 106.0 -1.852 . . . . 0.0 106.0 176.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 4.0 p -54.22 -31.32 52.84 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 123.006 0.522 . . . . 0.0 111.755 179.022 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.48 -55.03 20.1 Favored 'General case' 0 N--CA 1.457 -0.092 0 CA-C-N 119.394 0.997 . . . . 0.0 110.432 175.606 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -60.96 -31.8 71.35 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-O 120.952 0.406 . . . . 0.0 110.086 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.437 ' CG ' ' HA3' ' A' ' 25' ' ' GLY . 22.9 mtpp -65.79 -53.45 40.17 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-O 121.377 0.608 . . . . 0.0 110.967 174.795 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? -54.15 -38.77 65.86 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.385 179.006 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 78.8 t -77.7 -66.72 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.425 -1.689 0 C-N-CA 124.027 0.931 . . . . 0.0 109.622 176.627 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 29.3 p -95.36 -50.8 4.86 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 123.157 0.583 . . . . 0.0 111.557 -169.733 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 122.31 -28.28 5.84 Favored Glycine 0 CA--C 1.531 1.047 0 C-N-CA 125.264 1.412 . . . . 0.0 110.783 -166.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -89.28 80.22 6.91 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.895 1.278 . . . . 0.0 109.184 -165.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.437 ' HA3' ' CG ' ' A' ' 19' ' ' LYS . . . -76.14 40.22 1.46 Allowed Glycine 0 CA--C 1.532 1.151 0 N-CA-C 117.175 1.63 . . . . 0.0 117.175 -156.534 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 61.2 mt-30 -115.5 116.68 28.6 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 120.104 1.952 . . . . 0.0 110.814 -171.066 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -170.19 -169.88 33.87 Favored Glycine 0 C--N 1.339 0.709 0 N-CA-C 111.453 -0.659 . . . . 0.0 111.453 -178.765 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 45.2 mtpt -150.97 156.46 41.2 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 124.722 1.209 . . . . 0.0 108.732 169.888 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.454 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -88.83 162.91 15.92 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 178.345 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 -141.77 125.99 17.47 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 106.858 -1.534 . . . . 0.0 106.858 168.178 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 7.2 m120 66.03 -78.13 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.943 0.897 . . . . 0.0 111.589 169.211 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -165.26 44.43 0.08 Allowed 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 129.782 3.233 . . . . 0.0 109.64 168.655 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 93.8 mt-30 -134.4 179.98 5.94 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 127.611 2.364 . . . . 0.0 105.23 168.874 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.449 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.4 m -153.57 157.61 39.98 Favored 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 -177.704 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 8.1 mtt180 -146.12 128.6 15.98 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 118.022 -0.989 . . . . 0.0 109.502 -170.549 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -103.45 167.71 9.63 Favored 'General case' 0 C--N 1.343 0.306 0 CA-C-O 121.885 0.85 . . . . 0.0 112.209 171.545 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.451 -0.377 0 C-N-CA 126.076 1.75 . . . . 0.0 111.107 -176.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 59.8 m-85 . . . . . 0 CA--C 1.538 0.5 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -56.91 124.53 35.91 Favored Glycine 0 N--CA 1.447 -0.582 0 CA-C-O 118.612 -1.105 . . . . 0.0 110.622 176.488 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -139.22 130.74 27.15 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 118.164 0.982 . . . . 0.0 109.211 159.67 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -138.89 166.17 22.85 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.186 0 N-CA-C 106.794 -1.558 . . . . 0.0 106.794 -163.714 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 46.9 t0 -127.42 81.8 2.04 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 122.047 0.927 . . . . 0.0 109.055 166.072 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 93.3 t -122.13 133.89 67.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 N-CA-C 106.2 -1.778 . . . . 0.0 106.2 156.595 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -62.1 108.58 1.09 Allowed 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 124.514 1.126 . . . . 0.0 111.464 -174.082 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.491 ' HB3' ' HB2' ' A' ' 29' ' ' CYS . 11.4 p -63.54 128.24 34.93 Favored 'General case' 0 CA--C 1.516 -0.354 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.711 176.637 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -71.83 -38.14 70.22 Favored 'General case' 0 N--CA 1.45 -0.446 0 O-C-N 124.421 1.076 . . . . 0.0 108.108 153.499 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -169.17 160.31 9.62 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.666 1.187 . . . . 0.0 108.386 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.531 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 21.8 m -47.06 -40.52 15.14 Favored 'General case' 0 C--O 1.226 -0.16 0 C-N-CA 124.383 1.073 . . . . 0.0 112.378 173.401 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.08 -23.6 65.59 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-O 119.096 -0.478 . . . . 0.0 112.112 -177.809 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -69.9 -48.14 59.78 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 119.235 0.925 . . . . 0.0 109.674 174.414 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 21.3 m -47.84 -28.16 2.46 Favored 'General case' 0 CA--C 1.511 -0.522 0 C-N-CA 125.937 1.695 . . . . 0.0 110.596 -179.372 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 37.1 m0 -64.81 -65.85 0.62 Allowed 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 177.547 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -51.4 -31.95 24.48 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-O 117.918 -1.039 . . . . 0.0 111.464 172.173 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.42 -63.31 1.27 Allowed 'General case' 0 C--N 1.342 0.245 0 CA-C-N 121.018 1.735 . . . . 0.0 111.265 176.47 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -57.68 -30.94 65.86 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 121.906 0.86 . . . . 0.0 110.848 -178.5 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.7 mtmm -66.49 -49.45 66.56 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 173.875 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 67.4 mttt -51.98 -53.26 43.62 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.25 1.02 . . . . 0.0 109.95 177.434 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -63.04 -40.88 90.72 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 179.287 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -151.6 -49.15 0.11 Allowed 'General case' 0 N--CA 1.447 -0.613 0 O-C-N 121.419 -0.8 . . . . 0.0 111.768 -164.82 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 144.52 -15.14 2.04 Favored Glycine 0 CA--C 1.53 0.979 0 C-N-CA 120.721 -0.752 . . . . 0.0 114.154 -178.114 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 9.3 m -79.79 59.12 3.02 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 124.059 0.943 . . . . 0.0 111.682 -163.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -70.87 12.01 2.3 Favored Glycine 0 CA--C 1.532 1.152 0 N-CA-C 116.339 1.295 . . . . 0.0 116.339 -157.428 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -105.22 108.06 19.37 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 119.16 1.48 . . . . 0.0 107.042 -172.83 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -167.03 -170.37 31.82 Favored Glycine 0 C--N 1.336 0.575 0 N-CA-C 111.966 -0.454 . . . . 0.0 111.966 -168.39 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 78.2 mttt -156.22 154.91 31.51 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 124.922 1.289 . . . . 0.0 108.631 177.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.531 ' HB3' ' HA ' ' A' ' 11' ' ' SER . 0.5 OUTLIER -91.35 160.09 15.66 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 176.419 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -140.81 120.9 13.74 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 106.231 -1.766 . . . . 0.0 106.231 176.334 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 70.84 -84.96 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 118.25 0.477 . . . . 0.0 110.078 168.901 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -162.34 56.36 0.23 Allowed 'General case' 0 N--CA 1.462 0.131 0 C-N-CA 129.175 2.99 . . . . 0.0 104.793 162.079 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 5.6 mp0 -143.09 -178.96 6.1 Favored 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 128.882 2.873 . . . . 0.0 103.796 170.017 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.419 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.2 m -157.39 158.5 36.02 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 119.595 1.089 . . . . 0.0 109.998 -169.674 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 58.1 mtt-85 -144.81 153.32 41.51 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 124.555 1.142 . . . . 0.0 110.096 -176.109 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 8.7 p -139.07 163.33 32.7 Favored 'General case' 0 CA--C 1.521 -0.164 0 O-C-N 124.389 1.056 . . . . 0.0 111.088 170.609 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.533 0.294 0 C-N-CA 123.807 0.843 . . . . 0.0 112.194 -171.606 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 29.3 t80 . . . . . 0 N--CA 1.453 -0.304 0 CA-C-O 121.928 0.87 . . . . 0.0 109.562 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -61.8 138.41 46.48 Favored Glycine 0 CA--C 1.522 0.484 0 N-CA-C 109.201 -1.56 . . . . 0.0 109.201 160.758 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -140.01 126.87 20.69 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 118.825 1.312 . . . . 0.0 109.709 170.102 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -145.26 158.74 13.36 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.338 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 -158.464 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -123.5 41.62 3.43 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 121.881 0.848 . . . . 0.0 111.516 -174.726 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 97.5 t -87.19 129.14 39.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 166.747 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 52.8 pttt -49.53 101.48 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 126.211 1.805 . . . . 0.0 113.363 179.292 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.479 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -66.47 127.07 30.89 Favored 'General case' 0 CA--C 1.515 -0.378 0 C-N-CA 123.0 0.52 . . . . 0.0 110.591 170.358 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 87.2 m-85 -96.94 -12.43 23.41 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 125.198 1.561 . . . . 0.0 109.979 153.734 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -177.15 153.42 0.97 Allowed 'General case' 0 C--N 1.343 0.318 0 C-N-CA 124.483 1.113 . . . . 0.0 109.212 -177.582 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.444 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 1.9 p -54.52 -41.22 69.4 Favored 'General case' 0 N--CA 1.457 -0.12 0 C-N-CA 125.31 1.444 . . . . 0.0 111.199 171.513 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.5 p -59.3 -25.08 63.84 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -178.486 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -60.0 -57.38 13.11 Favored 'General case' 0 C--O 1.223 -0.312 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 173.63 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 11.7 m -48.56 -31.4 6.48 Favored 'General case' 0 CA--C 1.508 -0.646 0 C-N-CA 129.008 2.923 . . . . 0.0 109.964 -175.446 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 33.8 m0 -62.58 -63.82 1.11 Allowed 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 175.807 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -48.11 -39.77 21.45 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 123.263 0.625 . . . . 0.0 111.922 173.487 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.29 -56.72 18.14 Favored 'General case' 0 C--N 1.328 -0.327 0 O-C-N 121.681 -0.637 . . . . 0.0 110.546 178.553 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -59.75 -35.56 74.84 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.595 0.712 . . . . 0.0 110.549 179.076 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 4.3 mtmp? -64.5 -44.63 90.31 Favored 'General case' 0 N--CA 1.439 -1.011 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.438 177.838 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.43 -54.43 32.28 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 124.226 1.011 . . . . 0.0 109.785 178.791 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -67.58 -62.95 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.325 0 N-CA-C 112.087 0.402 . . . . 0.0 112.087 178.226 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 70.7 p -103.6 -49.51 3.66 Favored 'General case' 0 CA--C 1.522 -0.099 0 C-N-CA 122.779 0.431 . . . . 0.0 110.806 -167.199 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 118.65 -18.1 10.89 Favored Glycine 0 CA--C 1.532 1.1 0 CA-C-N 115.151 -0.932 . . . . 0.0 111.401 -163.692 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 24.5 m -79.56 67.31 5.28 Favored 'General case' 0 C--O 1.227 -0.123 0 C-N-CA 124.467 1.107 . . . . 0.0 110.285 -169.348 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -72.44 40.67 0.76 Allowed Glycine 0 CA--C 1.539 1.584 0 N-CA-C 117.036 1.574 . . . . 0.0 117.036 -160.207 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 63.1 mt-30 -117.09 120.53 38.6 Favored 'General case' 0 C--O 1.224 -0.282 0 C-N-CA 125.739 1.616 . . . . 0.0 108.942 -172.381 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -175.2 -168.39 35.67 Favored Glycine 0 C--N 1.335 0.524 0 CA-C-N 119.622 1.101 . . . . 0.0 111.508 -178.021 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 81.4 mttt -153.77 160.83 42.41 Favored 'General case' 0 CA--C 1.522 -0.101 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 165.414 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.479 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -89.18 165.57 14.38 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 177.051 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -141.32 141.58 33.87 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 106.264 -1.754 . . . . 0.0 106.264 165.323 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 18.9 t30 61.68 -93.43 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 118.591 0.632 . . . . 0.0 111.07 167.546 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.0 m120 -153.35 55.37 0.75 Allowed 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 127.632 2.373 . . . . 0.0 106.224 162.167 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 17.1 mp0 -148.12 176.82 9.9 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 129.966 3.306 . . . . 0.0 104.442 -176.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.461 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.4 m -156.81 155.1 30.96 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 119.54 1.064 . . . . 0.0 110.126 -171.914 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 -142.2 134.84 28.24 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 123.847 0.859 . . . . 0.0 109.248 -170.264 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 49.0 t -111.32 158.05 19.47 Favored 'General case' 0 C--N 1.341 0.228 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 -174.914 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 16.8 m-30 . . . . . 0 N--CA 1.454 -0.258 0 C-N-CA 125.481 1.512 . . . . 0.0 109.64 -175.302 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 10.7 t80 . . . . . 0 N--CA 1.453 -0.283 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -39.22 147.96 0.14 Allowed Glycine 0 CA--C 1.522 0.517 0 C-N-CA 126.637 2.065 . . . . 0.0 112.119 160.045 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -140.2 130.34 25.0 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 162.25 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -137.1 162.6 33.75 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.15 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 -167.128 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -90.56 -16.91 27.9 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 124.501 1.12 . . . . 0.0 112.621 -172.122 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 58.3 t -75.19 134.57 29.07 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 CA-C-N 118.795 0.725 . . . . 0.0 111.757 -157.294 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.2 tmtt? -37.7 106.31 0.05 OUTLIER 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 127.578 2.351 . . . . 0.0 112.104 173.04 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.499 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -75.28 135.22 40.95 Favored 'General case' 0 CA--C 1.515 -0.388 0 C-N-CA 120.332 -0.547 . . . . 0.0 109.915 168.907 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -95.12 -16.37 22.66 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 158.512 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 178.51 166.43 0.83 Allowed 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 106.099 -1.815 . . . . 0.0 106.099 -172.726 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.9 p -61.31 -39.37 90.22 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 124.06 0.944 . . . . 0.0 111.48 172.733 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.6 p -56.77 -40.94 76.78 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 122.773 0.429 . . . . 0.0 111.046 -177.495 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -40.66 -56.87 2.02 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.634 1.174 . . . . 0.0 111.078 170.546 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 23.7 m -57.95 -28.37 64.25 Favored 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 128.026 2.53 . . . . 0.0 109.73 -173.311 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 33.2 m0 -64.65 -66.15 0.58 Allowed 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 107.186 -1.413 . . . . 0.0 107.186 177.534 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -51.67 -33.14 32.54 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 118.085 -0.959 . . . . 0.0 111.696 174.409 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.82 -54.38 36.01 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 120.107 1.321 . . . . 0.0 110.709 175.916 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 5.1 t -58.12 -37.16 74.06 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.071 0.463 . . . . 0.0 110.46 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.42 ' CG ' ' HA3' ' A' ' 25' ' ' GLY . 40.3 mtmt -63.5 -58.71 6.15 Favored 'General case' 0 N--CA 1.44 -0.943 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.706 177.079 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 64.3 mmtt -49.53 -47.11 49.13 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.303 1.041 . . . . 0.0 111.835 178.076 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 44.0 t -70.87 -60.02 2.86 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.77 0 C-N-CA 123.962 0.905 . . . . 0.0 109.15 -178.102 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.2 m -118.58 -41.54 2.81 Favored 'General case' 0 N--CA 1.439 -1.004 0 C-N-CA 123.591 0.756 . . . . 0.0 110.987 -161.103 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 120.83 -21.42 8.41 Favored Glycine 0 CA--C 1.533 1.215 0 C-N-CA 124.908 1.242 . . . . 0.0 112.372 -177.737 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 21.5 m -88.17 61.08 6.09 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 124.709 1.204 . . . . 0.0 110.322 -160.628 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.42 ' HA3' ' CG ' ' A' ' 19' ' ' LYS . . . -64.13 23.39 0.09 OUTLIER Glycine 0 CA--C 1.54 1.623 0 N-CA-C 120.414 2.926 . . . . 0.0 120.414 -152.614 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -108.38 118.2 36.16 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 121.129 2.465 . . . . 0.0 109.903 -176.3 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -163.99 -170.49 28.98 Favored Glycine 0 CA--C 1.528 0.875 0 N-CA-C 112.157 -0.377 . . . . 0.0 112.157 -174.559 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -156.38 156.08 33.26 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 125.159 1.384 . . . . 0.0 107.879 174.073 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.499 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 0.0 OUTLIER -92.14 160.57 15.13 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 178.485 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.8 tp-100 -133.62 126.69 31.41 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 105.896 -1.89 . . . . 0.0 105.896 165.659 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.2 t30 69.04 -78.91 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 164.79 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -166.63 44.86 0.06 Allowed 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 130.411 3.484 . . . . 0.0 108.894 170.388 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -147.61 179.35 7.75 Favored 'General case' 0 N--CA 1.442 -0.825 0 C-N-CA 128.875 2.87 . . . . 0.0 104.167 177.453 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.432 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 5.0 m -153.94 164.75 37.9 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 119.894 1.224 . . . . 0.0 110.399 -169.422 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 73.4 mtp180 -140.0 152.93 46.68 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 125.651 1.58 . . . . 0.0 108.976 -178.685 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 36.8 t -132.59 162.63 30.8 Favored 'General case' 0 C--O 1.224 -0.26 0 O-C-N 124.652 1.22 . . . . 0.0 109.34 178.791 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.534 0.355 0 CA-C-N 118.651 0.66 . . . . 0.0 111.365 -177.294 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 . . . . . 0 CA--C 1.532 0.284 0 CA-C-O 121.158 0.504 . . . . 0.0 110.922 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 135.8 -118.4 1.85 Allowed Glycine 0 N--CA 1.449 -0.498 0 CA-C-O 117.949 -1.473 . . . . 0.0 110.664 173.221 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -130.78 147.16 52.4 Favored 'General case' 0 C--N 1.339 0.119 0 CA-C-N 118.512 1.156 . . . . 0.0 112.224 -173.581 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -140.42 160.67 25.02 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.373 0 N-CA-C 104.932 -2.247 . . . . 0.0 104.932 -171.487 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -123.33 41.88 3.36 Favored 'General case' 0 C--N 1.332 -0.19 0 C-N-CA 123.077 0.551 . . . . 0.0 110.677 -171.734 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 95.9 t -96.45 135.97 28.83 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 170.358 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.67 106.7 0.27 Allowed 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.815 1.246 . . . . 0.0 112.372 -177.748 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.432 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -65.19 127.29 31.08 Favored 'General case' 0 CA--C 1.515 -0.367 0 C-N-CA 122.587 0.355 . . . . 0.0 110.259 168.005 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -85.21 -19.19 32.06 Favored 'General case' 0 CA--C 1.538 0.519 0 O-C-N 124.403 1.064 . . . . 0.0 109.237 155.309 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -175.39 171.51 2.85 Favored 'General case' 0 C--O 1.221 -0.406 0 C-N-CA 125.486 1.515 . . . . 0.0 108.11 -179.243 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.44 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 20.0 m -62.86 -37.94 88.86 Favored 'General case' 0 N--CA 1.464 0.254 0 O-C-N 121.72 -0.612 . . . . 0.0 111.934 170.688 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.2 p -57.99 -34.36 69.9 Favored 'General case' 0 N--CA 1.452 -0.361 0 O-C-N 121.768 -0.582 . . . . 0.0 110.999 -178.138 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -40.24 -54.69 2.31 Favored 'General case' 0 C--O 1.225 -0.225 0 C-N-CA 124.42 1.088 . . . . 0.0 111.567 167.939 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 19.1 m -64.93 -30.06 71.03 Favored 'General case' 0 N--CA 1.44 -0.949 0 C-N-CA 127.394 2.278 . . . . 0.0 108.438 -171.019 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 28.9 m0 -64.9 -65.72 0.64 Allowed 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 106.178 -1.786 . . . . 0.0 106.178 176.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -51.46 -33.6 31.73 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 118.604 -0.712 . . . . 0.0 112.149 176.75 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.48 -54.88 25.57 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 119.902 1.228 . . . . 0.0 110.259 177.376 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -60.29 -34.1 73.29 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 120.794 0.33 . . . . 0.0 110.343 179.835 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 39.1 mtmt -65.16 -53.9 37.85 Favored 'General case' 0 N--CA 1.439 -0.999 0 C-N-CA 122.483 0.313 . . . . 0.0 110.839 176.267 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -48.32 -49.49 33.89 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 123.569 0.748 . . . . 0.0 110.71 176.786 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 65.3 t -73.15 -56.07 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.697 0 C-N-CA 124.289 1.036 . . . . 0.0 110.299 -175.477 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 11.9 t -138.91 18.85 2.65 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 113.588 0.959 . . . . 0.0 113.588 -162.517 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.09 -27.53 0.54 Allowed Glycine 0 CA--C 1.542 1.74 0 O-C-N 120.566 -1.334 . . . . 0.0 115.132 176.763 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 10.1 t -84.72 73.52 10.58 Favored 'General case' 0 C--O 1.226 -0.171 0 O-C-N 121.488 -1.007 . . . . 0.0 109.539 -162.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -72.04 35.77 0.63 Allowed Glycine 0 CA--C 1.536 1.398 0 N-CA-C 117.013 1.565 . . . . 0.0 117.013 -162.439 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -111.56 109.74 19.81 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 119.952 1.876 . . . . 0.0 109.454 -173.724 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -161.8 -169.19 24.78 Favored Glycine 0 CA--C 1.527 0.784 0 CA-C-N 118.736 0.698 . . . . 0.0 113.565 -173.558 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 19.2 ttmm -165.98 142.59 5.2 Favored 'General case' 0 CA--C 1.519 -0.246 0 C-N-CA 125.192 1.397 . . . . 0.0 107.748 -178.724 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.451 ' HA ' ' HA ' ' A' ' 34' ' ' CYS . 0.1 OUTLIER -86.08 149.04 25.42 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 109.217 -0.661 . . . . 0.0 109.217 -177.901 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 21.1 tp60 -116.22 111.3 19.98 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 105.056 -2.202 . . . . 0.0 105.056 174.555 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 63.32 -92.37 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 119.598 1.09 . . . . 0.0 109.731 172.002 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 21.8 m120 -147.68 55.18 1.07 Allowed 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 126.02 1.728 . . . . 0.0 107.891 165.193 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.4 mp0 -141.55 175.76 9.42 Favored 'General case' 0 N--CA 1.445 -0.715 0 C-N-CA 130.752 3.621 . . . . 0.0 103.177 171.944 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.451 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 0.8 OUTLIER -147.9 155.82 42.01 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-N 120.725 1.602 . . . . 0.0 110.759 -171.46 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 63.0 mtp180 -139.51 151.88 46.49 Favored 'General case' 0 CA--C 1.509 -0.619 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 -171.141 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 47.5 t -143.37 141.45 30.92 Favored 'General case' 0 C--N 1.332 -0.179 0 O-C-N 124.543 1.152 . . . . 0.0 110.817 -172.181 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 72.9 t80 . . . . . 0 N--CA 1.453 -0.298 0 C-N-CA 126.021 1.728 . . . . 0.0 109.834 -170.343 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 . . . . . 0 N--CA 1.449 -0.495 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 127.29 -127.85 5.99 Favored Glycine 0 C--N 1.332 0.307 0 CA-C-O 117.869 -1.517 . . . . 0.0 111.71 168.913 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -125.93 143.02 51.26 Favored 'General case' 0 C--N 1.342 0.279 0 CA-C-N 118.652 1.226 . . . . 0.0 112.514 -169.654 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.47 HD11 HG12 ' A' ' 6' ' ' VAL . 0.9 OUTLIER -139.39 162.05 27.34 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.184 0 C-N-CA 126.085 1.754 . . . . 0.0 106.702 -166.332 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -88.42 -15.82 34.47 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 124.03 0.932 . . . . 0.0 113.216 -169.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.47 HG12 HD11 ' A' ' 4' ' ' ILE . 0.8 OUTLIER -67.46 139.46 20.89 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 C-N-CA 119.369 -0.932 . . . . 0.0 112.31 -156.318 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 34.3 mttt -65.55 95.63 0.23 Allowed 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.758 1.223 . . . . 0.0 111.645 -174.093 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.496 ' HB3' ' HB2' ' A' ' 29' ' ' CYS . 1.4 p -67.09 133.21 49.41 Favored 'General case' 0 CA--C 1.517 -0.31 0 O-C-N 123.109 0.255 . . . . 0.0 111.12 176.953 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 52.8 m-85 -85.47 -27.79 25.45 Favored 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 124.047 0.842 . . . . 0.0 109.295 150.856 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -169.79 160.71 8.8 Favored 'General case' 0 C--O 1.223 -0.333 0 C-N-CA 123.813 0.845 . . . . 0.0 109.833 -179.756 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.439 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 66.8 m -46.56 -38.28 9.21 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 114.161 1.171 . . . . 0.0 114.161 175.069 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.8 p -58.02 -27.73 63.81 Favored 'General case' 0 N--CA 1.449 -0.475 0 O-C-N 121.634 -0.666 . . . . 0.0 112.161 -179.769 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -54.49 -47.05 73.5 Favored 'General case' 0 C--O 1.219 -0.503 0 C-N-CA 124.333 1.053 . . . . 0.0 111.345 170.561 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.412 ' SG ' ' CA ' ' A' ' 29' ' ' CYS . 6.3 m -67.47 -33.16 74.56 Favored 'General case' 0 CA--C 1.498 -1.027 0 C-N-CA 125.922 1.689 . . . . 0.0 107.614 -175.987 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 33.4 m0 -64.55 -65.79 0.63 Allowed 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 106.53 -1.656 . . . . 0.0 106.53 177.951 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 21.4 p -55.87 -29.76 60.43 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 118.583 -0.723 . . . . 0.0 111.999 -179.523 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.25 -54.76 18.0 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 119.298 0.953 . . . . 0.0 111.27 175.598 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.8 t -60.0 -36.92 78.23 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-O 121.55 0.691 . . . . 0.0 110.089 179.814 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 75.0 mttt -60.82 -54.39 45.69 Favored 'General case' 0 N--CA 1.436 -1.141 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.938 174.135 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -43.98 -53.89 5.85 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 124.198 0.999 . . . . 0.0 111.001 177.948 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 91.7 t -77.32 -60.43 2.31 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.836 0 C-N-CA 124.543 1.137 . . . . 0.0 109.775 -173.237 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 30.8 p -103.52 -42.13 5.77 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 122.788 0.435 . . . . 0.0 111.95 -167.76 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 110.29 -16.5 29.63 Favored Glycine 0 CA--C 1.536 1.365 0 C-N-CA 124.567 1.08 . . . . 0.0 111.234 -165.534 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 3.5 m -82.75 65.33 7.82 Favored 'General case' 0 C--O 1.224 -0.252 0 C-N-CA 124.276 1.03 . . . . 0.0 110.339 -165.558 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -74.27 34.86 0.94 Allowed Glycine 0 CA--C 1.538 1.508 0 N-CA-C 117.856 1.902 . . . . 0.0 117.856 -155.132 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 57.4 mt-30 -113.65 124.83 53.24 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 119.891 1.845 . . . . 0.0 109.428 -177.05 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -170.73 -168.21 32.17 Favored Glycine 0 CA--C 1.523 0.559 0 CA-C-N 119.161 0.891 . . . . 0.0 112.529 -175.944 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -159.81 142.03 13.33 Favored 'General case' 0 CA--C 1.52 -0.207 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 175.718 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.496 ' HB2' ' HB3' ' A' ' 8' ' ' CYS . 0.5 OUTLIER -86.54 157.52 19.73 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 108.188 -1.041 . . . . 0.0 108.188 -179.514 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 15.5 tt0 -136.67 123.93 21.86 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 105.383 -2.08 . . . . 0.0 105.383 176.86 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 22.2 t30 68.5 -92.75 0.03 OUTLIER 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 118.805 0.73 . . . . 0.0 109.795 167.244 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 24.3 m120 -154.46 57.05 0.7 Allowed 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 127.561 2.344 . . . . 0.0 105.691 160.486 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.7 mp0 -144.69 175.44 10.16 Favored 'General case' 0 N--CA 1.445 -0.68 0 C-N-CA 130.356 3.463 . . . . 0.0 103.097 175.954 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.2 m -149.91 161.85 41.48 Favored 'General case' 0 CA--C 1.504 -0.792 0 O-C-N 120.636 -1.29 . . . . 0.0 110.629 -173.819 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 49.6 mtp180 -139.63 150.72 45.29 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 -175.292 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 49.3 t -137.48 146.98 44.9 Favored 'General case' 0 N--CA 1.463 0.218 0 O-C-N 124.4 1.062 . . . . 0.0 110.398 -173.034 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 87.3 t80 . . . . . 0 N--CA 1.452 -0.328 0 C-N-CA 126.617 1.967 . . . . 0.0 109.344 -171.346 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 3.2 t80 . . . . . 0 N--CA 1.456 -0.157 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -57.61 171.91 3.12 Favored Glycine 0 CA--C 1.525 0.7 0 C-N-CA 126.708 2.099 . . . . 0.0 112.203 176.054 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -154.22 132.39 11.81 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 105.738 -1.949 . . . . 0.0 105.738 155.283 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -132.31 -176.45 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 N-CA-C 107.745 -1.205 . . . . 0.0 107.745 -175.226 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -137.39 84.92 2.09 Favored 'General case' 0 N--CA 1.457 -0.097 0 CA-C-O 121.89 0.852 . . . . 0.0 110.928 163.821 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 94.6 t -128.35 136.43 60.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 N-CA-C 105.382 -2.081 . . . . 0.0 105.382 156.313 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -70.42 115.74 9.95 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 123.765 0.826 . . . . 0.0 110.932 -168.381 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.493 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -68.69 125.38 26.37 Favored 'General case' 0 CA--C 1.514 -0.419 0 C-N-CA 122.661 0.385 . . . . 0.0 110.304 177.114 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -77.66 -27.13 50.82 Favored 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 124.61 1.194 . . . . 0.0 109.588 151.118 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -179.7 153.91 0.57 Allowed 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 124.417 1.087 . . . . 0.0 108.796 -172.847 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 36.7 m -49.51 -38.85 32.01 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 124.027 0.931 . . . . 0.0 113.04 173.911 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.3 p -62.12 -20.36 63.98 Favored 'General case' 0 N--CA 1.445 -0.71 0 C-N-CA 122.775 0.43 . . . . 0.0 112.127 -178.383 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.07 -50.74 18.3 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-N 118.509 0.595 . . . . 0.0 109.622 176.09 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 17.7 m -46.35 -28.65 1.39 Allowed 'General case' 0 CA--C 1.51 -0.575 0 C-N-CA 126.91 2.084 . . . . 0.0 110.52 -179.496 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 29.6 m0 -60.56 -71.43 0.14 Allowed 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 114.524 -1.217 . . . . 0.0 108.107 172.509 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -50.14 -31.04 12.5 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 124.109 0.964 . . . . 0.0 112.284 175.066 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.06 -54.77 32.81 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 120.273 1.397 . . . . 0.0 110.887 173.167 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 2.5 t -58.22 -35.72 72.09 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.863 0.84 . . . . 0.0 110.286 179.781 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 33.4 mtpt -63.22 -50.61 69.57 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.313 175.245 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -48.43 -55.41 10.96 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.91 0.884 . . . . 0.0 110.644 177.528 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -66.16 -61.35 1.73 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 179.05 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 81.9 p -107.78 -46.6 3.76 Favored 'General case' 0 C--N 1.338 0.107 0 CA-C-O 120.877 0.37 . . . . 0.0 111.16 -166.789 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 117.3 -16.94 12.71 Favored Glycine 0 CA--C 1.531 1.074 0 CA-C-N 115.295 -0.866 . . . . 0.0 111.303 -164.94 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 43.3 t -78.35 62.42 3.0 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 125.327 1.451 . . . . 0.0 110.683 -168.543 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -68.48 28.03 0.27 Allowed Glycine 0 CA--C 1.54 1.646 0 N-CA-C 118.369 2.108 . . . . 0.0 118.369 -157.642 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 58.2 mt-30 -113.06 108.07 16.82 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 120.584 2.192 . . . . 0.0 110.258 -173.473 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -157.44 -168.2 19.57 Favored Glycine 0 C--N 1.339 0.722 0 CA-C-O 119.872 -0.404 . . . . 0.0 112.599 -174.879 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -156.37 157.97 36.57 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 126.206 1.802 . . . . 0.0 107.718 170.872 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.493 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -89.51 162.82 15.5 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 108.725 -0.842 . . . . 0.0 108.725 178.108 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 20.4 tt0 -139.24 121.16 15.54 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 106.733 -1.58 . . . . 0.0 106.733 168.294 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 72.27 -88.22 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 123.051 0.54 . . . . 0.0 109.884 170.508 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.7 m120 -159.06 52.81 0.39 Allowed 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 128.55 2.74 . . . . 0.0 105.566 161.78 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 36.3 mt-30 -137.19 -175.19 3.97 Favored 'General case' 0 N--CA 1.444 -0.728 0 C-N-CA 128.933 2.893 . . . . 0.0 103.358 163.577 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.456 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.6 m -153.86 165.98 34.35 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 119.317 0.962 . . . . 0.0 110.321 -171.088 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 29.1 mtp180 -147.74 152.88 38.51 Favored 'General case' 0 CA--C 1.516 -0.357 0 C-N-CA 124.747 1.219 . . . . 0.0 108.326 -168.585 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 48.7 t -145.34 148.2 33.14 Favored 'General case' 0 C--N 1.328 -0.35 0 O-C-N 124.48 1.112 . . . . 0.0 109.491 -174.398 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.536 0.408 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -169.503 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 60.6 t80 . . . . . 0 N--CA 1.454 -0.263 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -48.52 160.75 0.6 Allowed Glycine 0 CA--C 1.525 0.715 0 C-N-CA 127.063 2.268 . . . . 0.0 112.416 177.968 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -143.65 130.79 20.7 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 119.022 1.411 . . . . 0.0 109.457 165.596 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -143.09 159.06 17.8 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.25 0 N-CA-C 106.298 -1.741 . . . . 0.0 106.298 -169.244 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -100.95 8.89 42.84 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 -164.014 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 93.3 t -78.7 136.2 24.36 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 O-C-N 121.687 -0.633 . . . . 0.0 110.68 -170.705 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -61.9 95.41 0.06 Allowed 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 125.419 1.488 . . . . 0.0 111.198 -177.177 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.48 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -61.38 120.18 9.96 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.557 170.851 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -83.18 -20.59 34.37 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 124.983 1.427 . . . . 0.0 109.941 151.821 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -178.83 150.19 0.48 Allowed 'General case' 0 C--N 1.341 0.239 0 C-N-CA 124.432 1.093 . . . . 0.0 109.123 -175.187 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.417 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 57.9 m -47.81 -35.61 10.42 Favored 'General case' 0 C--N 1.333 -0.129 0 C-N-CA 124.787 1.235 . . . . 0.0 113.754 173.079 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.0 p -61.24 -28.56 69.25 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 179.643 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -55.13 -54.65 40.46 Favored 'General case' 0 C--O 1.226 -0.175 0 C-N-CA 123.204 0.602 . . . . 0.0 109.507 174.563 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 11.4 m -55.02 -31.46 61.07 Favored 'General case' 0 N--CA 1.443 -0.811 0 C-N-CA 128.684 2.794 . . . . 0.0 109.253 -174.273 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 39.0 m0 -63.46 -68.34 0.35 Allowed 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 178.474 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -51.07 -32.23 21.43 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 118.345 -0.836 . . . . 0.0 112.163 175.483 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.54 -52.77 63.09 Favored 'General case' 0 C--N 1.339 0.136 0 CA-C-N 120.174 1.352 . . . . 0.0 110.326 174.807 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.8 t -62.46 -35.06 78.12 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 121.247 0.546 . . . . 0.0 110.434 179.3 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 41.7 mtpt -61.94 -51.92 66.15 Favored 'General case' 0 N--CA 1.44 -0.949 0 CA-C-O 121.788 0.804 . . . . 0.0 109.666 176.803 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.6 tptm -56.69 -42.41 79.04 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.19 -0.913 . . . . 0.0 111.493 -179.214 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 37.5 t -70.52 -59.49 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.357 0 C-N-CA 124.059 0.944 . . . . 0.0 109.447 179.195 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.7 t -117.63 -46.48 2.66 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.855 0.862 . . . . 0.0 111.966 -166.366 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 125.72 -25.04 5.68 Favored Glycine 0 CA--C 1.53 0.972 0 N-CA-C 111.162 -0.775 . . . . 0.0 111.162 -175.818 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 31.2 t -78.76 73.54 5.31 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 125.413 1.485 . . . . 0.0 108.821 -172.867 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -70.91 39.91 0.54 Allowed Glycine 0 CA--C 1.54 1.619 0 N-CA-C 116.294 1.278 . . . . 0.0 116.294 -168.451 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 64.2 mt-30 -114.79 115.75 27.52 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 126.217 1.807 . . . . 0.0 108.353 -174.911 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -170.93 -162.87 24.01 Favored Glycine 0 C--N 1.333 0.366 0 CA-C-N 119.524 1.056 . . . . 0.0 111.257 -176.74 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 4.6 pttp -167.06 164.81 15.91 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 165.319 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.48 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -87.39 172.11 10.07 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 119.999 -0.68 . . . . 0.0 110.153 -176.653 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -145.31 121.67 10.95 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 105.098 -2.186 . . . . 0.0 105.098 172.53 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 64.5 t30 68.86 -93.4 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 119.372 0.987 . . . . 0.0 110.23 169.723 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 26.1 m120 -153.8 52.03 0.69 Allowed 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 128.315 2.646 . . . . 0.0 106.002 161.532 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -139.17 177.58 7.8 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 131.07 3.748 . . . . 0.0 102.609 175.238 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.447 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.3 m -150.56 163.68 37.88 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-N 120.624 1.556 . . . . 0.0 111.647 -173.083 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 50.7 mtp180 -142.39 150.8 41.15 Favored 'General case' 0 CA--C 1.512 -0.518 0 C-N-CA 124.061 0.944 . . . . 0.0 109.686 -170.395 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 52.5 t -141.21 133.88 28.67 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 124.658 1.224 . . . . 0.0 112.694 -174.668 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 . . . . . 0 N--CA 1.451 -0.379 0 C-N-CA 126.573 1.949 . . . . 0.0 109.715 178.129 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 10.7 t80 . . . . . 0 N--CA 1.453 -0.283 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -39.39 148.04 0.15 Allowed Glycine 0 CA--C 1.522 0.521 0 C-N-CA 126.579 2.038 . . . . 0.0 112.139 160.126 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -140.2 130.34 25.0 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 162.339 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -137.07 162.57 33.87 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.18 0 N-CA-C 107.108 -1.441 . . . . 0.0 107.108 -167.095 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -90.56 -16.91 27.9 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 124.501 1.12 . . . . 0.0 112.621 -172.147 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 58.6 t -75.21 134.59 29.01 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 CA-C-N 118.795 0.725 . . . . 0.0 111.799 -157.321 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.2 tmtt? -37.7 106.31 0.05 OUTLIER 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 127.578 2.351 . . . . 0.0 112.104 173.067 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.499 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -75.28 135.22 40.95 Favored 'General case' 0 CA--C 1.515 -0.388 0 C-N-CA 120.332 -0.547 . . . . 0.0 109.915 168.907 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -95.12 -16.37 22.66 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 158.512 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 178.51 166.43 0.83 Allowed 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 106.099 -1.815 . . . . 0.0 106.099 -172.726 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.9 p -61.31 -39.33 90.09 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 124.06 0.944 . . . . 0.0 111.48 172.733 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.6 p -56.83 -40.96 76.99 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 122.86 0.464 . . . . 0.0 111.0 -177.455 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -40.66 -56.87 2.02 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.634 1.174 . . . . 0.0 111.078 170.546 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 23.7 m -57.95 -28.37 64.25 Favored 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 128.026 2.53 . . . . 0.0 109.73 -173.311 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 33.2 m0 -64.65 -66.15 0.58 Allowed 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 107.186 -1.413 . . . . 0.0 107.186 177.534 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -51.67 -33.14 32.54 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 118.085 -0.959 . . . . 0.0 111.696 174.409 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.85 -54.33 36.69 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 120.107 1.321 . . . . 0.0 110.742 175.903 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 5.1 t -58.12 -37.16 74.06 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.071 0.463 . . . . 0.0 110.46 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.419 ' CG ' ' HA3' ' A' ' 25' ' ' GLY . 40.3 mtmt -63.5 -58.71 6.15 Favored 'General case' 0 N--CA 1.44 -0.943 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.706 177.079 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 64.3 mmtt -49.55 -47.12 49.3 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.324 1.05 . . . . 0.0 111.772 178.11 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 43.7 t -70.87 -60.02 2.86 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.77 0 C-N-CA 123.962 0.905 . . . . 0.0 109.15 -178.08 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.2 m -118.58 -41.54 2.81 Favored 'General case' 0 N--CA 1.439 -1.004 0 C-N-CA 123.591 0.756 . . . . 0.0 110.987 -161.103 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 120.81 -21.36 8.44 Favored Glycine 0 CA--C 1.534 1.24 0 C-N-CA 124.925 1.25 . . . . 0.0 112.336 -177.778 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 21.5 m -88.22 61.12 6.09 Favored 'General case' 0 C--O 1.223 -0.297 0 C-N-CA 124.709 1.204 . . . . 0.0 110.331 -160.653 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.419 ' HA3' ' CG ' ' A' ' 19' ' ' LYS . . . -64.15 23.39 0.09 OUTLIER Glycine 0 CA--C 1.54 1.623 0 N-CA-C 120.414 2.926 . . . . 0.0 120.414 -152.626 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -108.38 118.2 36.16 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 121.129 2.465 . . . . 0.0 109.903 -176.3 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -164.04 -170.51 29.06 Favored Glycine 0 CA--C 1.528 0.876 0 N-CA-C 112.195 -0.362 . . . . 0.0 112.195 -174.589 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -156.34 156.08 33.33 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 125.138 1.375 . . . . 0.0 107.879 174.121 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.499 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 0.0 OUTLIER -92.14 160.57 15.13 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 178.485 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.8 tp-100 -133.62 126.69 31.41 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 105.896 -1.89 . . . . 0.0 105.896 165.659 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.2 t30 69.04 -78.91 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 164.79 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -166.63 44.86 0.06 Allowed 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 130.411 3.484 . . . . 0.0 108.894 170.388 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -147.61 179.35 7.75 Favored 'General case' 0 N--CA 1.442 -0.825 0 C-N-CA 128.875 2.87 . . . . 0.0 104.167 177.453 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.432 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 5.0 m -153.94 164.75 37.9 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 119.894 1.224 . . . . 0.0 110.399 -169.422 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 73.4 mtp180 -140.0 152.93 46.68 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 125.651 1.58 . . . . 0.0 108.976 -178.685 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 36.8 t -132.59 162.63 30.8 Favored 'General case' 0 C--O 1.224 -0.26 0 O-C-N 124.652 1.22 . . . . 0.0 109.34 178.791 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.534 0.355 0 CA-C-N 118.651 0.66 . . . . 0.0 111.365 -177.294 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 7.2 m-85 . . . . . 0 CA--C 1.534 0.346 0 CA-C-O 120.805 0.336 . . . . 0.0 110.983 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 138.65 -152.7 22.21 Favored Glycine 0 C--N 1.334 0.448 0 C-N-CA 124.409 1.004 . . . . 0.0 111.035 172.718 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -89.84 149.76 22.53 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 117.427 0.614 . . . . 0.0 111.992 -172.955 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -126.1 167.09 21.13 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.995 0 N-CA-C 105.843 -1.91 . . . . 0.0 105.843 176.973 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -127.72 57.04 1.54 Allowed 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 122.0 0.905 . . . . 0.0 109.892 -177.197 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 43.6 t -128.37 143.8 39.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 N-CA-C 108.231 -1.025 . . . . 0.0 108.231 167.187 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -55.37 132.77 48.94 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 125.19 1.396 . . . . 0.0 113.312 -174.351 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.459 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -86.2 139.1 31.36 Favored 'General case' 0 CA--C 1.516 -0.363 0 C-N-CA 123.12 0.568 . . . . 0.0 109.672 164.107 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -91.01 -20.65 21.87 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 124.171 0.92 . . . . 0.0 109.543 154.497 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -178.91 173.47 1.2 Allowed 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 126.972 2.109 . . . . 0.0 106.273 -172.902 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 31.3 m -64.15 -32.86 74.6 Favored 'General case' 0 N--CA 1.462 0.135 0 C-N-CA 123.668 0.787 . . . . 0.0 112.631 173.332 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -54.12 -54.62 37.0 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 122.134 0.969 . . . . 0.0 110.723 -172.885 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.5 mp0 -32.57 -57.64 0.34 Allowed 'General case' 0 N--CA 1.429 -1.514 0 C-N-CA 128.07 2.548 . . . . 0.0 114.285 168.577 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 14.5 m -54.17 -29.28 45.04 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 126.376 1.87 . . . . 0.0 109.679 -175.839 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 30.9 m0 -66.92 -66.54 0.54 Allowed 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 106.214 -1.772 . . . . 0.0 106.214 -179.694 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -50.36 -32.34 17.08 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 124.018 0.927 . . . . 0.0 111.392 174.815 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.85 -56.42 19.54 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 119.578 1.081 . . . . 0.0 109.732 175.056 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -60.15 -34.05 73.02 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-O 121.048 0.451 . . . . 0.0 111.057 179.478 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 32.6 mtpt -63.72 -54.58 33.2 Favored 'General case' 0 N--CA 1.442 -0.847 0 O-C-N 121.618 -0.676 . . . . 0.0 111.103 176.793 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -57.19 -39.27 75.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.521 178.904 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 31.8 t -73.32 -67.89 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.431 -1.4 0 C-N-CA 124.293 1.037 . . . . 0.0 109.218 179.745 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -107.29 -40.23 5.45 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 122.956 0.502 . . . . 0.0 112.063 -170.481 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 117.61 -15.97 12.64 Favored Glycine 0 CA--C 1.532 1.152 0 C-N-CA 124.608 1.099 . . . . 0.0 110.822 -166.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 30.4 t -82.22 64.82 7.07 Favored 'General case' 0 CA--C 1.527 0.094 0 C-N-CA 124.353 1.061 . . . . 0.0 110.092 -166.568 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -70.97 38.38 0.52 Allowed Glycine 0 CA--C 1.535 1.339 0 N-CA-C 117.916 1.926 . . . . 0.0 117.916 -160.06 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 -121.04 114.07 20.96 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 120.071 1.936 . . . . 0.0 108.58 -179.189 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -158.22 -177.69 31.55 Favored Glycine 0 CA--C 1.523 0.534 0 N-CA-C 111.52 -0.632 . . . . 0.0 111.52 -175.498 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -153.35 145.29 23.62 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 106.922 -1.51 . . . . 0.0 106.922 177.637 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.459 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -88.51 165.88 14.57 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 178.663 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -138.77 118.33 12.98 Favored 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 105.656 -1.979 . . . . 0.0 105.656 171.749 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 63.46 -89.32 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.455 0.702 . . . . 0.0 110.556 172.549 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.2 m120 -153.25 53.65 0.75 Allowed 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 127.001 2.121 . . . . 0.0 107.07 168.142 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -143.62 166.17 25.58 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 103.036 -2.949 . . . . 0.0 103.036 173.038 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.427 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.2 m -143.12 158.31 43.73 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 120.853 1.66 . . . . 0.0 110.257 -174.436 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 33.5 mtp180 -142.82 154.12 43.87 Favored 'General case' 0 CA--C 1.514 -0.433 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 -172.024 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 41.8 t -133.4 140.71 47.49 Favored 'General case' 0 C--N 1.328 -0.331 0 O-C-N 124.16 0.913 . . . . 0.0 110.15 -172.504 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 82.8 t80 . . . . . 0 N--CA 1.455 -0.222 0 C-N-CA 125.568 1.547 . . . . 0.0 109.81 -163.258 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 5.8 m-30 . . . . . 0 CA--C 1.532 0.285 0 CA-C-O 121.04 0.447 . . . . 0.0 111.034 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 123.14 -151.34 16.87 Favored Glycine 0 C--N 1.333 0.37 0 C-N-CA 124.461 1.029 . . . . 0.0 111.749 169.463 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.535 ' HA ' ' HG3' ' A' ' 35' ' ' ARG . 2.5 pt? -109.49 133.74 52.72 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 114.926 1.454 . . . . 0.0 114.926 -159.471 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -138.98 154.2 25.7 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.495 0 N-CA-C 104.348 -2.464 . . . . 0.0 104.348 -165.559 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -122.89 35.16 4.94 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 119.635 1.107 . . . . 0.0 111.089 -171.252 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.3 p -77.43 136.98 23.22 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-N 116.141 -0.481 . . . . 0.0 109.774 172.979 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 37.5 mtpt -66.16 96.01 0.31 Allowed 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.453 1.101 . . . . 0.0 112.221 -175.985 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.526 ' HB3' ' HB2' ' A' ' 29' ' ' CYS . 1.9 p -61.95 131.42 49.64 Favored 'General case' 0 CA--C 1.519 -0.213 0 O-C-N 123.789 0.681 . . . . 0.0 110.847 176.571 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 81.8 m-85 -88.36 -26.64 22.09 Favored 'General case' 0 N--CA 1.444 -0.771 0 C-N-CA 125.627 1.571 . . . . 0.0 108.749 155.194 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -165.87 160.27 16.73 Favored 'General case' 0 C--N 1.344 0.364 0 C-N-CA 123.548 0.739 . . . . 0.0 109.815 179.622 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.513 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 1.9 p -58.26 -41.24 83.81 Favored 'General case' 0 C--N 1.333 -0.118 0 C-N-CA 123.924 0.889 . . . . 0.0 111.404 173.713 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.39 -24.98 63.89 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 122.81 0.444 . . . . 0.0 111.672 -178.332 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 45.1 tt0 -61.85 -44.56 96.58 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 121.708 -0.62 . . . . 0.0 111.204 172.428 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 29.0 m -59.6 -27.91 66.71 Favored 'General case' 0 N--CA 1.439 -0.993 0 C-N-CA 125.687 1.595 . . . . 0.0 108.871 -177.079 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 36.5 m0 -65.98 -67.5 0.44 Allowed 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 107.444 -1.317 . . . . 0.0 107.444 178.91 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -53.26 -28.32 27.03 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.921 0.889 . . . . 0.0 111.57 175.019 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.02 -55.65 17.71 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 119.549 1.068 . . . . 0.0 110.23 174.87 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.2 t -61.08 -32.82 72.47 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 110.439 -0.208 . . . . 0.0 110.439 -179.434 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.6 mtmp? -63.41 -61.39 2.38 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-O 121.156 0.503 . . . . 0.0 110.853 174.782 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 17.1 pttm -59.52 -31.31 69.27 Favored 'General case' 0 N--CA 1.44 -0.964 0 N-CA-C 112.403 0.52 . . . . 0.0 112.403 -174.874 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 53.9 t -79.42 -57.57 5.03 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.514 0 C-N-CA 124.281 1.032 . . . . 0.0 109.865 176.309 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 13.2 t -140.64 25.34 2.19 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 113.753 1.02 . . . . 0.0 113.753 -162.844 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.35 -24.19 0.27 Allowed Glycine 0 CA--C 1.537 1.465 0 O-C-N 120.902 -1.123 . . . . 0.0 115.247 177.219 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 47.4 m -87.92 64.98 8.12 Favored 'General case' 0 C--O 1.223 -0.324 0 O-C-N 121.122 -1.223 . . . . 0.0 110.603 -155.803 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -66.79 23.49 0.18 Allowed Glycine 0 CA--C 1.538 1.513 0 N-CA-C 119.589 2.596 . . . . 0.0 119.589 -154.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -111.7 121.91 46.39 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 120.736 2.268 . . . . 0.0 109.709 -175.078 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -170.82 -166.08 29.15 Favored Glycine 0 C--N 1.337 0.613 0 CA-C-N 118.742 0.701 . . . . 0.0 111.832 -177.675 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.63 155.54 21.94 Favored 'General case' 0 CA--C 1.52 -0.177 0 C-N-CA 124.8 1.24 . . . . 0.0 108.586 174.51 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.526 ' HB2' ' HB3' ' A' ' 8' ' ' CYS . 0.2 OUTLIER -91.37 166.15 13.04 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 -178.594 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -148.79 121.64 8.73 Favored 'General case' 0 C--O 1.22 -0.483 0 N-CA-C 105.345 -2.095 . . . . 0.0 105.345 -179.197 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 57.65 -94.94 0.05 Allowed 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.913 1.233 . . . . 0.0 109.717 178.733 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 21.0 m120 -147.22 61.47 1.17 Allowed 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 126.509 1.924 . . . . 0.0 106.926 165.348 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 21.4 mp0 -147.09 173.64 12.3 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 129.5 3.12 . . . . 0.0 105.062 177.547 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.468 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.7 m -150.52 157.08 42.59 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 -176.683 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.535 ' HG3' ' HA ' ' A' ' 3' ' ' LEU . 0.0 OUTLIER -148.06 143.26 27.07 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 124.213 1.005 . . . . 0.0 109.036 -174.053 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 40.7 t -131.45 148.25 52.63 Favored 'General case' 0 C--N 1.338 0.09 0 O-C-N 123.853 0.72 . . . . 0.0 110.47 -164.385 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 87.7 t80 . . . . . 0 N--CA 1.455 -0.218 0 C-N-CA 125.901 1.68 . . . . 0.0 109.722 -168.276 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 . . . . . 0 N--CA 1.451 -0.4 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 110.59 -152.5 17.39 Favored Glycine 0 CA--C 1.521 0.412 0 C-N-CA 124.071 0.843 . . . . 0.0 112.021 169.805 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.533 ' HA ' ' HG3' ' A' ' 35' ' ' ARG . 2.5 pt? -103.95 136.34 43.78 Favored 'General case' 0 C--N 1.343 0.285 0 N-CA-C 115.184 1.55 . . . . 0.0 115.184 -156.177 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -136.17 159.2 38.78 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.66 0 N-CA-C 103.984 -2.598 . . . . 0.0 103.984 -170.589 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -137.27 47.53 2.1 Favored 'General case' 0 C--N 1.328 -0.354 0 O-C-N 120.901 -1.124 . . . . 0.0 109.234 -173.085 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 87.7 t -97.6 139.35 20.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 171.534 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.72 105.91 0.18 Allowed 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -175.22 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.526 ' HB3' ' HB2' ' A' ' 29' ' ' CYS . 1.2 p -67.64 133.84 50.08 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 169.437 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -78.86 -33.33 45.95 Favored 'General case' 0 N--CA 1.454 -0.236 0 O-C-N 124.335 1.022 . . . . 0.0 109.003 151.613 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -172.76 156.86 3.59 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 124.213 1.005 . . . . 0.0 108.374 -175.33 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.472 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 58.8 m -46.94 -45.88 21.03 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 124.488 1.115 . . . . 0.0 112.617 175.523 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.3 m -63.83 -11.7 29.61 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 -177.464 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.9 -48.41 31.03 Favored 'General case' 0 C--O 1.215 -0.74 0 CA-C-N 119.29 0.95 . . . . 0.0 109.271 168.427 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 18.4 m -48.71 -29.91 4.97 Favored 'General case' 0 CA--C 1.513 -0.473 0 C-N-CA 125.944 1.698 . . . . 0.0 110.1 -178.606 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 42.2 m0 -62.31 -68.09 0.36 Allowed 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 107.01 -1.478 . . . . 0.0 107.01 175.925 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -52.89 -28.51 23.54 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 117.789 -1.101 . . . . 0.0 112.444 173.931 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.3 -53.46 52.49 Favored 'General case' 0 C--O 1.228 -0.065 0 CA-C-N 121.306 1.866 . . . . 0.0 109.903 174.7 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -61.95 -34.14 75.56 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.122 178.535 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 40.8 mtmt -65.31 -52.15 55.93 Favored 'General case' 0 N--CA 1.445 -0.695 0 O-C-N 121.835 -0.541 . . . . 0.0 111.502 176.904 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 65.6 mttt -49.76 -45.95 50.05 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.243 1.417 . . . . 0.0 109.938 177.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 95.1 t -76.79 -69.84 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.424 -1.732 0 C-N-CA 124.252 1.021 . . . . 0.0 109.887 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 47.0 p -98.31 -49.04 4.83 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 122.457 0.303 . . . . 0.0 111.445 -169.975 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 123.35 -17.52 7.91 Favored Glycine 0 CA--C 1.533 1.207 0 C-N-CA 124.961 1.267 . . . . 0.0 111.193 -163.434 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 5.0 m -81.9 64.66 6.69 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 124.483 1.113 . . . . 0.0 110.612 -165.387 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -71.77 38.93 0.63 Allowed Glycine 0 CA--C 1.539 1.539 0 N-CA-C 118.26 2.064 . . . . 0.0 118.26 -155.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -123.27 133.03 54.21 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 120.312 2.056 . . . . 0.0 109.171 -175.605 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 179.01 -164.31 32.51 Favored Glycine 0 CA--C 1.524 0.647 0 CA-C-N 119.24 0.927 . . . . 0.0 111.181 -177.375 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.75 158.07 32.9 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 123.946 0.898 . . . . 0.0 109.108 166.806 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.526 ' HB2' ' HB3' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -91.98 165.32 13.27 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 -178.95 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 -146.42 115.8 7.09 Favored 'General case' 0 N--CA 1.444 -0.761 0 N-CA-C 105.644 -1.984 . . . . 0.0 105.644 179.184 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 71.48 -83.3 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 118.743 0.701 . . . . 0.0 110.325 170.059 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 36.3 m120 -162.35 55.58 0.23 Allowed 'General case' 0 N--CA 1.463 0.181 0 C-N-CA 130.026 3.33 . . . . 0.0 104.639 164.102 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -143.93 174.44 10.84 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 129.278 3.031 . . . . 0.0 103.431 177.009 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.448 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.2 m -154.41 158.67 40.37 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-N 120.525 1.511 . . . . 0.0 108.952 -173.456 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.533 ' HG3' ' HA ' ' A' ' 3' ' ' LEU . 0.0 OUTLIER -147.56 140.58 25.03 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 123.594 0.758 . . . . 0.0 109.684 -173.519 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 41.1 t -122.58 148.55 45.09 Favored 'General case' 0 C--N 1.34 0.195 0 C-N-CA 123.816 0.846 . . . . 0.0 110.49 -168.283 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 90.9 t80 . . . . . 0 N--CA 1.452 -0.359 0 C-N-CA 126.101 1.76 . . . . 0.0 109.846 -173.747 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 2.6 t80 . . . . . 0 N--CA 1.453 -0.297 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -57.59 137.17 49.93 Favored Glycine 0 N--CA 1.445 -0.721 0 N-CA-C 110.212 -1.155 . . . . 0.0 110.212 151.858 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.442 ' HA ' ' HG2' ' A' ' 35' ' ' ARG . 2.4 pt? -145.22 130.8 18.85 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 118.362 1.081 . . . . 0.0 110.49 165.738 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -145.05 160.21 13.67 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.219 0 N-CA-C 106.403 -1.702 . . . . 0.0 106.403 -163.131 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -120.42 32.58 5.95 Favored 'General case' 0 C--N 1.332 -0.159 0 C-N-CA 123.542 0.737 . . . . 0.0 110.737 -173.378 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 97.0 t -82.88 133.87 28.15 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 N-CA-C 108.115 -1.069 . . . . 0.0 108.115 171.681 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.1 mtpp -65.26 94.24 0.16 Allowed 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 125.701 1.6 . . . . 0.0 112.057 -173.606 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.498 ' HB3' ' HB2' ' A' ' 29' ' ' CYS . 1.7 p -58.44 136.02 57.38 Favored 'General case' 0 N--CA 1.464 0.238 0 O-C-N 123.436 0.46 . . . . 0.0 110.616 173.517 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 82.0 m-85 -91.09 -27.25 18.7 Favored 'General case' 0 N--CA 1.445 -0.697 0 C-N-CA 126.592 1.957 . . . . 0.0 108.306 152.666 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -158.68 162.05 37.17 Favored 'General case' 0 C--N 1.344 0.329 0 CA-C-N 118.605 0.639 . . . . 0.0 110.834 179.087 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.502 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 1.8 p -61.88 -45.07 95.36 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 124.875 1.27 . . . . 0.0 111.234 173.003 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.9 p -55.04 -32.25 61.72 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 121.178 0.513 . . . . 0.0 111.092 -178.147 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 48.7 tt0 -51.98 -48.78 64.23 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 123.607 0.763 . . . . 0.0 111.937 172.493 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 32.9 m -56.62 -30.42 63.25 Favored 'General case' 0 N--CA 1.444 -0.774 0 C-N-CA 126.606 1.962 . . . . 0.0 109.006 -177.985 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 32.2 m0 -64.56 -64.08 0.97 Allowed 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 107.494 -1.299 . . . . 0.0 107.494 179.832 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -51.6 -35.41 41.39 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 118.385 -0.817 . . . . 0.0 111.463 173.563 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.66 -56.15 18.0 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 119.872 1.214 . . . . 0.0 110.559 -179.038 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -57.71 -36.55 72.14 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.37 0.605 . . . . 0.0 110.472 179.32 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.452 ' CG ' ' HA3' ' A' ' 25' ' ' GLY . 1.7 mtmp? -62.8 -50.74 69.8 Favored 'General case' 0 N--CA 1.435 -1.202 0 CA-C-N 115.589 -0.732 . . . . 0.0 112.442 177.507 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 65.9 mmtt -50.22 -52.99 31.29 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 123.66 0.784 . . . . 0.0 111.024 178.272 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -67.93 -63.95 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 CA-C-N 118.177 0.444 . . . . 0.0 111.651 177.537 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.9 m -116.92 -37.79 3.54 Favored 'General case' 0 N--CA 1.442 -0.838 0 C-N-CA 123.581 0.753 . . . . 0.0 110.465 -155.652 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 116.94 -14.83 13.92 Favored Glycine 0 CA--C 1.531 1.055 0 C-N-CA 123.196 0.427 . . . . 0.0 113.183 -178.757 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.7 t -82.04 67.29 7.98 Favored 'General case' 0 N--CA 1.465 0.313 0 O-C-N 121.601 -0.94 . . . . 0.0 109.621 -166.663 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.452 ' HA3' ' CG ' ' A' ' 19' ' ' LYS . . . -74.08 37.08 0.93 Allowed Glycine 0 CA--C 1.537 1.457 0 N-CA-C 116.964 1.546 . . . . 0.0 116.964 -159.407 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -122.65 126.71 48.16 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 125.814 1.645 . . . . 0.0 107.522 -175.481 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -179.37 -172.43 43.54 Favored Glycine 0 CA--C 1.525 0.663 0 CA-C-N 119.246 0.93 . . . . 0.0 111.922 -176.091 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.28 157.13 42.73 Favored 'General case' 0 C--O 1.232 0.135 0 C-N-CA 125.62 1.568 . . . . 0.0 107.457 166.878 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.502 ' HB3' ' HA ' ' A' ' 11' ' ' SER . 0.5 OUTLIER -89.74 151.63 21.73 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 178.474 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 54.7 tp60 -124.09 112.88 17.65 Favored 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 105.923 -1.88 . . . . 0.0 105.923 177.85 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 62.95 -89.77 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 119.256 0.934 . . . . 0.0 110.099 174.567 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -150.28 56.22 0.94 Allowed 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 126.713 2.005 . . . . 0.0 107.916 164.128 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -135.55 179.75 6.14 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 129.313 3.045 . . . . 0.0 103.953 166.047 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.455 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.2 m -150.43 147.44 27.55 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-N 119.457 1.026 . . . . 0.0 109.319 -178.265 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.442 ' HG2' ' HA ' ' A' ' 3' ' ' LEU . 41.7 mtt180 -140.18 136.59 33.61 Favored 'General case' 0 CA--C 1.513 -0.464 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 -173.407 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.8 t -126.16 167.46 15.38 Favored 'General case' 0 C--O 1.225 -0.187 0 O-C-N 124.577 1.173 . . . . 0.0 110.103 -162.929 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 28.6 t80 . . . . . 0 N--CA 1.452 -0.333 0 C-N-CA 124.394 1.078 . . . . 0.0 109.429 166.65 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 . . . . . 0 N--CA 1.45 -0.434 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 124.64 -135.7 9.64 Favored Glycine 0 C--N 1.335 0.477 0 CA-C-O 118.742 -1.032 . . . . 0.0 111.581 167.957 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -110.25 144.2 39.29 Favored 'General case' 0 CA--C 1.519 -0.219 0 C-N-CA 124.224 1.009 . . . . 0.0 112.759 -165.781 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -132.15 171.13 18.57 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.208 0 N-CA-C 106.17 -1.789 . . . . 0.0 106.17 -170.382 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -133.42 83.44 2.05 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-O 122.26 1.028 . . . . 0.0 110.249 168.451 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 93.5 t -125.78 138.67 53.74 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 CA-C-N 113.956 -1.474 . . . . 0.0 107.374 160.819 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -68.58 106.25 2.52 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 124.495 1.118 . . . . 0.0 111.32 -169.34 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.522 ' HB3' ' HB2' ' A' ' 29' ' ' CYS . 5.8 p -66.67 130.44 43.18 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 120.784 0.326 . . . . 0.0 110.965 174.301 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -78.95 -36.21 41.99 Favored 'General case' 0 N--CA 1.442 -0.832 0 C-N-CA 125.351 1.46 . . . . 0.0 108.124 148.069 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -161.47 154.71 21.17 Favored 'General case' 0 C--O 1.222 -0.359 0 CA-C-N 118.44 0.563 . . . . 0.0 112.008 -177.451 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.507 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 27.9 m -50.75 -41.08 56.19 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 123.862 0.865 . . . . 0.0 112.583 173.606 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.31 -20.08 57.82 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 123.058 0.543 . . . . 0.0 112.292 -179.0 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 70.7 tt0 -72.03 -44.03 64.03 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 124.083 0.953 . . . . 0.0 110.79 176.05 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 20.8 m -55.16 -29.48 57.87 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 126.635 1.974 . . . . 0.0 108.874 179.21 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 36.1 m0 -64.83 -68.42 0.36 Allowed 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 179.288 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -54.71 -26.51 34.21 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 123.909 0.884 . . . . 0.0 111.557 175.938 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.14 -55.5 18.33 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 119.943 1.247 . . . . 0.0 109.806 174.003 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 3.8 t -55.16 -38.68 68.59 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.974 0.892 . . . . 0.0 110.278 178.579 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.9 mtmt -63.23 -53.6 50.5 Favored 'General case' 0 N--CA 1.434 -1.235 0 CA-C-N 115.159 -0.928 . . . . 0.0 110.519 177.133 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -52.98 -40.96 64.13 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 116.924 -1.512 . . . . 0.0 113.119 -179.007 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -67.98 -60.74 2.18 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 CA-C-N 119.314 0.961 . . . . 0.0 111.318 169.665 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 47.5 p -113.54 -65.96 1.13 Allowed 'General case' 0 N--CA 1.458 -0.065 0 CA-C-O 121.306 0.575 . . . . 0.0 110.45 -168.168 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 148.17 -23.05 1.41 Allowed Glycine 0 CA--C 1.529 0.963 0 CA-C-N 115.137 -0.938 . . . . 0.0 113.171 -170.757 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.2 p -82.44 72.36 9.51 Favored 'General case' 0 C--N 1.333 -0.139 0 O-C-N 121.553 -0.969 . . . . 0.0 109.666 -168.875 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -70.51 50.91 0.83 Allowed Glycine 0 CA--C 1.537 1.452 0 N-CA-C 117.034 1.574 . . . . 0.0 117.034 -163.057 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 54.9 mt-30 -131.53 101.9 5.7 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 125.421 1.488 . . . . 0.0 109.788 -165.188 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -161.82 -165.85 19.49 Favored Glycine 0 CA--C 1.525 0.681 0 CA-C-N 118.242 0.474 . . . . 0.0 113.467 -170.798 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 20.6 ttmm -162.98 144.91 10.14 Favored 'General case' 0 C--O 1.232 0.164 0 N-CA-C 107.403 -1.332 . . . . 0.0 107.403 178.853 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.522 ' HB2' ' HB3' ' A' ' 8' ' ' CYS . 0.5 OUTLIER -87.64 162.19 17.27 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 -179.54 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.4 tp-100 -143.27 132.71 23.47 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 106.929 -1.508 . . . . 0.0 106.929 171.221 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 64.08 -91.26 0.03 OUTLIER 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 123.214 0.606 . . . . 0.0 109.975 170.065 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 23.2 m120 -155.42 62.92 0.61 Allowed 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 127.608 2.363 . . . . 0.0 105.781 158.234 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 17.2 mp0 -147.69 179.46 7.68 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 130.951 3.701 . . . . 0.0 103.983 174.267 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.444 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.5 m -152.84 161.17 42.89 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 121.11 -0.994 . . . . 0.0 109.572 -174.598 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.8 mtt85 -138.05 152.83 49.2 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 124.416 1.086 . . . . 0.0 109.26 179.406 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 53.5 t -136.45 137.72 40.72 Favored 'General case' 0 CA--C 1.522 -0.132 0 C-N-CA 124.317 1.047 . . . . 0.0 108.314 179.828 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.141 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 -153.933 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 13.8 t80 . . . . . 0 CA--C 1.533 0.311 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -47.35 -178.08 0.01 OUTLIER Glycine 0 CA--C 1.531 1.053 0 C-N-CA 128.813 3.101 . . . . 0.0 112.862 166.423 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -155.57 128.45 8.03 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 106.592 -1.633 . . . . 0.0 106.592 150.424 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -139.41 159.21 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.176 0 N-CA-C 106.432 -1.692 . . . . 0.0 106.432 -174.212 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -92.89 -9.67 39.33 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.253 1.021 . . . . 0.0 112.244 -171.5 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 59.2 t -72.09 134.37 30.01 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 C-N-CA 119.953 -0.699 . . . . 0.0 110.55 -160.777 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -58.08 101.2 0.07 Allowed 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 125.568 1.547 . . . . 0.0 111.531 -174.385 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.464 ' HB3' ' HB2' ' A' ' 29' ' ' CYS . 0.5 OUTLIER -68.25 129.13 39.0 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 109.265 -0.642 . . . . 0.0 109.265 168.869 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -91.7 -16.8 26.41 Favored 'General case' 0 N--CA 1.454 -0.258 0 O-C-N 124.353 1.033 . . . . 0.0 109.316 150.437 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -169.7 148.15 3.59 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 123.701 0.801 . . . . 0.0 109.069 -178.698 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.517 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 27.1 m -47.37 -39.64 15.65 Favored 'General case' 0 N--CA 1.46 0.034 0 C-N-CA 124.551 1.14 . . . . 0.0 112.092 170.899 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.2 p -61.37 -22.93 65.41 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-O 118.889 -0.577 . . . . 0.0 112.25 -177.933 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.86 -47.88 56.9 Favored 'General case' 0 C--O 1.216 -0.678 0 CA-C-N 119.437 1.017 . . . . 0.0 109.283 174.372 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 27.5 m -47.9 -28.32 2.6 Favored 'General case' 0 CA--C 1.512 -0.513 0 C-N-CA 126.227 1.811 . . . . 0.0 110.441 -177.486 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 39.0 m0 -64.34 -67.79 0.4 Allowed 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.339 -1.3 . . . . 0.0 107.735 176.633 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -52.24 -27.95 16.81 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-O 118.164 -0.922 . . . . 0.0 111.725 172.878 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.07 -61.57 1.97 Allowed 'General case' 0 C--N 1.339 0.151 0 CA-C-N 121.035 1.743 . . . . 0.0 110.986 175.929 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -57.81 -30.41 65.68 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.249 0.547 . . . . 0.0 110.533 179.295 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.7 mtmt -67.89 -49.72 60.36 Favored 'General case' 0 N--CA 1.443 -0.79 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 172.742 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 51.6 mttt -50.21 -49.64 52.07 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 124.695 1.198 . . . . 0.0 109.789 178.771 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -67.45 -67.21 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 CA-C-N 118.146 0.43 . . . . 0.0 111.412 173.762 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 18.5 m -114.26 -49.46 2.84 Favored 'General case' 0 N--CA 1.438 -1.046 0 C-N-CA 123.255 0.622 . . . . 0.0 110.425 -158.045 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 133.16 -15.79 4.74 Favored Glycine 0 CA--C 1.533 1.189 0 C-N-CA 123.013 0.339 . . . . 0.0 112.829 -171.729 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.0 m -79.27 61.74 3.44 Favored 'General case' 0 C--O 1.225 -0.191 0 C-N-CA 124.393 1.077 . . . . 0.0 111.868 -164.624 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -70.67 1.6 21.16 Favored Glycine 0 CA--C 1.536 1.36 0 N-CA-C 116.159 1.223 . . . . 0.0 116.159 -158.71 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 60.0 mt-30 -90.66 110.81 21.98 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 119.846 1.823 . . . . 0.0 108.14 -176.631 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -164.44 -161.93 14.45 Favored Glycine 0 C--N 1.337 0.638 0 CA-C-N 118.741 0.701 . . . . 0.0 114.672 -170.879 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 6.9 mttp -169.29 150.58 4.35 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 123.935 0.894 . . . . 0.0 109.175 -175.179 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.517 ' HB3' ' HA ' ' A' ' 11' ' ' SER . 0.1 OUTLIER -94.32 160.47 14.66 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.932 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.0 tt0 -134.6 131.69 38.14 Favored 'General case' 0 N--CA 1.444 -0.767 0 N-CA-C 105.296 -2.113 . . . . 0.0 105.296 165.974 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 21.1 t30 67.22 -90.81 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 118.713 0.688 . . . . 0.0 110.574 163.522 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 31.1 m120 -156.16 53.83 0.56 Allowed 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 127.968 2.507 . . . . 0.0 106.107 164.032 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 25.0 mp0 -151.05 176.9 10.7 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 129.391 3.076 . . . . 0.0 103.818 -179.802 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.6 m -160.41 167.84 26.46 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 120.21 1.368 . . . . 0.0 111.137 -165.47 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 33.6 mtp180 -146.58 160.83 41.66 Favored 'General case' 0 CA--C 1.518 -0.266 0 C-N-CA 125.054 1.342 . . . . 0.0 109.255 179.809 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 29.0 p -131.32 177.89 7.13 Favored 'General case' 0 CA--C 1.513 -0.445 0 O-C-N 124.507 1.129 . . . . 0.0 109.88 162.399 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 3.8 p90 . . . . . 0 N--CA 1.446 -0.633 0 C-N-CA 124.197 0.999 . . . . 0.0 111.879 -172.356 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 79.5 t80 . . . . . 0 N--CA 1.453 -0.319 0 CA-C-O 122.021 0.915 . . . . 0.0 110.357 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -63.31 139.68 44.32 Favored Glycine 0 N--CA 1.449 -0.484 0 N-CA-C 108.236 -1.946 . . . . 0.0 108.236 167.169 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -145.62 127.97 15.87 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 119.208 1.504 . . . . 0.0 110.582 163.889 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -143.61 158.92 16.74 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.205 0 N-CA-C 106.063 -1.828 . . . . 0.0 106.063 -160.551 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -120.39 30.22 7.06 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 121.745 0.783 . . . . 0.0 112.352 -174.226 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 52.4 t -85.79 134.42 27.26 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 171.787 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.6 mptt -69.82 107.29 3.46 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 125.443 1.497 . . . . 0.0 112.056 -165.181 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.501 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -63.3 126.16 26.51 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 123.896 0.878 . . . . 0.0 109.968 171.219 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -82.73 -21.55 34.72 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 124.873 1.358 . . . . 0.0 109.173 153.128 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -175.64 179.24 1.45 Allowed 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 126.174 1.79 . . . . 0.0 106.588 -176.156 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 39.7 m -70.98 -34.02 70.99 Favored 'General case' 0 N--CA 1.461 0.104 0 C-N-CA 125.497 1.519 . . . . 0.0 113.093 173.779 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -52.88 -56.3 16.84 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-O 122.065 0.936 . . . . 0.0 110.963 -172.36 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . 0.269 8.4 mp0 -20.97 -59.44 0.03 OUTLIER 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 128.93 2.892 . . . . 0.0 115.761 159.4 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 31.6 m -61.08 -27.29 68.25 Favored 'General case' 0 N--CA 1.442 -0.828 0 C-N-CA 125.706 1.602 . . . . 0.0 109.09 -172.295 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 35.9 m0 -69.7 -64.85 0.8 Allowed 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 -179.007 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -52.78 -30.79 34.96 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 124.049 0.939 . . . . 0.0 110.869 174.76 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.22 -57.98 8.71 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 119.385 0.993 . . . . 0.0 110.329 173.615 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -59.21 -32.21 69.73 Favored 'General case' 0 CA--C 1.521 -0.15 0 O-C-N 121.989 -0.444 . . . . 0.0 111.063 -179.461 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.465 ' CG ' ' HA3' ' A' ' 25' ' ' GLY . 30.6 mtmt -64.95 -57.09 9.65 Favored 'General case' 0 N--CA 1.437 -1.122 0 CA-C-O 120.797 0.332 . . . . 0.0 111.1 176.2 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.2 mtpt -56.46 -38.27 71.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.591 -179.858 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 40.6 t -70.03 -61.94 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.427 -1.615 0 C-N-CA 123.848 0.859 . . . . 0.0 109.172 176.948 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.2 m -120.6 -45.69 2.4 Favored 'General case' 0 N--CA 1.436 -1.137 0 C-N-CA 123.628 0.771 . . . . 0.0 111.16 -162.877 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 126.26 -20.05 6.3 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 124.636 1.112 . . . . 0.0 111.997 -173.376 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 31.0 t -84.23 65.58 8.89 Favored 'General case' 0 C--N 1.333 -0.145 0 C-N-CA 124.691 1.197 . . . . 0.0 109.636 -166.136 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.465 ' HA3' ' CG ' ' A' ' 19' ' ' LYS . . . -71.03 40.27 0.55 Allowed Glycine 0 CA--C 1.533 1.183 0 N-CA-C 117.539 1.776 . . . . 0.0 117.539 -160.084 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -129.19 123.95 33.34 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 120.093 1.947 . . . . 0.0 109.261 -175.186 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -177.05 -166.22 33.64 Favored Glycine 0 C--N 1.335 0.507 0 N-CA-C 110.109 -1.196 . . . . 0.0 110.109 -175.543 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 6.7 mtmp? -153.89 166.02 34.26 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 124.492 1.117 . . . . 0.0 108.074 164.435 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.501 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -85.58 165.06 17.37 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 176.845 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -136.95 128.81 29.09 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 105.703 -1.962 . . . . 0.0 105.703 165.117 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 67.68 -89.9 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 123.238 0.615 . . . . 0.0 110.397 166.577 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 31.9 m120 -154.58 58.38 0.69 Allowed 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 127.314 2.246 . . . . 0.0 105.899 161.256 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 19.7 mp0 -151.15 176.45 11.17 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 129.288 3.035 . . . . 0.0 104.18 179.121 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.455 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.7 m -154.83 153.99 32.05 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-N 120.324 1.42 . . . . 0.0 110.73 -169.743 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 17.4 mtt180 -145.11 128.26 16.67 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 124.048 0.939 . . . . 0.0 110.204 -168.731 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -99.79 161.71 13.45 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 123.332 0.653 . . . . 0.0 111.453 178.039 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.454 -0.232 0 C-N-CA 123.811 0.844 . . . . 0.0 111.284 -171.272 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 . . . . . 0 C--O 1.233 0.219 0 CA-C-O 120.321 0.105 . . . . 0.0 110.966 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -42.35 142.95 1.33 Allowed Glycine 0 C--N 1.337 0.613 0 CA-C-O 118.796 -1.002 . . . . 0.0 111.325 172.282 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -141.9 129.2 21.1 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 106.439 -1.689 . . . . 0.0 106.439 167.016 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -131.73 -175.63 1.49 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.726 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 -165.742 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -141.58 83.81 1.88 Allowed 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 122.081 0.943 . . . . 0.0 110.86 161.07 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 80.5 t -130.14 134.57 62.51 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 N-CA-C 105.6 -2.0 . . . . 0.0 105.6 160.554 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.0 mptt -68.91 111.19 4.8 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 124.642 1.177 . . . . 0.0 110.263 -169.333 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.503 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -61.23 126.96 29.26 Favored 'General case' 0 CA--C 1.515 -0.376 0 C-N-CA 122.725 0.41 . . . . 0.0 110.191 175.518 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -89.67 -15.77 31.91 Favored 'General case' 0 N--CA 1.449 -0.488 0 O-C-N 125.003 1.439 . . . . 0.0 109.598 157.51 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 179.33 153.05 0.42 Allowed 'General case' 0 C--N 1.344 0.359 0 C-N-CA 125.485 1.514 . . . . 0.0 108.604 -177.146 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.523 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 24.4 m -54.95 -37.48 66.51 Favored 'General case' 0 N--CA 1.462 0.165 0 C-N-CA 123.056 0.542 . . . . 0.0 112.162 171.906 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.45 -23.18 64.22 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-O 119.427 -0.32 . . . . 0.0 111.765 179.076 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -67.46 -50.78 57.66 Favored 'General case' 0 C--O 1.217 -0.627 0 CA-C-N 118.655 0.661 . . . . 0.0 109.562 175.071 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 23.7 m -49.32 -27.31 3.79 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 126.108 1.763 . . . . 0.0 110.655 -177.108 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 31.2 m0 -63.36 -65.96 0.61 Allowed 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 114.821 -1.081 . . . . 0.0 108.192 173.271 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -52.95 -31.51 40.85 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-O 117.716 -1.135 . . . . 0.0 111.585 174.084 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.47 -55.46 27.43 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 121.686 2.039 . . . . 0.0 110.477 173.801 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 2.0 t -54.53 -37.46 65.41 Favored 'General case' 0 CA--C 1.527 0.087 0 C-N-CA 123.088 0.555 . . . . 0.0 109.858 178.259 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.7 mtpt -66.7 -54.24 25.16 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-O 121.351 0.596 . . . . 0.0 111.784 177.563 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 20.1 mtpp -53.75 -38.65 64.61 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 124.659 1.184 . . . . 0.0 110.25 -179.413 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 54.1 t -76.07 -61.63 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.426 -1.632 0 C-N-CA 124.734 1.214 . . . . 0.0 110.051 177.715 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 11.4 t -134.52 13.47 3.77 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 114.166 1.173 . . . . 0.0 114.166 -162.753 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 76.17 -26.19 1.53 Allowed Glycine 0 CA--C 1.537 1.424 0 O-C-N 120.317 -1.489 . . . . 0.0 114.259 178.658 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.4 m -81.17 62.8 5.26 Favored 'General case' 0 C--O 1.223 -0.333 0 C-N-CA 125.451 1.5 . . . . 0.0 111.511 -162.621 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -66.73 49.44 0.22 Allowed Glycine 0 CA--C 1.54 1.647 0 N-CA-C 119.023 2.369 . . . . 0.0 119.023 -156.807 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -130.92 118.71 21.08 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 120.477 2.139 . . . . 0.0 109.945 -173.419 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -172.98 -164.95 29.21 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 111.357 -0.697 . . . . 0.0 111.357 -177.378 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 58.4 mttt -160.56 161.13 32.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 124.882 1.273 . . . . 0.0 108.582 169.531 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.523 ' HB3' ' HA ' ' A' ' 11' ' ' SER . 0.1 OUTLIER -92.18 162.34 14.36 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 -177.674 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.7 tp-100 -133.55 133.72 42.47 Favored 'General case' 0 N--CA 1.444 -0.733 0 N-CA-C 106.069 -1.826 . . . . 0.0 106.069 166.407 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 63.55 -87.63 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 117.971 0.35 . . . . 0.0 111.64 168.084 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -161.02 63.94 0.29 Allowed 'General case' 0 C--O 1.227 -0.118 0 C-N-CA 129.681 3.192 . . . . 0.0 104.169 165.259 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -161.64 174.58 13.11 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 129.279 3.032 . . . . 0.0 103.007 -177.759 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.415 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.7 m -153.65 160.61 42.44 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 121.199 1.818 . . . . 0.0 111.075 -169.112 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 63.8 mtp180 -139.43 151.12 45.99 Favored 'General case' 0 CA--C 1.511 -0.554 0 C-N-CA 125.351 1.461 . . . . 0.0 108.812 178.559 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -154.5 154.32 32.95 Favored 'General case' 0 C--N 1.333 -0.124 0 O-C-N 124.117 0.886 . . . . 0.0 112.562 -178.885 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.243 0 CA-C-O 120.962 0.41 . . . . 0.0 111.037 -174.171 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.3 pt? . . . . . 0 N--CA 1.449 -0.492 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -136.14 167.38 24.68 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.171 0 N-CA-C 106.563 -1.644 . . . . 0.0 106.563 -164.342 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -129.68 88.38 2.67 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 122.193 0.997 . . . . 0.0 108.718 162.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 99.1 t -133.23 137.9 52.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 159.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.4 mptt -41.04 107.66 0.08 Allowed 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 127.217 2.207 . . . . 0.0 112.746 178.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.501 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -68.16 133.57 49.11 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 167.231 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -93.62 -15.07 25.74 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 158.154 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 176.25 155.91 0.23 Allowed 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 125.902 1.681 . . . . 0.0 107.832 -175.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 40.6 m -51.46 -39.62 57.83 Favored 'General case' 0 C--O 1.227 -0.12 0 C-N-CA 123.006 0.522 . . . . 0.0 111.724 171.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.9 p -62.8 -20.21 64.79 Favored 'General case' 0 N--CA 1.445 -0.716 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -178.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.25 -49.2 36.87 Favored 'General case' 0 C--O 1.218 -0.569 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 175.107 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 20.3 m -46.63 -29.64 1.94 Allowed 'General case' 0 CA--C 1.503 -0.853 0 C-N-CA 126.106 1.762 . . . . 0.0 110.138 178.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 31.5 m0 -63.59 -66.06 0.59 Allowed 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 176.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -51.37 -35.95 40.98 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 118.455 -0.783 . . . . 0.0 111.75 174.776 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.08 -57.05 11.92 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 120.243 1.383 . . . . 0.0 111.376 177.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 17.7 m -58.8 -33.78 70.75 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 122.232 1.015 . . . . 0.0 110.895 -179.531 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.5 mtmt -69.23 -42.78 75.22 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-N 115.178 -0.919 . . . . 0.0 113.143 175.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 41.7 mttm -54.28 -53.8 48.83 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.519 0.328 . . . . 0.0 110.359 174.317 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -62.78 -57.14 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 178.339 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 60.2 p -116.4 -57.24 2.22 Favored 'General case' 0 CA--C 1.522 -0.117 0 CA-C-O 121.185 0.517 . . . . 0.0 110.897 -169.136 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 130.29 -15.19 5.57 Favored Glycine 0 CA--C 1.532 1.136 0 CA-C-N 114.874 -1.057 . . . . 0.0 112.07 -161.325 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 58.0 p -79.11 63.28 3.73 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 118.659 1.229 . . . . 0.0 111.049 -171.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -69.0 2.3 8.8 Favored Glycine 0 CA--C 1.533 1.187 0 O-C-N 121.517 -0.739 . . . . 0.0 114.916 -164.556 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 30.8 mt-30 -85.93 105.52 16.46 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 119.158 1.479 . . . . 0.0 107.375 -177.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -158.45 -172.81 26.06 Favored Glycine 0 CA--C 1.524 0.645 0 CA-C-O 121.148 0.304 . . . . 0.0 112.908 -172.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 4.4 ttmm -159.84 143.34 14.24 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 125.398 1.479 . . . . 0.0 107.658 -174.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . 0.501 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -89.39 151.43 22.05 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 177.41 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 56.7 tp60 -125.31 116.9 22.66 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 105.079 -2.193 . . . . 0.0 105.079 172.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 66.04 -82.37 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 118.911 0.778 . . . . 0.0 111.481 168.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -157.9 43.29 0.31 Allowed 'General case' 0 N--CA 1.444 -0.727 0 C-N-CA 128.423 2.689 . . . . 0.0 109.649 171.214 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 26.5 mp0 -141.65 178.42 7.48 Favored 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 128.006 2.522 . . . . 0.0 105.091 172.802 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.408 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 0.9 OUTLIER -159.27 152.47 22.31 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 119.185 0.902 . . . . 0.0 110.16 -164.444 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 8.8 mtt180 -146.29 132.87 19.81 Favored 'General case' 0 C--O 1.227 -0.09 0 CA-C-O 118.415 -0.802 . . . . 0.0 110.087 -167.354 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -102.91 164.17 11.78 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 123.712 0.805 . . . . 0.0 111.225 168.273 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 71.4 t80 . . . . . 0 N--CA 1.451 -0.392 0 C-N-CA 126.816 2.046 . . . . 0.0 109.384 177.98 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.5 pt? . . . . . 0 N--CA 1.448 -0.57 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -136.87 178.25 5.08 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.018 0 N-CA-C 107.429 -1.322 . . . . 0.0 107.429 -166.421 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 49.6 t0 -130.19 102.29 6.16 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 154.301 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -130.97 148.31 33.06 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 N-CA-C 105.995 -1.854 . . . . 0.0 105.995 148.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 42.7 mttm -64.57 115.46 5.21 Favored 'General case' 0 N--CA 1.444 -0.735 0 C-N-CA 123.828 0.851 . . . . 0.0 110.866 -170.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.548 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -73.22 119.55 17.62 Favored 'General case' 0 CA--C 1.511 -0.536 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 175.296 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -79.79 -22.88 42.57 Favored 'General case' 0 N--CA 1.449 -0.496 0 O-C-N 125.495 1.747 . . . . 0.0 109.078 156.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 178.97 154.17 0.41 Allowed 'General case' 0 C--N 1.344 0.344 0 C-N-CA 125.405 1.482 . . . . 0.0 108.751 -175.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.514 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 19.0 m -52.79 -38.71 61.52 Favored 'General case' 0 C--O 1.231 0.105 0 C-N-CA 123.321 0.649 . . . . 0.0 112.38 171.655 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.31 -22.28 64.75 Favored 'General case' 0 N--CA 1.445 -0.68 0 C-N-CA 122.721 0.408 . . . . 0.0 111.925 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.07 -51.11 34.51 Favored 'General case' 0 C--O 1.22 -0.489 0 CA-C-O 121.329 0.585 . . . . 0.0 109.506 176.063 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 20.8 m -47.6 -28.61 2.41 Favored 'General case' 0 CA--C 1.51 -0.579 0 C-N-CA 126.361 1.864 . . . . 0.0 110.444 -179.122 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 27.0 m0 -61.79 -68.55 0.31 Allowed 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 173.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -50.99 -32.47 21.25 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 117.945 -1.026 . . . . 0.0 112.308 174.852 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.01 -51.19 67.78 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 120.88 1.673 . . . . 0.0 110.831 173.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 2.0 t -60.79 -35.84 77.48 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 121.444 0.64 . . . . 0.0 109.813 178.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.3 mtpt -63.19 -50.61 69.66 Favored 'General case' 0 N--CA 1.44 -0.941 0 O-C-N 121.477 -0.765 . . . . 0.0 110.331 176.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 39.6 tptt -52.12 -45.3 64.87 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 124.452 1.101 . . . . 0.0 111.205 178.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 43.6 t -75.01 -63.14 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.428 -1.561 0 C-N-CA 124.646 1.178 . . . . 0.0 109.732 -178.328 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -110.3 -35.12 6.16 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.817 0.847 . . . . 0.0 112.421 -166.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 108.76 -23.21 24.49 Favored Glycine 0 CA--C 1.532 1.106 0 N-CA-C 110.6 -1.0 . . . . 0.0 110.6 -170.321 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 13.6 m -81.91 66.63 7.57 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 125.595 1.558 . . . . 0.0 110.046 -167.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -67.49 47.61 0.29 Allowed Glycine 0 CA--C 1.54 1.64 0 N-CA-C 117.98 1.952 . . . . 0.0 117.98 -160.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -132.38 98.61 4.43 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 119.951 1.875 . . . . 0.0 110.594 -163.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -159.17 -163.6 13.36 Favored Glycine 0 CA--C 1.525 0.702 0 CA-C-O 119.838 -0.423 . . . . 0.0 113.339 -172.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -158.65 160.17 36.2 Favored 'General case' 0 C--O 1.232 0.184 0 C-N-CA 126.997 2.119 . . . . 0.0 107.636 169.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . 0.548 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -91.13 160.89 15.33 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 178.406 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -136.96 126.02 24.44 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 173.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 6.2 m120 64.43 -82.64 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.647 1.179 . . . . 0.0 110.616 174.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -163.63 43.89 0.11 Allowed 'General case' 0 N--CA 1.441 -0.899 0 C-N-CA 127.47 2.308 . . . . 0.0 106.155 172.093 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 7.8 mp0 -139.79 -177.82 5.14 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 129.911 3.285 . . . . 0.0 103.84 175.278 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.442 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.5 m -150.11 160.41 43.68 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 120.328 1.422 . . . . 0.0 111.897 -171.57 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 51.3 mtp180 -144.94 147.96 33.3 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 124.139 0.975 . . . . 0.0 108.385 -172.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 48.0 t -133.95 159.71 39.9 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.45 -0.474 0 CA-C-N 118.464 0.574 . . . . 0.0 110.858 -173.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.6 pt? . . . . . 0 N--CA 1.454 -0.257 0 N-CA-C 106.317 -1.735 . . . . 0.0 106.317 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.3 pt -145.35 151.47 15.04 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.48 0 N-CA-C 104.828 -2.286 . . . . 0.0 104.828 -152.024 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -108.65 86.91 2.37 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 170.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 19.6 m -121.16 135.84 60.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 114.052 -1.431 . . . . 0.0 108.249 157.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -73.03 95.44 2.01 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 124.082 0.953 . . . . 0.0 111.525 -167.62 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.489 ' HB3' ' HB2' ' A' ' 29' ' ' CYS . 1.6 p -64.92 131.04 45.6 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.706 -177.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -87.15 -25.72 23.95 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 124.26 0.975 . . . . 0.0 109.468 151.151 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -164.09 167.62 20.07 Favored 'General case' 0 C--O 1.223 -0.291 0 C-N-CA 123.748 0.819 . . . . 0.0 109.186 -178.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.445 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 1.7 p -59.13 -37.48 77.32 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 125.15 1.38 . . . . 0.0 112.179 174.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.5 p -56.25 -36.33 68.42 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 121.287 0.565 . . . . 0.0 111.581 -176.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -39.59 -53.37 2.13 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 125.37 1.468 . . . . 0.0 111.947 168.002 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.7 m -67.94 -31.07 70.56 Favored 'General case' 0 N--CA 1.439 -0.996 0 C-N-CA 127.76 2.424 . . . . 0.0 108.813 -173.365 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 33.3 m0 -65.1 -63.36 1.12 Allowed 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 106.227 -1.768 . . . . 0.0 106.227 176.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 1.3 p -53.69 -31.02 46.31 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 119.026 -0.512 . . . . 0.0 111.573 177.062 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.8 -57.54 10.52 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 119.371 0.987 . . . . 0.0 110.72 174.3 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -58.85 -34.77 71.97 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 122.171 0.986 . . . . 0.0 110.583 -178.739 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.9 mtpm? -62.54 -55.46 27.16 Favored 'General case' 0 N--CA 1.438 -1.037 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.912 176.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 85.1 mttt -48.22 -50.25 30.11 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 124.175 0.99 . . . . 0.0 111.481 -179.475 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -68.65 -71.34 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 118.58 0.627 . . . . 0.0 110.907 174.618 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 88.3 m -104.43 -35.79 7.79 Favored 'General case' 0 N--CA 1.435 -1.223 0 C-N-CA 123.96 0.904 . . . . 0.0 110.74 -159.191 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 112.02 -16.4 25.36 Favored Glycine 0 CA--C 1.532 1.126 0 C-N-CA 123.374 0.512 . . . . 0.0 111.982 -175.08 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.7 p -80.84 63.91 5.41 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 126.557 1.943 . . . . 0.0 110.031 -166.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -72.54 41.64 0.82 Allowed Glycine 0 CA--C 1.537 1.44 0 N-CA-C 117.57 1.788 . . . . 0.0 117.57 -155.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -120.87 135.17 55.25 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 119.955 1.877 . . . . 0.0 109.214 -177.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 175.52 -166.42 37.82 Favored Glycine 0 CA--C 1.524 0.633 0 N-CA-C 111.189 -0.764 . . . . 0.0 111.189 -177.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 4.3 mptt -157.89 156.2 30.94 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 125.363 1.465 . . . . 0.0 108.676 171.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . 0.489 ' HB2' ' HB3' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -90.53 160.84 15.76 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 -179.746 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -137.88 131.2 30.64 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 105.518 -2.03 . . . . 0.0 105.518 170.543 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 31.4 t30 67.58 -93.05 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 118.984 0.811 . . . . 0.0 110.089 165.402 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 24.3 m120 -154.95 58.51 0.67 Allowed 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 127.888 2.475 . . . . 0.0 105.367 160.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 17.1 mp0 -149.25 178.37 8.81 Favored 'General case' 0 N--CA 1.444 -0.733 0 C-N-CA 129.762 3.225 . . . . 0.0 103.711 177.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.448 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.3 m -155.4 165.22 37.29 Favored 'General case' 0 CA--C 1.506 -0.726 0 O-C-N 120.899 -1.126 . . . . 0.0 110.055 -171.24 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -141.9 146.34 35.61 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 175.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 20.2 m -84.35 -129.65 0.03 OUTLIER 'General case' 0 N--CA 1.439 -1.0 0 N-CA-C 108.058 -1.09 . . . . 0.0 108.058 164.552 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 3.8 p90 . . . . . 0 N--CA 1.449 -0.508 0 C-N-CA 124.01 0.924 . . . . 0.0 108.853 -173.998 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.5 pp . . . . . 0 N--CA 1.456 -0.163 0 N-CA-C 111.818 0.303 . . . . 0.0 111.818 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -130.09 -168.76 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.903 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 -174.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.5 t0 -135.5 105.44 6.22 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-O 120.745 0.307 . . . . 0.0 110.599 156.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -142.7 136.65 27.38 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.21 0 N-CA-C 109.295 -0.632 . . . . 0.0 109.295 152.235 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 55.1 pttt -46.31 114.52 0.82 Allowed 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 125.648 1.579 . . . . 0.0 112.001 176.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.503 ' HB3' ' HB2' ' A' ' 29' ' ' CYS . 5.2 p -88.39 134.73 33.75 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 118.004 0.365 . . . . 0.0 111.838 177.156 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -90.39 -21.33 22.01 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 153.67 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -164.89 166.68 19.37 Favored 'General case' 0 C--O 1.223 -0.303 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 -178.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.405 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 1.9 p -59.75 -39.24 84.14 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 124.519 1.127 . . . . 0.0 111.737 172.403 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.5 p -56.06 -36.29 67.9 Favored 'General case' 0 N--CA 1.451 -0.381 0 O-C-N 121.969 -0.457 . . . . 0.0 111.448 -176.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -39.18 -55.25 1.68 Allowed 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.159 1.384 . . . . 0.0 111.486 167.58 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 13.8 m -64.97 -31.45 72.69 Favored 'General case' 0 N--CA 1.438 -1.025 0 C-N-CA 128.186 2.595 . . . . 0.0 108.824 -173.268 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 33.2 m0 -64.02 -67.0 0.47 Allowed 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 105.837 -1.912 . . . . 0.0 105.837 178.501 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -52.44 -32.84 41.34 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 123.265 0.626 . . . . 0.0 111.843 177.732 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.95 -54.88 35.67 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 119.519 1.054 . . . . 0.0 110.147 175.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.7 t -59.94 -34.74 73.66 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-O 120.865 0.364 . . . . 0.0 110.643 179.312 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.413 ' CG ' ' HA3' ' A' ' 25' ' ' GLY . 4.8 mtpm? -63.36 -55.14 26.96 Favored 'General case' 0 N--CA 1.438 -1.046 0 O-C-N 122.314 -0.241 . . . . 0.0 110.833 176.571 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -53.22 -48.29 68.27 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 123.311 0.645 . . . . 0.0 111.079 178.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 40.8 t -70.79 -51.23 38.0 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.485 0 C-N-CA 123.997 0.919 . . . . 0.0 110.191 -176.355 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -129.03 -34.16 1.93 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.778 0.831 . . . . 0.0 112.341 -157.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 118.16 -31.94 5.46 Favored Glycine 0 CA--C 1.533 1.156 0 C-N-CA 124.588 1.09 . . . . 0.0 112.342 176.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 49.5 m -85.53 81.69 8.58 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 126.254 1.822 . . . . 0.0 110.253 -166.268 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.413 ' HA3' ' CG ' ' A' ' 19' ' ' LYS . . . -76.53 47.46 2.42 Favored Glycine 0 CA--C 1.536 1.363 0 CA-C-O 118.72 -1.045 . . . . 0.0 115.355 -164.482 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -119.52 122.57 41.94 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 119.341 1.571 . . . . 0.0 108.739 -178.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -173.35 -169.14 35.42 Favored Glycine 0 CA--C 1.522 0.522 0 CA-C-N 119.162 0.892 . . . . 0.0 112.233 -174.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -161.8 145.34 12.34 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 177.2 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . 0.503 ' HB2' ' HB3' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -88.37 152.27 22.03 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 179.265 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 31.0 tp60 -127.59 108.69 10.99 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 105.67 -1.974 . . . . 0.0 105.67 -179.436 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 65.64 -79.69 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 119.233 0.924 . . . . 0.0 111.44 172.279 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -159.31 43.08 0.23 Allowed 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 129.327 3.051 . . . . 0.0 110.758 169.178 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -133.9 -171.56 2.76 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 105.97 -1.863 . . . . 0.0 105.97 157.226 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.458 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.2 m -145.03 162.35 37.16 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 119.254 0.934 . . . . 0.0 111.079 -172.52 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 41.3 mtp180 -142.9 153.36 43.03 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 -174.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 49.1 t -135.3 148.39 49.49 Favored 'General case' 0 C--N 1.33 -0.267 0 O-C-N 124.437 1.086 . . . . 0.0 110.891 -175.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 88.3 t80 . . . . . 0 C--O 1.234 0.276 0 C-N-CA 126.837 2.055 . . . . 0.0 109.433 -172.11 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.4 pt? . . . . . 0 N--CA 1.447 -0.618 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -132.9 166.05 30.57 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.878 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 -161.465 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 22.0 p-10 -117.53 24.96 10.75 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 125.52 1.528 . . . . 0.0 112.115 -169.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 21.3 t -117.02 133.35 64.04 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 C-N-CA 123.811 0.844 . . . . 0.0 110.127 -179.702 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt -46.31 146.14 1.48 Allowed 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 126.853 2.061 . . . . 0.0 114.491 -176.416 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.532 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -104.56 129.49 52.64 Favored 'General case' 0 CA--C 1.511 -0.539 0 C-N-CA 123.034 0.533 . . . . 0.0 110.221 167.89 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -94.66 -10.74 30.9 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 157.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -174.98 168.75 3.47 Favored 'General case' 0 C--N 1.342 0.264 0 C-N-CA 126.154 1.782 . . . . 0.0 107.499 -179.436 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.456 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 2.6 p -64.82 -42.99 94.53 Favored 'General case' 0 C--N 1.333 -0.122 0 C-N-CA 125.81 1.644 . . . . 0.0 111.462 169.385 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.4 p -55.11 -38.88 68.72 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 122.094 -0.379 . . . . 0.0 110.824 -177.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -35.31 -55.91 0.63 Allowed 'General case' 0 C--O 1.222 -0.349 0 C-N-CA 125.329 1.451 . . . . 0.0 112.097 166.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 18.8 m -64.07 -31.2 72.31 Favored 'General case' 0 N--CA 1.439 -1.016 0 C-N-CA 127.986 2.514 . . . . 0.0 108.491 -170.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 29.8 m0 -66.41 -63.26 1.11 Allowed 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 106.927 -1.508 . . . . 0.0 106.927 178.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -53.8 -31.75 50.11 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.458 0.703 . . . . 0.0 111.533 175.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.72 -56.72 10.53 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 119.775 1.171 . . . . 0.0 109.862 178.117 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -57.49 -35.81 70.68 Favored 'General case' 0 CA--C 1.514 -0.421 0 CA-C-O 121.028 0.442 . . . . 0.0 110.758 179.654 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.455 ' CG ' ' HA3' ' A' ' 25' ' ' GLY . 18.9 mtmm -63.55 -58.14 7.93 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.416 175.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 7.4 mtpm? -54.0 -39.83 66.42 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 123.514 0.725 . . . . 0.0 111.825 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 42.6 t -73.93 -62.2 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.5 0 C-N-CA 123.953 0.901 . . . . 0.0 109.022 179.071 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.2 m -117.02 -43.55 2.85 Favored 'General case' 0 N--CA 1.439 -0.984 0 C-N-CA 124.083 0.953 . . . . 0.0 110.902 -161.312 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 124.13 -21.34 6.94 Favored Glycine 0 CA--C 1.534 1.241 0 C-N-CA 124.873 1.225 . . . . 0.0 112.376 -176.091 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 9.7 t -86.22 72.88 10.31 Favored 'General case' 0 C--O 1.227 -0.126 0 O-C-N 121.474 -1.015 . . . . 0.0 109.102 -164.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.455 ' HA3' ' CG ' ' A' ' 19' ' ' LYS . . . -73.72 38.45 0.9 Allowed Glycine 0 CA--C 1.533 1.184 0 N-CA-C 117.369 1.708 . . . . 0.0 117.369 -160.495 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 61.0 mt-30 -116.16 122.68 45.79 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 126.394 1.877 . . . . 0.0 108.625 -176.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -174.8 -166.47 32.72 Favored Glycine 0 CA--C 1.521 0.458 0 CA-C-N 119.298 0.954 . . . . 0.0 111.869 -177.414 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 78.1 tttt -166.69 150.3 7.03 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 175.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . 0.532 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -88.23 161.35 17.25 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 -177.817 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -138.9 115.96 10.95 Favored 'General case' 0 N--CA 1.441 -0.876 0 N-CA-C 106.707 -1.59 . . . . 0.0 106.707 173.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 73.27 -75.58 0.07 Allowed 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.432 0.693 . . . . 0.0 111.493 165.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -168.48 46.94 0.04 OUTLIER 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 129.739 3.216 . . . . 0.0 109.418 167.316 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -144.01 -170.21 3.28 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 104.991 -2.225 . . . . 0.0 104.991 160.223 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.422 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 3.9 m -150.76 159.48 44.5 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 119.268 0.94 . . . . 0.0 110.235 -170.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 51.1 mtt-85 -136.11 152.38 50.78 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 124.599 1.159 . . . . 0.0 109.934 179.038 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 41.2 t -131.99 167.86 18.92 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 124.1 0.875 . . . . 0.0 111.281 -172.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 86.0 m-85 . . . . . 0 C--O 1.233 0.191 0 C-N-CA 127.132 2.173 . . . . 0.0 109.135 172.074 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.1 pt? . . . . . 0 N--CA 1.447 -0.622 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -133.24 -175.29 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.974 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 -168.476 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -143.71 91.78 2.28 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 121.625 0.726 . . . . 0.0 110.179 162.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 94.8 t -135.73 140.95 43.38 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 161.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.22 104.29 0.08 Allowed 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 125.79 1.636 . . . . 0.0 113.183 -177.19 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.92 130.71 42.34 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 167.107 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 29.6 m-85 -88.7 -21.72 23.75 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 123.752 0.821 . . . . 0.0 109.438 150.4 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -167.55 168.6 12.69 Favored 'General case' 0 C--O 1.224 -0.283 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 -175.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.3 p -62.89 -41.98 99.61 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 125.478 1.511 . . . . 0.0 111.973 174.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.41 ' HA ' ' CD2' ' A' ' 15' ' ' TRP . 23.0 t -57.1 -35.57 69.59 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 121.683 -0.635 . . . . 0.0 111.376 -174.303 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -35.63 -55.48 0.69 Allowed 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.387 1.475 . . . . 0.0 112.645 163.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 11.6 m -65.94 -31.41 72.32 Favored 'General case' 0 N--CA 1.439 -1.011 0 C-N-CA 127.892 2.477 . . . . 0.0 109.01 -173.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.41 ' CD2' ' HA ' ' A' ' 12' ' ' SER . 35.4 m0 -64.87 -63.37 1.13 Allowed 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 106.421 -1.696 . . . . 0.0 106.421 177.471 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -53.65 -33.0 53.7 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 122.865 0.466 . . . . 0.0 111.685 176.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.86 -55.49 29.23 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 119.265 0.938 . . . . 0.0 110.267 175.34 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -60.13 -34.08 73.03 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 121.097 0.475 . . . . 0.0 110.373 178.586 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.45 ' CG ' ' HA3' ' A' ' 25' ' ' GLY . 30.1 mtmt -64.15 -50.81 66.73 Favored 'General case' 0 N--CA 1.44 -0.967 0 O-C-N 121.35 -0.844 . . . . 0.0 110.456 178.311 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 10.2 mtpm? -57.97 -39.73 78.88 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.795 178.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 38.3 t -72.32 -60.51 2.35 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.403 0 C-N-CA 123.802 0.841 . . . . 0.0 109.551 179.323 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.9 t -118.24 -39.96 3.0 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.171 0.988 . . . . 0.0 112.578 -165.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 120.52 -25.36 7.33 Favored Glycine 0 CA--C 1.532 1.128 0 C-N-CA 123.896 0.76 . . . . 0.0 111.648 -178.172 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.9 t -87.83 75.27 8.92 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 124.048 0.939 . . . . 0.0 108.996 -167.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.45 ' HA3' ' CG ' ' A' ' 19' ' ' LYS . . . -71.95 54.47 1.38 Allowed Glycine 0 CA--C 1.534 1.234 0 N-CA-C 116.891 1.516 . . . . 0.0 116.891 -161.009 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -129.62 123.03 30.26 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 120.278 2.039 . . . . 0.0 111.171 -173.013 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -175.55 -168.99 36.72 Favored Glycine 0 CA--C 1.527 0.837 0 CA-C-N 118.273 0.488 . . . . 0.0 112.256 -176.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -149.06 158.78 44.45 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 125.987 1.715 . . . . 0.0 107.651 165.097 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . 0.427 ' HA ' ' HA ' ' A' ' 34' ' ' CYS . 0.4 OUTLIER -86.94 153.73 21.36 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 179.98 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 2.2 tp60 -124.5 106.8 10.45 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 176.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 73.88 -85.31 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.409 0 O-C-N 121.752 -0.593 . . . . 0.0 109.836 167.301 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 34.3 m120 -152.73 46.19 0.71 Allowed 'General case' 0 C--O 1.224 -0.266 0 C-N-CA 127.323 2.249 . . . . 0.0 107.289 161.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 5.2 mp0 -135.44 -175.84 4.07 Favored 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 128.597 2.759 . . . . 0.0 103.994 169.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.427 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 0.9 OUTLIER -153.41 154.33 34.24 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 119.947 1.249 . . . . 0.0 110.545 -170.151 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 66.6 mtp180 -144.05 111.74 6.09 Favored 'General case' 0 CA--C 1.506 -0.724 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.338 -168.022 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -76.39 168.31 20.28 Favored 'General case' 0 N--CA 1.438 -1.032 0 CA-C-O 121.798 0.809 . . . . 0.0 110.384 166.797 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 1.4 p90 . . . . . 0 N--CA 1.443 -0.8 0 C-N-CA 124.913 1.285 . . . . 0.0 111.25 177.674 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.2 pt? . . . . . 0 N--CA 1.445 -0.68 0 N-CA-C 107.294 -1.373 . . . . 0.0 107.294 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -136.53 158.28 37.48 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.25 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 -162.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -86.44 -17.92 33.04 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 125.061 1.344 . . . . 0.0 112.012 -171.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 63.2 t -70.09 134.44 30.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 C-N-CA 119.994 -0.682 . . . . 0.0 110.756 -159.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 56.8 pttt -53.6 102.2 0.05 Allowed 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.331 1.452 . . . . 0.0 112.611 -178.028 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.448 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -62.6 131.41 48.96 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 169.995 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -90.67 -17.2 27.23 Favored 'General case' 0 CA--C 1.535 0.402 0 O-C-N 124.684 1.24 . . . . 0.0 109.659 157.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 173.54 156.41 0.12 Allowed 'General case' 0 C--N 1.343 0.323 0 C-N-CA 126.41 1.884 . . . . 0.0 107.518 -175.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 35.4 m -47.6 -38.4 14.47 Favored 'General case' 0 CA--C 1.528 0.131 0 C-N-CA 124.151 0.98 . . . . 0.0 113.581 174.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.0 p -60.98 -28.59 69.12 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 121.892 -0.505 . . . . 0.0 112.005 -179.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 7.6 tm-20 -55.5 -52.89 62.16 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.178 0.591 . . . . 0.0 109.435 173.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 15.1 m -55.94 -28.17 55.7 Favored 'General case' 0 N--CA 1.442 -0.862 0 C-N-CA 127.726 2.41 . . . . 0.0 109.705 -176.216 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 37.4 m0 -66.68 -66.5 0.55 Allowed 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 107.039 -1.467 . . . . 0.0 107.039 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -50.89 -33.52 24.42 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 118.368 -0.825 . . . . 0.0 111.112 174.181 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.35 -58.75 5.12 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 120.056 1.298 . . . . 0.0 111.534 177.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -60.81 -30.26 69.97 Favored 'General case' 0 CA--C 1.519 -0.232 0 O-C-N 121.511 -0.743 . . . . 0.0 110.886 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -65.97 -48.73 70.31 Favored 'General case' 0 N--CA 1.442 -0.859 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.747 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.1 tmtt? -60.3 -37.64 81.15 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 124.453 1.101 . . . . 0.0 110.774 177.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 29.8 t -72.17 -62.0 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.428 -1.543 0 C-N-CA 124.05 0.94 . . . . 0.0 108.497 177.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.3 m -122.06 -49.87 2.06 Favored 'General case' 0 N--CA 1.431 -1.395 0 C-N-CA 123.922 0.889 . . . . 0.0 110.684 -163.196 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 134.18 -20.95 3.94 Favored Glycine 0 CA--C 1.536 1.389 0 C-N-CA 123.926 0.774 . . . . 0.0 112.253 -170.237 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 30.9 m -82.83 63.09 6.76 Favored 'General case' 0 C--O 1.228 -0.079 0 C-N-CA 125.205 1.402 . . . . 0.0 111.084 -164.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -65.99 1.26 4.92 Favored Glycine 0 CA--C 1.536 1.371 0 N-CA-C 116.297 1.279 . . . . 0.0 116.297 -162.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -89.56 105.48 17.82 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 119.629 1.714 . . . . 0.0 108.401 -173.432 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -158.85 -174.0 27.99 Favored Glycine 0 C--N 1.333 0.397 0 O-C-N 122.27 -0.269 . . . . 0.0 112.712 -171.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -151.33 154.98 37.77 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 124.753 1.221 . . . . 0.0 108.109 173.317 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . 0.448 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -87.77 161.04 17.8 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 176.951 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 45.9 tt0 -136.01 127.63 28.89 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 105.164 -2.161 . . . . 0.0 105.164 170.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 68.71 -89.45 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 118.797 0.726 . . . . 0.0 110.555 168.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 36.6 m120 -161.27 55.28 0.28 Allowed 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 130.129 3.372 . . . . 0.0 104.065 165.011 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -145.99 175.47 10.42 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 130.855 3.662 . . . . 0.0 102.794 176.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.404 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.2 m -156.84 157.85 35.68 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-N 120.06 1.3 . . . . 0.0 110.809 -168.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 15.2 mtp180 -144.15 145.3 32.02 Favored 'General case' 0 CA--C 1.512 -0.497 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 -170.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 8.4 p -132.89 151.53 52.02 Favored 'General case' 0 CA--C 1.515 -0.384 0 O-C-N 124.244 0.965 . . . . 0.0 110.733 169.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.448 -0.526 0 C-N-CA 123.92 0.888 . . . . 0.0 112.322 -173.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.2 pt? . . . . . 0 N--CA 1.446 -0.627 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -130.42 174.52 12.71 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.003 0 N-CA-C 106.574 -1.639 . . . . 0.0 106.574 -175.813 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -132.59 71.27 1.47 Allowed 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 122.163 0.982 . . . . 0.0 110.653 175.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 64.7 t -131.37 136.37 57.65 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 114.357 -1.292 . . . . 0.0 109.032 167.193 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 60.0 pttt -45.95 113.64 0.65 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 126.156 1.782 . . . . 0.0 112.618 179.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.415 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -74.09 136.67 43.02 Favored 'General case' 0 CA--C 1.516 -0.351 0 C-N-CA 120.103 -0.639 . . . . 0.0 109.859 170.123 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 7.2 t80 -100.73 -8.18 23.03 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 161.066 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 174.08 165.12 0.2 Allowed 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 126.941 2.096 . . . . 0.0 106.461 -175.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.6 m -62.33 -36.26 81.66 Favored 'General case' 0 C--O 1.226 -0.182 0 C-N-CA 122.73 0.412 . . . . 0.0 111.961 170.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.5 p -59.09 -37.75 77.89 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 122.131 -0.356 . . . . 0.0 110.652 -179.529 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -42.58 -55.3 3.57 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.165 0.986 . . . . 0.0 110.63 170.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 25.5 m -56.56 -31.11 63.88 Favored 'General case' 0 N--CA 1.444 -0.763 0 C-N-CA 127.174 2.19 . . . . 0.0 109.678 -173.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 34.2 m0 -65.74 -63.47 1.08 Allowed 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 -179.214 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -51.62 -36.37 45.58 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-O 118.691 -0.671 . . . . 0.0 111.031 173.565 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.74 -57.58 10.46 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 119.632 1.106 . . . . 0.0 110.863 -178.611 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -59.04 -35.31 73.1 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-O 121.37 0.605 . . . . 0.0 110.55 178.497 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.461 ' CG ' ' HA3' ' A' ' 25' ' ' GLY . 8.1 mtmt -62.55 -45.46 92.84 Favored 'General case' 0 N--CA 1.441 -0.909 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 178.621 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -54.91 -52.39 63.05 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 122.957 0.503 . . . . 0.0 111.231 176.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -67.38 -65.32 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 118.47 0.577 . . . . 0.0 112.093 178.713 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 62.2 p -105.25 -50.02 3.33 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 122.546 0.338 . . . . 0.0 110.703 -170.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 126.46 -10.36 7.24 Favored Glycine 0 CA--C 1.532 1.126 0 CA-C-N 115.464 -0.789 . . . . 0.0 112.224 -161.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.5 m -78.66 57.49 2.05 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 118.674 1.237 . . . . 0.0 112.347 -165.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.461 ' HA3' ' CG ' ' A' ' 19' ' ' LYS . . . -74.2 30.55 0.97 Allowed Glycine 0 CA--C 1.533 1.199 0 N-CA-C 117.093 1.597 . . . . 0.0 117.093 -154.075 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 -122.79 123.76 41.78 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 119.57 1.685 . . . . 0.0 108.069 -172.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -179.11 -170.86 41.59 Favored Glycine 0 CA--C 1.526 0.757 0 CA-C-N 118.921 0.782 . . . . 0.0 112.743 -175.101 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -147.49 159.47 43.69 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 125.526 1.53 . . . . 0.0 108.337 166.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 34' ' ' CYS . 0.1 OUTLIER -88.37 141.18 28.75 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.775 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 11.3 tp60 -102.58 99.54 9.55 Favored 'General case' 0 N--CA 1.445 -0.713 0 N-CA-C 105.595 -2.002 . . . . 0.0 105.595 171.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 69.4 -77.62 0.05 Allowed 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 119.182 0.901 . . . . 0.0 112.32 166.318 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -153.95 39.11 0.47 Allowed 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 128.458 2.703 . . . . 0.0 110.933 168.449 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -136.86 -177.77 4.89 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 104.219 -2.511 . . . . 0.0 104.219 166.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.1 m -151.1 153.7 35.55 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 119.861 1.209 . . . . 0.0 110.639 -167.53 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 75.9 mtp180 -144.67 110.85 5.5 Favored 'General case' 0 CA--C 1.507 -0.693 0 C-N-CA 123.666 0.787 . . . . 0.0 109.475 -163.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 4.6 m -91.15 -154.99 0.38 Allowed 'General case' 0 N--CA 1.441 -0.875 0 CA-C-N 114.685 -1.143 . . . . 0.0 110.484 -178.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.451 -0.409 0 C-N-CA 124.857 1.263 . . . . 0.0 109.481 -175.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.6 pt? . . . . . 0 N--CA 1.45 -0.438 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.411 HD11 HG12 ' A' ' 6' ' ' VAL . 0.7 OUTLIER -145.48 157.77 13.01 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.619 0 N-CA-C 105.978 -1.86 . . . . 0.0 105.978 -157.842 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -118.35 33.17 5.76 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 123.139 0.576 . . . . 0.0 110.759 -169.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.411 HG12 HD11 ' A' ' 4' ' ' ILE . 1.4 p -77.99 127.36 38.55 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.175 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 170.349 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 53.3 pttt -43.84 101.83 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.31 1.444 . . . . 0.0 111.287 171.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.454 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.1 OUTLIER -68.8 133.47 48.36 Favored 'General case' 0 CA--C 1.517 -0.306 0 C-N-CA 119.414 -0.914 . . . . 0.0 110.32 177.492 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -98.05 -8.14 28.39 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.416 158.274 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 176.24 166.24 0.43 Allowed 'General case' 0 C--O 1.225 -0.202 0 C-N-CA 126.137 1.775 . . . . 0.0 107.15 -177.273 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.8 m -61.58 -35.35 77.58 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 118.334 0.515 . . . . 0.0 112.041 172.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.8 p -58.79 -32.56 69.44 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 121.666 -0.646 . . . . 0.0 111.61 -179.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -44.26 -52.71 7.28 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 124.092 0.957 . . . . 0.0 111.136 169.257 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 8.9 m -67.04 -30.69 70.84 Favored 'General case' 0 N--CA 1.44 -0.962 0 C-N-CA 127.677 2.391 . . . . 0.0 108.514 -172.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 34.2 m0 -64.95 -65.55 0.66 Allowed 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 106.0 -1.852 . . . . 0.0 106.0 176.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 4.0 p -54.22 -31.32 52.84 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 123.006 0.522 . . . . 0.0 111.755 179.022 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.48 -55.03 20.1 Favored 'General case' 0 N--CA 1.457 -0.092 0 CA-C-N 119.394 0.997 . . . . 0.0 110.432 175.606 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -60.96 -31.8 71.35 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-O 120.952 0.406 . . . . 0.0 110.086 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.437 ' CG ' ' HA3' ' A' ' 25' ' ' GLY . 22.9 mtpp -65.79 -53.45 40.17 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-O 121.377 0.608 . . . . 0.0 110.967 174.795 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? -54.15 -38.77 65.86 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.385 179.006 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 78.8 t -77.7 -66.72 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.425 -1.689 0 C-N-CA 124.027 0.931 . . . . 0.0 109.622 176.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 29.3 p -95.36 -50.8 4.86 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 123.157 0.583 . . . . 0.0 111.557 -169.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 122.31 -28.28 5.84 Favored Glycine 0 CA--C 1.531 1.047 0 C-N-CA 125.264 1.412 . . . . 0.0 110.783 -166.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -89.28 80.22 6.91 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.895 1.278 . . . . 0.0 109.184 -165.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.437 ' HA3' ' CG ' ' A' ' 19' ' ' LYS . . . -76.14 40.22 1.46 Allowed Glycine 0 CA--C 1.532 1.151 0 N-CA-C 117.175 1.63 . . . . 0.0 117.175 -156.534 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 61.2 mt-30 -115.5 116.68 28.6 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 120.104 1.952 . . . . 0.0 110.814 -171.066 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -170.19 -169.88 33.87 Favored Glycine 0 C--N 1.339 0.709 0 N-CA-C 111.453 -0.659 . . . . 0.0 111.453 -178.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 45.2 mtpt -150.97 156.46 41.2 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 124.722 1.209 . . . . 0.0 108.732 169.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . 0.454 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -88.83 162.91 15.92 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 178.345 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 -141.77 125.99 17.47 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 106.858 -1.534 . . . . 0.0 106.858 168.178 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 7.2 m120 66.03 -78.13 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.943 0.897 . . . . 0.0 111.589 169.211 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -165.26 44.43 0.08 Allowed 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 129.782 3.233 . . . . 0.0 109.64 168.655 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 93.8 mt-30 -134.4 179.98 5.94 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 127.611 2.364 . . . . 0.0 105.23 168.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.449 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.4 m -153.57 157.61 39.98 Favored 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 -177.704 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 8.1 mtt180 -146.12 128.6 15.98 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 118.022 -0.989 . . . . 0.0 109.502 -170.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -103.45 167.71 9.63 Favored 'General case' 0 C--N 1.343 0.306 0 CA-C-O 121.885 0.85 . . . . 0.0 112.209 171.545 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.451 -0.377 0 C-N-CA 126.076 1.75 . . . . 0.0 111.107 -176.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.3 pt? . . . . . 0 N--CA 1.447 -0.587 0 N-CA-C 109.211 -0.662 . . . . 0.0 109.211 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -138.89 166.17 22.85 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.186 0 N-CA-C 106.794 -1.558 . . . . 0.0 106.794 -163.714 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 46.9 t0 -127.42 81.8 2.04 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 122.047 0.927 . . . . 0.0 109.055 166.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 93.3 t -122.13 133.89 67.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 N-CA-C 106.2 -1.778 . . . . 0.0 106.2 156.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -62.1 108.58 1.09 Allowed 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 124.514 1.126 . . . . 0.0 111.464 -174.082 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.491 ' HB3' ' HB2' ' A' ' 29' ' ' CYS . 11.4 p -63.54 128.24 34.93 Favored 'General case' 0 CA--C 1.516 -0.354 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.711 176.637 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -71.83 -38.14 70.22 Favored 'General case' 0 N--CA 1.45 -0.446 0 O-C-N 124.421 1.076 . . . . 0.0 108.108 153.499 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -169.17 160.31 9.62 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.666 1.187 . . . . 0.0 108.386 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.531 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 21.8 m -47.06 -40.52 15.14 Favored 'General case' 0 C--O 1.226 -0.16 0 C-N-CA 124.383 1.073 . . . . 0.0 112.378 173.401 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.08 -23.6 65.59 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-O 119.096 -0.478 . . . . 0.0 112.112 -177.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -69.9 -48.14 59.78 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 119.235 0.925 . . . . 0.0 109.674 174.414 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 21.3 m -47.84 -28.16 2.46 Favored 'General case' 0 CA--C 1.511 -0.522 0 C-N-CA 125.937 1.695 . . . . 0.0 110.596 -179.372 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 37.1 m0 -64.81 -65.85 0.62 Allowed 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 177.547 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -51.4 -31.95 24.48 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-O 117.918 -1.039 . . . . 0.0 111.464 172.173 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.42 -63.31 1.27 Allowed 'General case' 0 C--N 1.342 0.245 0 CA-C-N 121.018 1.735 . . . . 0.0 111.265 176.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -57.68 -30.94 65.86 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 121.906 0.86 . . . . 0.0 110.848 -178.5 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.7 mtmm -66.49 -49.45 66.56 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 173.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 67.4 mttt -51.98 -53.26 43.62 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.25 1.02 . . . . 0.0 109.95 177.434 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -63.04 -40.88 90.72 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 179.287 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -151.6 -49.15 0.11 Allowed 'General case' 0 N--CA 1.447 -0.613 0 O-C-N 121.419 -0.8 . . . . 0.0 111.768 -164.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 144.52 -15.14 2.04 Favored Glycine 0 CA--C 1.53 0.979 0 C-N-CA 120.721 -0.752 . . . . 0.0 114.154 -178.114 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 9.3 m -79.79 59.12 3.02 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 124.059 0.943 . . . . 0.0 111.682 -163.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -70.87 12.01 2.3 Favored Glycine 0 CA--C 1.532 1.152 0 N-CA-C 116.339 1.295 . . . . 0.0 116.339 -157.428 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -105.22 108.06 19.37 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 119.16 1.48 . . . . 0.0 107.042 -172.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -167.03 -170.37 31.82 Favored Glycine 0 C--N 1.336 0.575 0 N-CA-C 111.966 -0.454 . . . . 0.0 111.966 -168.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 78.2 mttt -156.22 154.91 31.51 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 124.922 1.289 . . . . 0.0 108.631 177.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . 0.531 ' HB3' ' HA ' ' A' ' 11' ' ' SER . 0.5 OUTLIER -91.35 160.09 15.66 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 176.419 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -140.81 120.9 13.74 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 106.231 -1.766 . . . . 0.0 106.231 176.334 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 70.84 -84.96 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 118.25 0.477 . . . . 0.0 110.078 168.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -162.34 56.36 0.23 Allowed 'General case' 0 N--CA 1.462 0.131 0 C-N-CA 129.175 2.99 . . . . 0.0 104.793 162.079 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 5.6 mp0 -143.09 -178.96 6.1 Favored 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 128.882 2.873 . . . . 0.0 103.796 170.017 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.419 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.2 m -157.39 158.5 36.02 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 119.595 1.089 . . . . 0.0 109.998 -169.674 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 58.1 mtt-85 -144.81 153.32 41.51 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 124.555 1.142 . . . . 0.0 110.096 -176.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 8.7 p -139.07 163.33 32.7 Favored 'General case' 0 CA--C 1.521 -0.164 0 O-C-N 124.389 1.056 . . . . 0.0 111.088 170.609 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.533 0.294 0 C-N-CA 123.807 0.843 . . . . 0.0 112.194 -171.606 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.6 pt? . . . . . 0 N--CA 1.452 -0.361 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -145.26 158.74 13.36 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.338 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 -158.464 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -123.5 41.62 3.43 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 121.881 0.848 . . . . 0.0 111.516 -174.726 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 97.5 t -87.19 129.14 39.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 166.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 52.8 pttt -49.53 101.48 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 126.211 1.805 . . . . 0.0 113.363 179.292 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.479 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -66.47 127.07 30.89 Favored 'General case' 0 CA--C 1.515 -0.378 0 C-N-CA 123.0 0.52 . . . . 0.0 110.591 170.358 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 87.2 m-85 -96.94 -12.43 23.41 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 125.198 1.561 . . . . 0.0 109.979 153.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -177.15 153.42 0.97 Allowed 'General case' 0 C--N 1.343 0.318 0 C-N-CA 124.483 1.113 . . . . 0.0 109.212 -177.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.444 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 1.9 p -54.52 -41.22 69.4 Favored 'General case' 0 N--CA 1.457 -0.12 0 C-N-CA 125.31 1.444 . . . . 0.0 111.199 171.513 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.5 p -59.3 -25.08 63.84 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -178.486 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -60.0 -57.38 13.11 Favored 'General case' 0 C--O 1.223 -0.312 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 173.63 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 11.7 m -48.56 -31.4 6.48 Favored 'General case' 0 CA--C 1.508 -0.646 0 C-N-CA 129.008 2.923 . . . . 0.0 109.964 -175.446 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 33.8 m0 -62.58 -63.82 1.11 Allowed 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 175.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -48.11 -39.77 21.45 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 123.263 0.625 . . . . 0.0 111.922 173.487 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.29 -56.72 18.14 Favored 'General case' 0 C--N 1.328 -0.327 0 O-C-N 121.681 -0.637 . . . . 0.0 110.546 178.553 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -59.75 -35.56 74.84 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.595 0.712 . . . . 0.0 110.549 179.076 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 4.3 mtmp? -64.5 -44.63 90.31 Favored 'General case' 0 N--CA 1.439 -1.011 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.438 177.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.43 -54.43 32.28 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 124.226 1.011 . . . . 0.0 109.785 178.791 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -67.58 -62.95 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.325 0 N-CA-C 112.087 0.402 . . . . 0.0 112.087 178.226 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 70.7 p -103.6 -49.51 3.66 Favored 'General case' 0 CA--C 1.522 -0.099 0 C-N-CA 122.779 0.431 . . . . 0.0 110.806 -167.199 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 118.65 -18.1 10.89 Favored Glycine 0 CA--C 1.532 1.1 0 CA-C-N 115.151 -0.932 . . . . 0.0 111.401 -163.692 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 24.5 m -79.56 67.31 5.28 Favored 'General case' 0 C--O 1.227 -0.123 0 C-N-CA 124.467 1.107 . . . . 0.0 110.285 -169.348 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -72.44 40.67 0.76 Allowed Glycine 0 CA--C 1.539 1.584 0 N-CA-C 117.036 1.574 . . . . 0.0 117.036 -160.207 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 63.1 mt-30 -117.09 120.53 38.6 Favored 'General case' 0 C--O 1.224 -0.282 0 C-N-CA 125.739 1.616 . . . . 0.0 108.942 -172.381 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -175.2 -168.39 35.67 Favored Glycine 0 C--N 1.335 0.524 0 CA-C-N 119.622 1.101 . . . . 0.0 111.508 -178.021 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 81.4 mttt -153.77 160.83 42.41 Favored 'General case' 0 CA--C 1.522 -0.101 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 165.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . 0.479 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -89.18 165.57 14.38 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 177.051 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -141.32 141.58 33.87 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 106.264 -1.754 . . . . 0.0 106.264 165.323 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 18.9 t30 61.68 -93.43 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 118.591 0.632 . . . . 0.0 111.07 167.546 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.0 m120 -153.35 55.37 0.75 Allowed 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 127.632 2.373 . . . . 0.0 106.224 162.167 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 17.1 mp0 -148.12 176.82 9.9 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 129.966 3.306 . . . . 0.0 104.442 -176.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.461 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.4 m -156.81 155.1 30.96 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 119.54 1.064 . . . . 0.0 110.126 -171.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 -142.2 134.84 28.24 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 123.847 0.859 . . . . 0.0 109.248 -170.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 49.0 t -111.32 158.05 19.47 Favored 'General case' 0 C--N 1.341 0.228 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 -174.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 16.8 m-30 . . . . . 0 N--CA 1.454 -0.258 0 C-N-CA 125.481 1.512 . . . . 0.0 109.64 -175.302 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.4 pt? . . . . . 0 N--CA 1.451 -0.402 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -137.1 162.6 33.75 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.15 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 -167.128 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -90.56 -16.91 27.9 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 124.501 1.12 . . . . 0.0 112.621 -172.122 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 58.3 t -75.19 134.57 29.07 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 CA-C-N 118.795 0.725 . . . . 0.0 111.757 -157.294 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.2 tmtt? -37.7 106.31 0.05 OUTLIER 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 127.578 2.351 . . . . 0.0 112.104 173.04 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.499 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -75.28 135.22 40.95 Favored 'General case' 0 CA--C 1.515 -0.388 0 C-N-CA 120.332 -0.547 . . . . 0.0 109.915 168.907 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -95.12 -16.37 22.66 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 158.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 178.51 166.43 0.83 Allowed 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 106.099 -1.815 . . . . 0.0 106.099 -172.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.9 p -61.31 -39.37 90.22 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 124.06 0.944 . . . . 0.0 111.48 172.733 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.6 p -56.77 -40.94 76.78 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 122.773 0.429 . . . . 0.0 111.046 -177.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -40.66 -56.87 2.02 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.634 1.174 . . . . 0.0 111.078 170.546 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 23.7 m -57.95 -28.37 64.25 Favored 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 128.026 2.53 . . . . 0.0 109.73 -173.311 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 33.2 m0 -64.65 -66.15 0.58 Allowed 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 107.186 -1.413 . . . . 0.0 107.186 177.534 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -51.67 -33.14 32.54 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 118.085 -0.959 . . . . 0.0 111.696 174.409 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.82 -54.38 36.01 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 120.107 1.321 . . . . 0.0 110.709 175.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 5.1 t -58.12 -37.16 74.06 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.071 0.463 . . . . 0.0 110.46 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.42 ' CG ' ' HA3' ' A' ' 25' ' ' GLY . 40.3 mtmt -63.5 -58.71 6.15 Favored 'General case' 0 N--CA 1.44 -0.943 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.706 177.079 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 64.3 mmtt -49.53 -47.11 49.13 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.303 1.041 . . . . 0.0 111.835 178.076 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 44.0 t -70.87 -60.02 2.86 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.77 0 C-N-CA 123.962 0.905 . . . . 0.0 109.15 -178.102 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.2 m -118.58 -41.54 2.81 Favored 'General case' 0 N--CA 1.439 -1.004 0 C-N-CA 123.591 0.756 . . . . 0.0 110.987 -161.103 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 120.83 -21.42 8.41 Favored Glycine 0 CA--C 1.533 1.215 0 C-N-CA 124.908 1.242 . . . . 0.0 112.372 -177.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 21.5 m -88.17 61.08 6.09 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 124.709 1.204 . . . . 0.0 110.322 -160.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.42 ' HA3' ' CG ' ' A' ' 19' ' ' LYS . . . -64.13 23.39 0.09 OUTLIER Glycine 0 CA--C 1.54 1.623 0 N-CA-C 120.414 2.926 . . . . 0.0 120.414 -152.614 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -108.38 118.2 36.16 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 121.129 2.465 . . . . 0.0 109.903 -176.3 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -163.99 -170.49 28.98 Favored Glycine 0 CA--C 1.528 0.875 0 N-CA-C 112.157 -0.377 . . . . 0.0 112.157 -174.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -156.38 156.08 33.26 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 125.159 1.384 . . . . 0.0 107.879 174.073 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . 0.499 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 0.0 OUTLIER -92.14 160.57 15.13 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 178.485 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.8 tp-100 -133.62 126.69 31.41 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 105.896 -1.89 . . . . 0.0 105.896 165.659 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.2 t30 69.04 -78.91 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 164.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -166.63 44.86 0.06 Allowed 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 130.411 3.484 . . . . 0.0 108.894 170.388 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -147.61 179.35 7.75 Favored 'General case' 0 N--CA 1.442 -0.825 0 C-N-CA 128.875 2.87 . . . . 0.0 104.167 177.453 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.432 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 5.0 m -153.94 164.75 37.9 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 119.894 1.224 . . . . 0.0 110.399 -169.422 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 73.4 mtp180 -140.0 152.93 46.68 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 125.651 1.58 . . . . 0.0 108.976 -178.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 36.8 t -132.59 162.63 30.8 Favored 'General case' 0 C--O 1.224 -0.26 0 O-C-N 124.652 1.22 . . . . 0.0 109.34 178.791 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.534 0.355 0 CA-C-N 118.651 0.66 . . . . 0.0 111.365 -177.294 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.457 -0.097 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -140.42 160.67 25.02 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.373 0 N-CA-C 104.932 -2.247 . . . . 0.0 104.932 -171.487 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -123.33 41.88 3.36 Favored 'General case' 0 C--N 1.332 -0.19 0 C-N-CA 123.077 0.551 . . . . 0.0 110.677 -171.734 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 95.9 t -96.45 135.97 28.83 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 170.358 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.67 106.7 0.27 Allowed 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.815 1.246 . . . . 0.0 112.372 -177.748 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.432 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -65.19 127.29 31.08 Favored 'General case' 0 CA--C 1.515 -0.367 0 C-N-CA 122.587 0.355 . . . . 0.0 110.259 168.005 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -85.21 -19.19 32.06 Favored 'General case' 0 CA--C 1.538 0.519 0 O-C-N 124.403 1.064 . . . . 0.0 109.237 155.309 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -175.39 171.51 2.85 Favored 'General case' 0 C--O 1.221 -0.406 0 C-N-CA 125.486 1.515 . . . . 0.0 108.11 -179.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.44 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 20.0 m -62.86 -37.94 88.86 Favored 'General case' 0 N--CA 1.464 0.254 0 O-C-N 121.72 -0.612 . . . . 0.0 111.934 170.688 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.2 p -57.99 -34.36 69.9 Favored 'General case' 0 N--CA 1.452 -0.361 0 O-C-N 121.768 -0.582 . . . . 0.0 110.999 -178.138 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -40.24 -54.69 2.31 Favored 'General case' 0 C--O 1.225 -0.225 0 C-N-CA 124.42 1.088 . . . . 0.0 111.567 167.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 19.1 m -64.93 -30.06 71.03 Favored 'General case' 0 N--CA 1.44 -0.949 0 C-N-CA 127.394 2.278 . . . . 0.0 108.438 -171.019 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 28.9 m0 -64.9 -65.72 0.64 Allowed 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 106.178 -1.786 . . . . 0.0 106.178 176.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -51.46 -33.6 31.73 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 118.604 -0.712 . . . . 0.0 112.149 176.75 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.48 -54.88 25.57 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 119.902 1.228 . . . . 0.0 110.259 177.376 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -60.29 -34.1 73.29 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 120.794 0.33 . . . . 0.0 110.343 179.835 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 39.1 mtmt -65.16 -53.9 37.85 Favored 'General case' 0 N--CA 1.439 -0.999 0 C-N-CA 122.483 0.313 . . . . 0.0 110.839 176.267 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -48.32 -49.49 33.89 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 123.569 0.748 . . . . 0.0 110.71 176.786 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 65.3 t -73.15 -56.07 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.697 0 C-N-CA 124.289 1.036 . . . . 0.0 110.299 -175.477 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 11.9 t -138.91 18.85 2.65 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 113.588 0.959 . . . . 0.0 113.588 -162.517 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.09 -27.53 0.54 Allowed Glycine 0 CA--C 1.542 1.74 0 O-C-N 120.566 -1.334 . . . . 0.0 115.132 176.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 10.1 t -84.72 73.52 10.58 Favored 'General case' 0 C--O 1.226 -0.171 0 O-C-N 121.488 -1.007 . . . . 0.0 109.539 -162.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -72.04 35.77 0.63 Allowed Glycine 0 CA--C 1.536 1.398 0 N-CA-C 117.013 1.565 . . . . 0.0 117.013 -162.439 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -111.56 109.74 19.81 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 119.952 1.876 . . . . 0.0 109.454 -173.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -161.8 -169.19 24.78 Favored Glycine 0 CA--C 1.527 0.784 0 CA-C-N 118.736 0.698 . . . . 0.0 113.565 -173.558 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 19.2 ttmm -165.98 142.59 5.2 Favored 'General case' 0 CA--C 1.519 -0.246 0 C-N-CA 125.192 1.397 . . . . 0.0 107.748 -178.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . 0.451 ' HA ' ' HA ' ' A' ' 34' ' ' CYS . 0.1 OUTLIER -86.08 149.04 25.42 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 109.217 -0.661 . . . . 0.0 109.217 -177.901 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 21.1 tp60 -116.22 111.3 19.98 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 105.056 -2.202 . . . . 0.0 105.056 174.555 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 63.32 -92.37 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 119.598 1.09 . . . . 0.0 109.731 172.002 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 21.8 m120 -147.68 55.18 1.07 Allowed 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 126.02 1.728 . . . . 0.0 107.891 165.193 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.4 mp0 -141.55 175.76 9.42 Favored 'General case' 0 N--CA 1.445 -0.715 0 C-N-CA 130.752 3.621 . . . . 0.0 103.177 171.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.451 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 0.8 OUTLIER -147.9 155.82 42.01 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-N 120.725 1.602 . . . . 0.0 110.759 -171.46 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 63.0 mtp180 -139.51 151.88 46.49 Favored 'General case' 0 CA--C 1.509 -0.619 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 -171.141 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 47.5 t -143.37 141.45 30.92 Favored 'General case' 0 C--N 1.332 -0.179 0 O-C-N 124.543 1.152 . . . . 0.0 110.817 -172.181 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 72.9 t80 . . . . . 0 N--CA 1.453 -0.298 0 C-N-CA 126.021 1.728 . . . . 0.0 109.834 -170.343 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.6 pt? . . . . . 0 CA--C 1.522 -0.104 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.47 HD11 HG12 ' A' ' 6' ' ' VAL . 0.9 OUTLIER -139.39 162.05 27.34 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.184 0 C-N-CA 126.085 1.754 . . . . 0.0 106.702 -166.332 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -88.42 -15.82 34.47 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 124.03 0.932 . . . . 0.0 113.216 -169.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.47 HG12 HD11 ' A' ' 4' ' ' ILE . 0.8 OUTLIER -67.46 139.46 20.89 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 C-N-CA 119.369 -0.932 . . . . 0.0 112.31 -156.318 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 34.3 mttt -65.55 95.63 0.23 Allowed 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.758 1.223 . . . . 0.0 111.645 -174.093 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.496 ' HB3' ' HB2' ' A' ' 29' ' ' CYS . 1.4 p -67.09 133.21 49.41 Favored 'General case' 0 CA--C 1.517 -0.31 0 O-C-N 123.109 0.255 . . . . 0.0 111.12 176.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 52.8 m-85 -85.47 -27.79 25.45 Favored 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 124.047 0.842 . . . . 0.0 109.295 150.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -169.79 160.71 8.8 Favored 'General case' 0 C--O 1.223 -0.333 0 C-N-CA 123.813 0.845 . . . . 0.0 109.833 -179.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.439 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 66.8 m -46.56 -38.28 9.21 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 114.161 1.171 . . . . 0.0 114.161 175.069 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.8 p -58.02 -27.73 63.81 Favored 'General case' 0 N--CA 1.449 -0.475 0 O-C-N 121.634 -0.666 . . . . 0.0 112.161 -179.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -54.49 -47.05 73.5 Favored 'General case' 0 C--O 1.219 -0.503 0 C-N-CA 124.333 1.053 . . . . 0.0 111.345 170.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.412 ' SG ' ' CA ' ' A' ' 29' ' ' CYS . 6.3 m -67.47 -33.16 74.56 Favored 'General case' 0 CA--C 1.498 -1.027 0 C-N-CA 125.922 1.689 . . . . 0.0 107.614 -175.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 33.4 m0 -64.55 -65.79 0.63 Allowed 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 106.53 -1.656 . . . . 0.0 106.53 177.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 21.4 p -55.87 -29.76 60.43 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 118.583 -0.723 . . . . 0.0 111.999 -179.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.25 -54.76 18.0 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 119.298 0.953 . . . . 0.0 111.27 175.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.8 t -60.0 -36.92 78.23 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-O 121.55 0.691 . . . . 0.0 110.089 179.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 75.0 mttt -60.82 -54.39 45.69 Favored 'General case' 0 N--CA 1.436 -1.141 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.938 174.135 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -43.98 -53.89 5.85 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 124.198 0.999 . . . . 0.0 111.001 177.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 91.7 t -77.32 -60.43 2.31 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.836 0 C-N-CA 124.543 1.137 . . . . 0.0 109.775 -173.237 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 30.8 p -103.52 -42.13 5.77 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 122.788 0.435 . . . . 0.0 111.95 -167.76 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 110.29 -16.5 29.63 Favored Glycine 0 CA--C 1.536 1.365 0 C-N-CA 124.567 1.08 . . . . 0.0 111.234 -165.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 3.5 m -82.75 65.33 7.82 Favored 'General case' 0 C--O 1.224 -0.252 0 C-N-CA 124.276 1.03 . . . . 0.0 110.339 -165.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -74.27 34.86 0.94 Allowed Glycine 0 CA--C 1.538 1.508 0 N-CA-C 117.856 1.902 . . . . 0.0 117.856 -155.132 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 57.4 mt-30 -113.65 124.83 53.24 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 119.891 1.845 . . . . 0.0 109.428 -177.05 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -170.73 -168.21 32.17 Favored Glycine 0 CA--C 1.523 0.559 0 CA-C-N 119.161 0.891 . . . . 0.0 112.529 -175.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -159.81 142.03 13.33 Favored 'General case' 0 CA--C 1.52 -0.207 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 175.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . 0.496 ' HB2' ' HB3' ' A' ' 8' ' ' CYS . 0.5 OUTLIER -86.54 157.52 19.73 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 108.188 -1.041 . . . . 0.0 108.188 -179.514 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 15.5 tt0 -136.67 123.93 21.86 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 105.383 -2.08 . . . . 0.0 105.383 176.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 22.2 t30 68.5 -92.75 0.03 OUTLIER 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 118.805 0.73 . . . . 0.0 109.795 167.244 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 24.3 m120 -154.46 57.05 0.7 Allowed 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 127.561 2.344 . . . . 0.0 105.691 160.486 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.7 mp0 -144.69 175.44 10.16 Favored 'General case' 0 N--CA 1.445 -0.68 0 C-N-CA 130.356 3.463 . . . . 0.0 103.097 175.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.2 m -149.91 161.85 41.48 Favored 'General case' 0 CA--C 1.504 -0.792 0 O-C-N 120.636 -1.29 . . . . 0.0 110.629 -173.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 49.6 mtp180 -139.63 150.72 45.29 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 -175.292 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 49.3 t -137.48 146.98 44.9 Favored 'General case' 0 N--CA 1.463 0.218 0 O-C-N 124.4 1.062 . . . . 0.0 110.398 -173.034 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 87.3 t80 . . . . . 0 N--CA 1.452 -0.328 0 C-N-CA 126.617 1.967 . . . . 0.0 109.344 -171.346 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.1 pt? . . . . . 0 N--CA 1.448 -0.54 0 N-CA-C 105.738 -1.949 . . . . 0.0 105.738 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -132.31 -176.45 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 N-CA-C 107.745 -1.205 . . . . 0.0 107.745 -175.226 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -137.39 84.92 2.09 Favored 'General case' 0 N--CA 1.457 -0.097 0 CA-C-O 121.89 0.852 . . . . 0.0 110.928 163.821 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 94.6 t -128.35 136.43 60.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 N-CA-C 105.382 -2.081 . . . . 0.0 105.382 156.313 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -70.42 115.74 9.95 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 123.765 0.826 . . . . 0.0 110.932 -168.381 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.493 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -68.69 125.38 26.37 Favored 'General case' 0 CA--C 1.514 -0.419 0 C-N-CA 122.661 0.385 . . . . 0.0 110.304 177.114 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -77.66 -27.13 50.82 Favored 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 124.61 1.194 . . . . 0.0 109.588 151.118 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -179.7 153.91 0.57 Allowed 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 124.417 1.087 . . . . 0.0 108.796 -172.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 36.7 m -49.51 -38.85 32.01 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 124.027 0.931 . . . . 0.0 113.04 173.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.3 p -62.12 -20.36 63.98 Favored 'General case' 0 N--CA 1.445 -0.71 0 C-N-CA 122.775 0.43 . . . . 0.0 112.127 -178.383 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.07 -50.74 18.3 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-N 118.509 0.595 . . . . 0.0 109.622 176.09 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 17.7 m -46.35 -28.65 1.39 Allowed 'General case' 0 CA--C 1.51 -0.575 0 C-N-CA 126.91 2.084 . . . . 0.0 110.52 -179.496 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 29.6 m0 -60.56 -71.43 0.14 Allowed 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 114.524 -1.217 . . . . 0.0 108.107 172.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -50.14 -31.04 12.5 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 124.109 0.964 . . . . 0.0 112.284 175.066 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.06 -54.77 32.81 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 120.273 1.397 . . . . 0.0 110.887 173.167 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 2.5 t -58.22 -35.72 72.09 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.863 0.84 . . . . 0.0 110.286 179.781 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 33.4 mtpt -63.22 -50.61 69.57 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.313 175.245 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -48.43 -55.41 10.96 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.91 0.884 . . . . 0.0 110.644 177.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -66.16 -61.35 1.73 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 179.05 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 81.9 p -107.78 -46.6 3.76 Favored 'General case' 0 C--N 1.338 0.107 0 CA-C-O 120.877 0.37 . . . . 0.0 111.16 -166.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 117.3 -16.94 12.71 Favored Glycine 0 CA--C 1.531 1.074 0 CA-C-N 115.295 -0.866 . . . . 0.0 111.303 -164.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 43.3 t -78.35 62.42 3.0 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 125.327 1.451 . . . . 0.0 110.683 -168.543 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -68.48 28.03 0.27 Allowed Glycine 0 CA--C 1.54 1.646 0 N-CA-C 118.369 2.108 . . . . 0.0 118.369 -157.642 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 58.2 mt-30 -113.06 108.07 16.82 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 120.584 2.192 . . . . 0.0 110.258 -173.473 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -157.44 -168.2 19.57 Favored Glycine 0 C--N 1.339 0.722 0 CA-C-O 119.872 -0.404 . . . . 0.0 112.599 -174.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -156.37 157.97 36.57 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 126.206 1.802 . . . . 0.0 107.718 170.872 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . 0.493 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -89.51 162.82 15.5 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 108.725 -0.842 . . . . 0.0 108.725 178.108 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 20.4 tt0 -139.24 121.16 15.54 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 106.733 -1.58 . . . . 0.0 106.733 168.294 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 72.27 -88.22 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 123.051 0.54 . . . . 0.0 109.884 170.508 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.7 m120 -159.06 52.81 0.39 Allowed 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 128.55 2.74 . . . . 0.0 105.566 161.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 36.3 mt-30 -137.19 -175.19 3.97 Favored 'General case' 0 N--CA 1.444 -0.728 0 C-N-CA 128.933 2.893 . . . . 0.0 103.358 163.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.456 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.6 m -153.86 165.98 34.35 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 119.317 0.962 . . . . 0.0 110.321 -171.088 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 29.1 mtp180 -147.74 152.88 38.51 Favored 'General case' 0 CA--C 1.516 -0.357 0 C-N-CA 124.747 1.219 . . . . 0.0 108.326 -168.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 48.7 t -145.34 148.2 33.14 Favored 'General case' 0 C--N 1.328 -0.35 0 O-C-N 124.48 1.112 . . . . 0.0 109.491 -174.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.536 0.408 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -169.503 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.3 pt? . . . . . 0 N--CA 1.452 -0.351 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -143.09 159.06 17.8 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.25 0 N-CA-C 106.298 -1.741 . . . . 0.0 106.298 -169.244 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -100.95 8.89 42.84 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 -164.014 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 93.3 t -78.7 136.2 24.36 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 O-C-N 121.687 -0.633 . . . . 0.0 110.68 -170.705 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -61.9 95.41 0.06 Allowed 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 125.419 1.488 . . . . 0.0 111.198 -177.177 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.48 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -61.38 120.18 9.96 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.557 170.851 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -83.18 -20.59 34.37 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 124.983 1.427 . . . . 0.0 109.941 151.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -178.83 150.19 0.48 Allowed 'General case' 0 C--N 1.341 0.239 0 C-N-CA 124.432 1.093 . . . . 0.0 109.123 -175.187 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.417 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 57.9 m -47.81 -35.61 10.42 Favored 'General case' 0 C--N 1.333 -0.129 0 C-N-CA 124.787 1.235 . . . . 0.0 113.754 173.079 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.0 p -61.24 -28.56 69.25 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 179.643 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -55.13 -54.65 40.46 Favored 'General case' 0 C--O 1.226 -0.175 0 C-N-CA 123.204 0.602 . . . . 0.0 109.507 174.563 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 11.4 m -55.02 -31.46 61.07 Favored 'General case' 0 N--CA 1.443 -0.811 0 C-N-CA 128.684 2.794 . . . . 0.0 109.253 -174.273 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 39.0 m0 -63.46 -68.34 0.35 Allowed 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 178.474 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -51.07 -32.23 21.43 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 118.345 -0.836 . . . . 0.0 112.163 175.483 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.54 -52.77 63.09 Favored 'General case' 0 C--N 1.339 0.136 0 CA-C-N 120.174 1.352 . . . . 0.0 110.326 174.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.8 t -62.46 -35.06 78.12 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 121.247 0.546 . . . . 0.0 110.434 179.3 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 41.7 mtpt -61.94 -51.92 66.15 Favored 'General case' 0 N--CA 1.44 -0.949 0 CA-C-O 121.788 0.804 . . . . 0.0 109.666 176.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.6 tptm -56.69 -42.41 79.04 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.19 -0.913 . . . . 0.0 111.493 -179.214 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 37.5 t -70.52 -59.49 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.357 0 C-N-CA 124.059 0.944 . . . . 0.0 109.447 179.195 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.7 t -117.63 -46.48 2.66 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.855 0.862 . . . . 0.0 111.966 -166.366 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 125.72 -25.04 5.68 Favored Glycine 0 CA--C 1.53 0.972 0 N-CA-C 111.162 -0.775 . . . . 0.0 111.162 -175.818 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 31.2 t -78.76 73.54 5.31 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 125.413 1.485 . . . . 0.0 108.821 -172.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -70.91 39.91 0.54 Allowed Glycine 0 CA--C 1.54 1.619 0 N-CA-C 116.294 1.278 . . . . 0.0 116.294 -168.451 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 64.2 mt-30 -114.79 115.75 27.52 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 126.217 1.807 . . . . 0.0 108.353 -174.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -170.93 -162.87 24.01 Favored Glycine 0 C--N 1.333 0.366 0 CA-C-N 119.524 1.056 . . . . 0.0 111.257 -176.74 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 4.6 pttp -167.06 164.81 15.91 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 165.319 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . 0.48 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -87.39 172.11 10.07 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 119.999 -0.68 . . . . 0.0 110.153 -176.653 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -145.31 121.67 10.95 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 105.098 -2.186 . . . . 0.0 105.098 172.53 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 64.5 t30 68.86 -93.4 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 119.372 0.987 . . . . 0.0 110.23 169.723 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 26.1 m120 -153.8 52.03 0.69 Allowed 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 128.315 2.646 . . . . 0.0 106.002 161.532 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -139.17 177.58 7.8 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 131.07 3.748 . . . . 0.0 102.609 175.238 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.447 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.3 m -150.56 163.68 37.88 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-N 120.624 1.556 . . . . 0.0 111.647 -173.083 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 50.7 mtp180 -142.39 150.8 41.15 Favored 'General case' 0 CA--C 1.512 -0.518 0 C-N-CA 124.061 0.944 . . . . 0.0 109.686 -170.395 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 52.5 t -141.21 133.88 28.67 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 124.658 1.224 . . . . 0.0 112.694 -174.668 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 . . . . . 0 N--CA 1.451 -0.379 0 C-N-CA 126.573 1.949 . . . . 0.0 109.715 178.129 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.4 pt? . . . . . 0 N--CA 1.451 -0.402 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -137.07 162.57 33.87 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.18 0 N-CA-C 107.108 -1.441 . . . . 0.0 107.108 -167.095 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -90.56 -16.91 27.9 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 124.501 1.12 . . . . 0.0 112.621 -172.147 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 58.6 t -75.21 134.59 29.01 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 CA-C-N 118.795 0.725 . . . . 0.0 111.799 -157.321 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.2 tmtt? -37.7 106.31 0.05 OUTLIER 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 127.578 2.351 . . . . 0.0 112.104 173.067 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.499 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -75.28 135.22 40.95 Favored 'General case' 0 CA--C 1.515 -0.388 0 C-N-CA 120.332 -0.547 . . . . 0.0 109.915 168.907 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -95.12 -16.37 22.66 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 158.512 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 178.51 166.43 0.83 Allowed 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 106.099 -1.815 . . . . 0.0 106.099 -172.726 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.9 p -61.31 -39.33 90.09 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 124.06 0.944 . . . . 0.0 111.48 172.733 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.6 p -56.83 -40.96 76.99 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 122.86 0.464 . . . . 0.0 111.0 -177.455 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -40.66 -56.87 2.02 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.634 1.174 . . . . 0.0 111.078 170.546 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 23.7 m -57.95 -28.37 64.25 Favored 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 128.026 2.53 . . . . 0.0 109.73 -173.311 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 33.2 m0 -64.65 -66.15 0.58 Allowed 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 107.186 -1.413 . . . . 0.0 107.186 177.534 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -51.67 -33.14 32.54 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 118.085 -0.959 . . . . 0.0 111.696 174.409 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.85 -54.33 36.69 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 120.107 1.321 . . . . 0.0 110.742 175.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 5.1 t -58.12 -37.16 74.06 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.071 0.463 . . . . 0.0 110.46 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.419 ' CG ' ' HA3' ' A' ' 25' ' ' GLY . 40.3 mtmt -63.5 -58.71 6.15 Favored 'General case' 0 N--CA 1.44 -0.943 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.706 177.079 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 64.3 mmtt -49.55 -47.12 49.3 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.324 1.05 . . . . 0.0 111.772 178.11 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 43.7 t -70.87 -60.02 2.86 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.77 0 C-N-CA 123.962 0.905 . . . . 0.0 109.15 -178.08 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.2 m -118.58 -41.54 2.81 Favored 'General case' 0 N--CA 1.439 -1.004 0 C-N-CA 123.591 0.756 . . . . 0.0 110.987 -161.103 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 120.81 -21.36 8.44 Favored Glycine 0 CA--C 1.534 1.24 0 C-N-CA 124.925 1.25 . . . . 0.0 112.336 -177.778 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 21.5 m -88.22 61.12 6.09 Favored 'General case' 0 C--O 1.223 -0.297 0 C-N-CA 124.709 1.204 . . . . 0.0 110.331 -160.653 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.419 ' HA3' ' CG ' ' A' ' 19' ' ' LYS . . . -64.15 23.39 0.09 OUTLIER Glycine 0 CA--C 1.54 1.623 0 N-CA-C 120.414 2.926 . . . . 0.0 120.414 -152.626 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -108.38 118.2 36.16 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 121.129 2.465 . . . . 0.0 109.903 -176.3 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -164.04 -170.51 29.06 Favored Glycine 0 CA--C 1.528 0.876 0 N-CA-C 112.195 -0.362 . . . . 0.0 112.195 -174.589 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -156.34 156.08 33.33 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 125.138 1.375 . . . . 0.0 107.879 174.121 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . 0.499 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 0.0 OUTLIER -92.14 160.57 15.13 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 178.485 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.8 tp-100 -133.62 126.69 31.41 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 105.896 -1.89 . . . . 0.0 105.896 165.659 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.2 t30 69.04 -78.91 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 164.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -166.63 44.86 0.06 Allowed 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 130.411 3.484 . . . . 0.0 108.894 170.388 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -147.61 179.35 7.75 Favored 'General case' 0 N--CA 1.442 -0.825 0 C-N-CA 128.875 2.87 . . . . 0.0 104.167 177.453 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.432 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 5.0 m -153.94 164.75 37.9 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 119.894 1.224 . . . . 0.0 110.399 -169.422 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 73.4 mtp180 -140.0 152.93 46.68 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 125.651 1.58 . . . . 0.0 108.976 -178.685 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 36.8 t -132.59 162.63 30.8 Favored 'General case' 0 C--O 1.224 -0.26 0 O-C-N 124.652 1.22 . . . . 0.0 109.34 178.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.534 0.355 0 CA-C-N 118.651 0.66 . . . . 0.0 111.365 -177.294 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.456 -0.169 0 N-CA-C 111.992 0.367 . . . . 0.0 111.992 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -126.1 167.09 21.13 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.995 0 N-CA-C 105.843 -1.91 . . . . 0.0 105.843 176.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -127.72 57.04 1.54 Allowed 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 122.0 0.905 . . . . 0.0 109.892 -177.197 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 43.6 t -128.37 143.8 39.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 N-CA-C 108.231 -1.025 . . . . 0.0 108.231 167.187 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -55.37 132.77 48.94 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 125.19 1.396 . . . . 0.0 113.312 -174.351 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.459 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -86.2 139.1 31.36 Favored 'General case' 0 CA--C 1.516 -0.363 0 C-N-CA 123.12 0.568 . . . . 0.0 109.672 164.107 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -91.01 -20.65 21.87 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 124.171 0.92 . . . . 0.0 109.543 154.497 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -178.91 173.47 1.2 Allowed 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 126.972 2.109 . . . . 0.0 106.273 -172.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 31.3 m -64.15 -32.86 74.6 Favored 'General case' 0 N--CA 1.462 0.135 0 C-N-CA 123.668 0.787 . . . . 0.0 112.631 173.332 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -54.12 -54.62 37.0 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 122.134 0.969 . . . . 0.0 110.723 -172.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.5 mp0 -32.57 -57.64 0.34 Allowed 'General case' 0 N--CA 1.429 -1.514 0 C-N-CA 128.07 2.548 . . . . 0.0 114.285 168.577 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 14.5 m -54.17 -29.28 45.04 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 126.376 1.87 . . . . 0.0 109.679 -175.839 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 30.9 m0 -66.92 -66.54 0.54 Allowed 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 106.214 -1.772 . . . . 0.0 106.214 -179.694 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -50.36 -32.34 17.08 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 124.018 0.927 . . . . 0.0 111.392 174.815 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.85 -56.42 19.54 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 119.578 1.081 . . . . 0.0 109.732 175.056 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -60.15 -34.05 73.02 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-O 121.048 0.451 . . . . 0.0 111.057 179.478 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 32.6 mtpt -63.72 -54.58 33.2 Favored 'General case' 0 N--CA 1.442 -0.847 0 O-C-N 121.618 -0.676 . . . . 0.0 111.103 176.793 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -57.19 -39.27 75.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.521 178.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 31.8 t -73.32 -67.89 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.431 -1.4 0 C-N-CA 124.293 1.037 . . . . 0.0 109.218 179.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -107.29 -40.23 5.45 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 122.956 0.502 . . . . 0.0 112.063 -170.481 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 117.61 -15.97 12.64 Favored Glycine 0 CA--C 1.532 1.152 0 C-N-CA 124.608 1.099 . . . . 0.0 110.822 -166.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 30.4 t -82.22 64.82 7.07 Favored 'General case' 0 CA--C 1.527 0.094 0 C-N-CA 124.353 1.061 . . . . 0.0 110.092 -166.568 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -70.97 38.38 0.52 Allowed Glycine 0 CA--C 1.535 1.339 0 N-CA-C 117.916 1.926 . . . . 0.0 117.916 -160.06 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 -121.04 114.07 20.96 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 120.071 1.936 . . . . 0.0 108.58 -179.189 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -158.22 -177.69 31.55 Favored Glycine 0 CA--C 1.523 0.534 0 N-CA-C 111.52 -0.632 . . . . 0.0 111.52 -175.498 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -153.35 145.29 23.62 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 106.922 -1.51 . . . . 0.0 106.922 177.637 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . 0.459 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -88.51 165.88 14.57 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 178.663 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -138.77 118.33 12.98 Favored 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 105.656 -1.979 . . . . 0.0 105.656 171.749 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 63.46 -89.32 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.455 0.702 . . . . 0.0 110.556 172.549 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.2 m120 -153.25 53.65 0.75 Allowed 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 127.001 2.121 . . . . 0.0 107.07 168.142 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -143.62 166.17 25.58 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 103.036 -2.949 . . . . 0.0 103.036 173.038 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.427 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.2 m -143.12 158.31 43.73 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 120.853 1.66 . . . . 0.0 110.257 -174.436 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 33.5 mtp180 -142.82 154.12 43.87 Favored 'General case' 0 CA--C 1.514 -0.433 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 -172.024 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 41.8 t -133.4 140.71 47.49 Favored 'General case' 0 C--N 1.328 -0.331 0 O-C-N 124.16 0.913 . . . . 0.0 110.15 -172.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 82.8 t80 . . . . . 0 N--CA 1.455 -0.222 0 C-N-CA 125.568 1.547 . . . . 0.0 109.81 -163.258 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.535 ' HA ' ' HG3' ' A' ' 35' ' ' ARG . 2.5 pt? . . . . . 0 N--CA 1.453 -0.294 0 N-CA-C 114.926 1.454 . . . . 0.0 114.926 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -138.98 154.2 25.7 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.495 0 N-CA-C 104.348 -2.464 . . . . 0.0 104.348 -165.559 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -122.89 35.16 4.94 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 119.635 1.107 . . . . 0.0 111.089 -171.252 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.3 p -77.43 136.98 23.22 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-N 116.141 -0.481 . . . . 0.0 109.774 172.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 37.5 mtpt -66.16 96.01 0.31 Allowed 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.453 1.101 . . . . 0.0 112.221 -175.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.526 ' HB3' ' HB2' ' A' ' 29' ' ' CYS . 1.9 p -61.95 131.42 49.64 Favored 'General case' 0 CA--C 1.519 -0.213 0 O-C-N 123.789 0.681 . . . . 0.0 110.847 176.571 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 81.8 m-85 -88.36 -26.64 22.09 Favored 'General case' 0 N--CA 1.444 -0.771 0 C-N-CA 125.627 1.571 . . . . 0.0 108.749 155.194 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -165.87 160.27 16.73 Favored 'General case' 0 C--N 1.344 0.364 0 C-N-CA 123.548 0.739 . . . . 0.0 109.815 179.622 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.513 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 1.9 p -58.26 -41.24 83.81 Favored 'General case' 0 C--N 1.333 -0.118 0 C-N-CA 123.924 0.889 . . . . 0.0 111.404 173.713 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.39 -24.98 63.89 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 122.81 0.444 . . . . 0.0 111.672 -178.332 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 45.1 tt0 -61.85 -44.56 96.58 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 121.708 -0.62 . . . . 0.0 111.204 172.428 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 29.0 m -59.6 -27.91 66.71 Favored 'General case' 0 N--CA 1.439 -0.993 0 C-N-CA 125.687 1.595 . . . . 0.0 108.871 -177.079 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 36.5 m0 -65.98 -67.5 0.44 Allowed 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 107.444 -1.317 . . . . 0.0 107.444 178.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -53.26 -28.32 27.03 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.921 0.889 . . . . 0.0 111.57 175.019 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.02 -55.65 17.71 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 119.549 1.068 . . . . 0.0 110.23 174.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.2 t -61.08 -32.82 72.47 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 110.439 -0.208 . . . . 0.0 110.439 -179.434 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.6 mtmp? -63.41 -61.39 2.38 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-O 121.156 0.503 . . . . 0.0 110.853 174.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 17.1 pttm -59.52 -31.31 69.27 Favored 'General case' 0 N--CA 1.44 -0.964 0 N-CA-C 112.403 0.52 . . . . 0.0 112.403 -174.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 53.9 t -79.42 -57.57 5.03 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.514 0 C-N-CA 124.281 1.032 . . . . 0.0 109.865 176.309 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 13.2 t -140.64 25.34 2.19 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 113.753 1.02 . . . . 0.0 113.753 -162.844 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.35 -24.19 0.27 Allowed Glycine 0 CA--C 1.537 1.465 0 O-C-N 120.902 -1.123 . . . . 0.0 115.247 177.219 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 47.4 m -87.92 64.98 8.12 Favored 'General case' 0 C--O 1.223 -0.324 0 O-C-N 121.122 -1.223 . . . . 0.0 110.603 -155.803 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -66.79 23.49 0.18 Allowed Glycine 0 CA--C 1.538 1.513 0 N-CA-C 119.589 2.596 . . . . 0.0 119.589 -154.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -111.7 121.91 46.39 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 120.736 2.268 . . . . 0.0 109.709 -175.078 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -170.82 -166.08 29.15 Favored Glycine 0 C--N 1.337 0.613 0 CA-C-N 118.742 0.701 . . . . 0.0 111.832 -177.675 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.63 155.54 21.94 Favored 'General case' 0 CA--C 1.52 -0.177 0 C-N-CA 124.8 1.24 . . . . 0.0 108.586 174.51 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . 0.526 ' HB2' ' HB3' ' A' ' 8' ' ' CYS . 0.2 OUTLIER -91.37 166.15 13.04 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 -178.594 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -148.79 121.64 8.73 Favored 'General case' 0 C--O 1.22 -0.483 0 N-CA-C 105.345 -2.095 . . . . 0.0 105.345 -179.197 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 57.65 -94.94 0.05 Allowed 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.913 1.233 . . . . 0.0 109.717 178.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 21.0 m120 -147.22 61.47 1.17 Allowed 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 126.509 1.924 . . . . 0.0 106.926 165.348 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 21.4 mp0 -147.09 173.64 12.3 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 129.5 3.12 . . . . 0.0 105.062 177.547 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.468 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.7 m -150.52 157.08 42.59 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 -176.683 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.535 ' HG3' ' HA ' ' A' ' 3' ' ' LEU . 0.0 OUTLIER -148.06 143.26 27.07 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 124.213 1.005 . . . . 0.0 109.036 -174.053 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 40.7 t -131.45 148.25 52.63 Favored 'General case' 0 C--N 1.338 0.09 0 O-C-N 123.853 0.72 . . . . 0.0 110.47 -164.385 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 87.7 t80 . . . . . 0 N--CA 1.455 -0.218 0 C-N-CA 125.901 1.68 . . . . 0.0 109.722 -168.276 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.533 ' HA ' ' HG3' ' A' ' 35' ' ' ARG . 2.5 pt? . . . . . 0 N--CA 1.454 -0.275 0 N-CA-C 115.184 1.55 . . . . 0.0 115.184 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -136.17 159.2 38.78 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.66 0 N-CA-C 103.984 -2.598 . . . . 0.0 103.984 -170.589 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -137.27 47.53 2.1 Favored 'General case' 0 C--N 1.328 -0.354 0 O-C-N 120.901 -1.124 . . . . 0.0 109.234 -173.085 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 87.7 t -97.6 139.35 20.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 171.534 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.72 105.91 0.18 Allowed 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -175.22 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.526 ' HB3' ' HB2' ' A' ' 29' ' ' CYS . 1.2 p -67.64 133.84 50.08 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 169.437 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -78.86 -33.33 45.95 Favored 'General case' 0 N--CA 1.454 -0.236 0 O-C-N 124.335 1.022 . . . . 0.0 109.003 151.613 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -172.76 156.86 3.59 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 124.213 1.005 . . . . 0.0 108.374 -175.33 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.472 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 58.8 m -46.94 -45.88 21.03 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 124.488 1.115 . . . . 0.0 112.617 175.523 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.3 m -63.83 -11.7 29.61 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 -177.464 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.9 -48.41 31.03 Favored 'General case' 0 C--O 1.215 -0.74 0 CA-C-N 119.29 0.95 . . . . 0.0 109.271 168.427 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 18.4 m -48.71 -29.91 4.97 Favored 'General case' 0 CA--C 1.513 -0.473 0 C-N-CA 125.944 1.698 . . . . 0.0 110.1 -178.606 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 42.2 m0 -62.31 -68.09 0.36 Allowed 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 107.01 -1.478 . . . . 0.0 107.01 175.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -52.89 -28.51 23.54 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 117.789 -1.101 . . . . 0.0 112.444 173.931 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.3 -53.46 52.49 Favored 'General case' 0 C--O 1.228 -0.065 0 CA-C-N 121.306 1.866 . . . . 0.0 109.903 174.7 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -61.95 -34.14 75.56 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.122 178.535 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 40.8 mtmt -65.31 -52.15 55.93 Favored 'General case' 0 N--CA 1.445 -0.695 0 O-C-N 121.835 -0.541 . . . . 0.0 111.502 176.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 65.6 mttt -49.76 -45.95 50.05 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.243 1.417 . . . . 0.0 109.938 177.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 95.1 t -76.79 -69.84 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.424 -1.732 0 C-N-CA 124.252 1.021 . . . . 0.0 109.887 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 47.0 p -98.31 -49.04 4.83 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 122.457 0.303 . . . . 0.0 111.445 -169.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 123.35 -17.52 7.91 Favored Glycine 0 CA--C 1.533 1.207 0 C-N-CA 124.961 1.267 . . . . 0.0 111.193 -163.434 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 5.0 m -81.9 64.66 6.69 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 124.483 1.113 . . . . 0.0 110.612 -165.387 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -71.77 38.93 0.63 Allowed Glycine 0 CA--C 1.539 1.539 0 N-CA-C 118.26 2.064 . . . . 0.0 118.26 -155.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -123.27 133.03 54.21 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 120.312 2.056 . . . . 0.0 109.171 -175.605 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 179.01 -164.31 32.51 Favored Glycine 0 CA--C 1.524 0.647 0 CA-C-N 119.24 0.927 . . . . 0.0 111.181 -177.375 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.75 158.07 32.9 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 123.946 0.898 . . . . 0.0 109.108 166.806 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . 0.526 ' HB2' ' HB3' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -91.98 165.32 13.27 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 -178.95 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 -146.42 115.8 7.09 Favored 'General case' 0 N--CA 1.444 -0.761 0 N-CA-C 105.644 -1.984 . . . . 0.0 105.644 179.184 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 71.48 -83.3 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 118.743 0.701 . . . . 0.0 110.325 170.059 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 36.3 m120 -162.35 55.58 0.23 Allowed 'General case' 0 N--CA 1.463 0.181 0 C-N-CA 130.026 3.33 . . . . 0.0 104.639 164.102 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -143.93 174.44 10.84 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 129.278 3.031 . . . . 0.0 103.431 177.009 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.448 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.2 m -154.41 158.67 40.37 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-N 120.525 1.511 . . . . 0.0 108.952 -173.456 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.533 ' HG3' ' HA ' ' A' ' 3' ' ' LEU . 0.0 OUTLIER -147.56 140.58 25.03 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 123.594 0.758 . . . . 0.0 109.684 -173.519 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 41.1 t -122.58 148.55 45.09 Favored 'General case' 0 C--N 1.34 0.195 0 C-N-CA 123.816 0.846 . . . . 0.0 110.49 -168.283 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 90.9 t80 . . . . . 0 N--CA 1.452 -0.359 0 C-N-CA 126.101 1.76 . . . . 0.0 109.846 -173.747 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.442 ' HA ' ' HG2' ' A' ' 35' ' ' ARG . 2.4 pt? . . . . . 0 N--CA 1.448 -0.537 0 N-CA-C 110.49 -0.189 . . . . 0.0 110.49 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -145.05 160.21 13.67 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.219 0 N-CA-C 106.403 -1.702 . . . . 0.0 106.403 -163.131 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -120.42 32.58 5.95 Favored 'General case' 0 C--N 1.332 -0.159 0 C-N-CA 123.542 0.737 . . . . 0.0 110.737 -173.378 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 97.0 t -82.88 133.87 28.15 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 N-CA-C 108.115 -1.069 . . . . 0.0 108.115 171.681 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.1 mtpp -65.26 94.24 0.16 Allowed 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 125.701 1.6 . . . . 0.0 112.057 -173.606 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.498 ' HB3' ' HB2' ' A' ' 29' ' ' CYS . 1.7 p -58.44 136.02 57.38 Favored 'General case' 0 N--CA 1.464 0.238 0 O-C-N 123.436 0.46 . . . . 0.0 110.616 173.517 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 82.0 m-85 -91.09 -27.25 18.7 Favored 'General case' 0 N--CA 1.445 -0.697 0 C-N-CA 126.592 1.957 . . . . 0.0 108.306 152.666 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -158.68 162.05 37.17 Favored 'General case' 0 C--N 1.344 0.329 0 CA-C-N 118.605 0.639 . . . . 0.0 110.834 179.087 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.502 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 1.8 p -61.88 -45.07 95.36 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 124.875 1.27 . . . . 0.0 111.234 173.003 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.9 p -55.04 -32.25 61.72 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 121.178 0.513 . . . . 0.0 111.092 -178.147 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 48.7 tt0 -51.98 -48.78 64.23 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 123.607 0.763 . . . . 0.0 111.937 172.493 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 32.9 m -56.62 -30.42 63.25 Favored 'General case' 0 N--CA 1.444 -0.774 0 C-N-CA 126.606 1.962 . . . . 0.0 109.006 -177.985 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 32.2 m0 -64.56 -64.08 0.97 Allowed 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 107.494 -1.299 . . . . 0.0 107.494 179.832 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -51.6 -35.41 41.39 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 118.385 -0.817 . . . . 0.0 111.463 173.563 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.66 -56.15 18.0 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 119.872 1.214 . . . . 0.0 110.559 -179.038 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -57.71 -36.55 72.14 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.37 0.605 . . . . 0.0 110.472 179.32 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.452 ' CG ' ' HA3' ' A' ' 25' ' ' GLY . 1.7 mtmp? -62.8 -50.74 69.8 Favored 'General case' 0 N--CA 1.435 -1.202 0 CA-C-N 115.589 -0.732 . . . . 0.0 112.442 177.507 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 65.9 mmtt -50.22 -52.99 31.29 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 123.66 0.784 . . . . 0.0 111.024 178.272 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -67.93 -63.95 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 CA-C-N 118.177 0.444 . . . . 0.0 111.651 177.537 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.9 m -116.92 -37.79 3.54 Favored 'General case' 0 N--CA 1.442 -0.838 0 C-N-CA 123.581 0.753 . . . . 0.0 110.465 -155.652 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 116.94 -14.83 13.92 Favored Glycine 0 CA--C 1.531 1.055 0 C-N-CA 123.196 0.427 . . . . 0.0 113.183 -178.757 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.7 t -82.04 67.29 7.98 Favored 'General case' 0 N--CA 1.465 0.313 0 O-C-N 121.601 -0.94 . . . . 0.0 109.621 -166.663 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.452 ' HA3' ' CG ' ' A' ' 19' ' ' LYS . . . -74.08 37.08 0.93 Allowed Glycine 0 CA--C 1.537 1.457 0 N-CA-C 116.964 1.546 . . . . 0.0 116.964 -159.407 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -122.65 126.71 48.16 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 125.814 1.645 . . . . 0.0 107.522 -175.481 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -179.37 -172.43 43.54 Favored Glycine 0 CA--C 1.525 0.663 0 CA-C-N 119.246 0.93 . . . . 0.0 111.922 -176.091 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.28 157.13 42.73 Favored 'General case' 0 C--O 1.232 0.135 0 C-N-CA 125.62 1.568 . . . . 0.0 107.457 166.878 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . 0.502 ' HB3' ' HA ' ' A' ' 11' ' ' SER . 0.5 OUTLIER -89.74 151.63 21.73 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 178.474 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 54.7 tp60 -124.09 112.88 17.65 Favored 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 105.923 -1.88 . . . . 0.0 105.923 177.85 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 62.95 -89.77 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 119.256 0.934 . . . . 0.0 110.099 174.567 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -150.28 56.22 0.94 Allowed 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 126.713 2.005 . . . . 0.0 107.916 164.128 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -135.55 179.75 6.14 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 129.313 3.045 . . . . 0.0 103.953 166.047 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.455 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.2 m -150.43 147.44 27.55 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-N 119.457 1.026 . . . . 0.0 109.319 -178.265 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.442 ' HG2' ' HA ' ' A' ' 3' ' ' LEU . 41.7 mtt180 -140.18 136.59 33.61 Favored 'General case' 0 CA--C 1.513 -0.464 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 -173.407 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.8 t -126.16 167.46 15.38 Favored 'General case' 0 C--O 1.225 -0.187 0 O-C-N 124.577 1.173 . . . . 0.0 110.103 -162.929 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 28.6 t80 . . . . . 0 N--CA 1.452 -0.333 0 C-N-CA 124.394 1.078 . . . . 0.0 109.429 166.65 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.1 pt? . . . . . 0 CA--C 1.519 -0.219 0 N-CA-C 112.759 0.652 . . . . 0.0 112.759 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -132.15 171.13 18.57 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.208 0 N-CA-C 106.17 -1.789 . . . . 0.0 106.17 -170.382 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -133.42 83.44 2.05 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-O 122.26 1.028 . . . . 0.0 110.249 168.451 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 93.5 t -125.78 138.67 53.74 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 CA-C-N 113.956 -1.474 . . . . 0.0 107.374 160.819 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -68.58 106.25 2.52 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 124.495 1.118 . . . . 0.0 111.32 -169.34 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.522 ' HB3' ' HB2' ' A' ' 29' ' ' CYS . 5.8 p -66.67 130.44 43.18 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 120.784 0.326 . . . . 0.0 110.965 174.301 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -78.95 -36.21 41.99 Favored 'General case' 0 N--CA 1.442 -0.832 0 C-N-CA 125.351 1.46 . . . . 0.0 108.124 148.069 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -161.47 154.71 21.17 Favored 'General case' 0 C--O 1.222 -0.359 0 CA-C-N 118.44 0.563 . . . . 0.0 112.008 -177.451 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.507 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 27.9 m -50.75 -41.08 56.19 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 123.862 0.865 . . . . 0.0 112.583 173.606 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.31 -20.08 57.82 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 123.058 0.543 . . . . 0.0 112.292 -179.0 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 70.7 tt0 -72.03 -44.03 64.03 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 124.083 0.953 . . . . 0.0 110.79 176.05 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 20.8 m -55.16 -29.48 57.87 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 126.635 1.974 . . . . 0.0 108.874 179.21 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 36.1 m0 -64.83 -68.42 0.36 Allowed 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 179.288 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -54.71 -26.51 34.21 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 123.909 0.884 . . . . 0.0 111.557 175.938 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.14 -55.5 18.33 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 119.943 1.247 . . . . 0.0 109.806 174.003 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 3.8 t -55.16 -38.68 68.59 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.974 0.892 . . . . 0.0 110.278 178.579 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.9 mtmt -63.23 -53.6 50.5 Favored 'General case' 0 N--CA 1.434 -1.235 0 CA-C-N 115.159 -0.928 . . . . 0.0 110.519 177.133 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -52.98 -40.96 64.13 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 116.924 -1.512 . . . . 0.0 113.119 -179.007 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -67.98 -60.74 2.18 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 CA-C-N 119.314 0.961 . . . . 0.0 111.318 169.665 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 47.5 p -113.54 -65.96 1.13 Allowed 'General case' 0 N--CA 1.458 -0.065 0 CA-C-O 121.306 0.575 . . . . 0.0 110.45 -168.168 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 148.17 -23.05 1.41 Allowed Glycine 0 CA--C 1.529 0.963 0 CA-C-N 115.137 -0.938 . . . . 0.0 113.171 -170.757 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.2 p -82.44 72.36 9.51 Favored 'General case' 0 C--N 1.333 -0.139 0 O-C-N 121.553 -0.969 . . . . 0.0 109.666 -168.875 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -70.51 50.91 0.83 Allowed Glycine 0 CA--C 1.537 1.452 0 N-CA-C 117.034 1.574 . . . . 0.0 117.034 -163.057 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -131.53 101.9 5.7 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 125.421 1.488 . . . . 0.0 109.788 -165.188 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -161.82 -165.85 19.49 Favored Glycine 0 CA--C 1.525 0.681 0 CA-C-N 118.242 0.474 . . . . 0.0 113.467 -170.798 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 20.6 ttmm -162.98 144.91 10.14 Favored 'General case' 0 C--O 1.232 0.164 0 N-CA-C 107.403 -1.332 . . . . 0.0 107.403 178.853 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . 0.522 ' HB2' ' HB3' ' A' ' 8' ' ' CYS . 0.5 OUTLIER -87.64 162.19 17.27 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 -179.54 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.4 tp-100 -143.27 132.71 23.47 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 106.929 -1.508 . . . . 0.0 106.929 171.221 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 64.08 -91.26 0.03 OUTLIER 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 123.214 0.606 . . . . 0.0 109.975 170.065 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 23.2 m120 -155.42 62.92 0.61 Allowed 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 127.608 2.363 . . . . 0.0 105.781 158.234 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 17.2 mp0 -147.69 179.46 7.68 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 130.951 3.701 . . . . 0.0 103.983 174.267 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.444 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.5 m -152.84 161.17 42.89 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 121.11 -0.994 . . . . 0.0 109.572 -174.598 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.8 mtt85 -138.05 152.83 49.2 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 124.416 1.086 . . . . 0.0 109.26 179.406 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 53.5 t -136.45 137.72 40.72 Favored 'General case' 0 CA--C 1.522 -0.132 0 C-N-CA 124.317 1.047 . . . . 0.0 108.314 179.828 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.141 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 -153.933 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.8 pt? . . . . . 0 N--CA 1.453 -0.306 0 N-CA-C 106.592 -1.633 . . . . 0.0 106.592 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -139.41 159.21 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.176 0 N-CA-C 106.432 -1.692 . . . . 0.0 106.432 -174.212 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -92.89 -9.67 39.33 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.253 1.021 . . . . 0.0 112.244 -171.5 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 59.2 t -72.09 134.37 30.01 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 C-N-CA 119.953 -0.699 . . . . 0.0 110.55 -160.777 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -58.08 101.2 0.07 Allowed 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 125.568 1.547 . . . . 0.0 111.531 -174.385 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.464 ' HB3' ' HB2' ' A' ' 29' ' ' CYS . 0.5 OUTLIER -68.25 129.13 39.0 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 109.265 -0.642 . . . . 0.0 109.265 168.869 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -91.7 -16.8 26.41 Favored 'General case' 0 N--CA 1.454 -0.258 0 O-C-N 124.353 1.033 . . . . 0.0 109.316 150.437 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -169.7 148.15 3.59 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 123.701 0.801 . . . . 0.0 109.069 -178.698 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.517 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 27.1 m -47.37 -39.64 15.65 Favored 'General case' 0 N--CA 1.46 0.034 0 C-N-CA 124.551 1.14 . . . . 0.0 112.092 170.899 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.2 p -61.37 -22.93 65.41 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-O 118.889 -0.577 . . . . 0.0 112.25 -177.933 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.86 -47.88 56.9 Favored 'General case' 0 C--O 1.216 -0.678 0 CA-C-N 119.437 1.017 . . . . 0.0 109.283 174.372 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 27.5 m -47.9 -28.32 2.6 Favored 'General case' 0 CA--C 1.512 -0.513 0 C-N-CA 126.227 1.811 . . . . 0.0 110.441 -177.486 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 39.0 m0 -64.34 -67.79 0.4 Allowed 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.339 -1.3 . . . . 0.0 107.735 176.633 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -52.24 -27.95 16.81 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-O 118.164 -0.922 . . . . 0.0 111.725 172.878 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.07 -61.57 1.97 Allowed 'General case' 0 C--N 1.339 0.151 0 CA-C-N 121.035 1.743 . . . . 0.0 110.986 175.929 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -57.81 -30.41 65.68 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.249 0.547 . . . . 0.0 110.533 179.295 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.7 mtmt -67.89 -49.72 60.36 Favored 'General case' 0 N--CA 1.443 -0.79 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 172.742 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 51.6 mttt -50.21 -49.64 52.07 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 124.695 1.198 . . . . 0.0 109.789 178.771 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -67.45 -67.21 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 CA-C-N 118.146 0.43 . . . . 0.0 111.412 173.762 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 18.5 m -114.26 -49.46 2.84 Favored 'General case' 0 N--CA 1.438 -1.046 0 C-N-CA 123.255 0.622 . . . . 0.0 110.425 -158.045 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 133.16 -15.79 4.74 Favored Glycine 0 CA--C 1.533 1.189 0 C-N-CA 123.013 0.339 . . . . 0.0 112.829 -171.729 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.0 m -79.27 61.74 3.44 Favored 'General case' 0 C--O 1.225 -0.191 0 C-N-CA 124.393 1.077 . . . . 0.0 111.868 -164.624 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -70.67 1.6 21.16 Favored Glycine 0 CA--C 1.536 1.36 0 N-CA-C 116.159 1.223 . . . . 0.0 116.159 -158.71 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 60.0 mt-30 -90.66 110.81 21.98 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 119.846 1.823 . . . . 0.0 108.14 -176.631 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -164.44 -161.93 14.45 Favored Glycine 0 C--N 1.337 0.638 0 CA-C-N 118.741 0.701 . . . . 0.0 114.672 -170.879 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 6.9 mttp -169.29 150.58 4.35 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 123.935 0.894 . . . . 0.0 109.175 -175.179 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . 0.517 ' HB3' ' HA ' ' A' ' 11' ' ' SER . 0.1 OUTLIER -94.32 160.47 14.66 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.932 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.0 tt0 -134.6 131.69 38.14 Favored 'General case' 0 N--CA 1.444 -0.767 0 N-CA-C 105.296 -2.113 . . . . 0.0 105.296 165.974 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 21.1 t30 67.22 -90.81 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 118.713 0.688 . . . . 0.0 110.574 163.522 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 31.1 m120 -156.16 53.83 0.56 Allowed 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 127.968 2.507 . . . . 0.0 106.107 164.032 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 25.0 mp0 -151.05 176.9 10.7 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 129.391 3.076 . . . . 0.0 103.818 -179.802 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.6 m -160.41 167.84 26.46 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 120.21 1.368 . . . . 0.0 111.137 -165.47 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 33.6 mtp180 -146.58 160.83 41.66 Favored 'General case' 0 CA--C 1.518 -0.266 0 C-N-CA 125.054 1.342 . . . . 0.0 109.255 179.809 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 29.0 p -131.32 177.89 7.13 Favored 'General case' 0 CA--C 1.513 -0.445 0 O-C-N 124.507 1.129 . . . . 0.0 109.88 162.399 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 3.8 p90 . . . . . 0 N--CA 1.446 -0.633 0 C-N-CA 124.197 0.999 . . . . 0.0 111.879 -172.356 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.2 pt? . . . . . 0 N--CA 1.452 -0.371 0 CA-C-O 120.533 0.206 . . . . 0.0 110.582 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -143.61 158.92 16.74 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.205 0 N-CA-C 106.063 -1.828 . . . . 0.0 106.063 -160.551 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -120.39 30.22 7.06 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 121.745 0.783 . . . . 0.0 112.352 -174.226 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 52.4 t -85.79 134.42 27.26 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 171.787 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.6 mptt -69.82 107.29 3.46 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 125.443 1.497 . . . . 0.0 112.056 -165.181 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.501 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -63.3 126.16 26.51 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 123.896 0.878 . . . . 0.0 109.968 171.219 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -82.73 -21.55 34.72 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 124.873 1.358 . . . . 0.0 109.173 153.128 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -175.64 179.24 1.45 Allowed 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 126.174 1.79 . . . . 0.0 106.588 -176.156 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 39.7 m -70.98 -34.02 70.99 Favored 'General case' 0 N--CA 1.461 0.104 0 C-N-CA 125.497 1.519 . . . . 0.0 113.093 173.779 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -52.88 -56.3 16.84 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-O 122.065 0.936 . . . . 0.0 110.963 -172.36 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . 0.269 8.4 mp0 -20.97 -59.44 0.03 OUTLIER 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 128.93 2.892 . . . . 0.0 115.761 159.4 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 31.6 m -61.08 -27.29 68.25 Favored 'General case' 0 N--CA 1.442 -0.828 0 C-N-CA 125.706 1.602 . . . . 0.0 109.09 -172.295 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 35.9 m0 -69.7 -64.85 0.8 Allowed 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 -179.007 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -52.78 -30.79 34.96 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 124.049 0.939 . . . . 0.0 110.869 174.76 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.22 -57.98 8.71 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 119.385 0.993 . . . . 0.0 110.329 173.615 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -59.21 -32.21 69.73 Favored 'General case' 0 CA--C 1.521 -0.15 0 O-C-N 121.989 -0.444 . . . . 0.0 111.063 -179.461 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.465 ' CG ' ' HA3' ' A' ' 25' ' ' GLY . 30.6 mtmt -64.95 -57.09 9.65 Favored 'General case' 0 N--CA 1.437 -1.122 0 CA-C-O 120.797 0.332 . . . . 0.0 111.1 176.2 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.2 mtpt -56.46 -38.27 71.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.591 -179.858 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 40.6 t -70.03 -61.94 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.427 -1.615 0 C-N-CA 123.848 0.859 . . . . 0.0 109.172 176.948 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.2 m -120.6 -45.69 2.4 Favored 'General case' 0 N--CA 1.436 -1.137 0 C-N-CA 123.628 0.771 . . . . 0.0 111.16 -162.877 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 126.26 -20.05 6.3 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 124.636 1.112 . . . . 0.0 111.997 -173.376 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 31.0 t -84.23 65.58 8.89 Favored 'General case' 0 C--N 1.333 -0.145 0 C-N-CA 124.691 1.197 . . . . 0.0 109.636 -166.136 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.465 ' HA3' ' CG ' ' A' ' 19' ' ' LYS . . . -71.03 40.27 0.55 Allowed Glycine 0 CA--C 1.533 1.183 0 N-CA-C 117.539 1.776 . . . . 0.0 117.539 -160.084 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -129.19 123.95 33.34 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 120.093 1.947 . . . . 0.0 109.261 -175.186 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -177.05 -166.22 33.64 Favored Glycine 0 C--N 1.335 0.507 0 N-CA-C 110.109 -1.196 . . . . 0.0 110.109 -175.543 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 6.7 mtmp? -153.89 166.02 34.26 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 124.492 1.117 . . . . 0.0 108.074 164.435 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . 0.501 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -85.58 165.06 17.37 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 176.845 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -136.95 128.81 29.09 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 105.703 -1.962 . . . . 0.0 105.703 165.117 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 67.68 -89.9 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 123.238 0.615 . . . . 0.0 110.397 166.577 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 31.9 m120 -154.58 58.38 0.69 Allowed 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 127.314 2.246 . . . . 0.0 105.899 161.256 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 19.7 mp0 -151.15 176.45 11.17 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 129.288 3.035 . . . . 0.0 104.18 179.121 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.455 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.7 m -154.83 153.99 32.05 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-N 120.324 1.42 . . . . 0.0 110.73 -169.743 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 17.4 mtt180 -145.11 128.26 16.67 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 124.048 0.939 . . . . 0.0 110.204 -168.731 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -99.79 161.71 13.45 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 123.332 0.653 . . . . 0.0 111.453 178.039 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.454 -0.232 0 C-N-CA 123.811 0.844 . . . . 0.0 111.284 -171.272 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.3 pt? . . . . . 0 N--CA 1.447 -0.582 0 N-CA-C 106.439 -1.689 . . . . 0.0 106.439 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -131.73 -175.63 1.49 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.726 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 -165.742 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -141.58 83.81 1.88 Allowed 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 122.081 0.943 . . . . 0.0 110.86 161.07 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 80.5 t -130.14 134.57 62.51 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 N-CA-C 105.6 -2.0 . . . . 0.0 105.6 160.554 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.0 mptt -68.91 111.19 4.8 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 124.642 1.177 . . . . 0.0 110.263 -169.333 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.503 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -61.23 126.96 29.26 Favored 'General case' 0 CA--C 1.515 -0.376 0 C-N-CA 122.725 0.41 . . . . 0.0 110.191 175.518 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -89.67 -15.77 31.91 Favored 'General case' 0 N--CA 1.449 -0.488 0 O-C-N 125.003 1.439 . . . . 0.0 109.598 157.51 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 179.33 153.05 0.42 Allowed 'General case' 0 C--N 1.344 0.359 0 C-N-CA 125.485 1.514 . . . . 0.0 108.604 -177.146 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.523 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 24.4 m -54.95 -37.48 66.51 Favored 'General case' 0 N--CA 1.462 0.165 0 C-N-CA 123.056 0.542 . . . . 0.0 112.162 171.906 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.45 -23.18 64.22 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-O 119.427 -0.32 . . . . 0.0 111.765 179.076 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -67.46 -50.78 57.66 Favored 'General case' 0 C--O 1.217 -0.627 0 CA-C-N 118.655 0.661 . . . . 0.0 109.562 175.071 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 23.7 m -49.32 -27.31 3.79 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 126.108 1.763 . . . . 0.0 110.655 -177.108 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 31.2 m0 -63.36 -65.96 0.61 Allowed 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 114.821 -1.081 . . . . 0.0 108.192 173.271 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -52.95 -31.51 40.85 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-O 117.716 -1.135 . . . . 0.0 111.585 174.084 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.47 -55.46 27.43 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 121.686 2.039 . . . . 0.0 110.477 173.801 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 2.0 t -54.53 -37.46 65.41 Favored 'General case' 0 CA--C 1.527 0.087 0 C-N-CA 123.088 0.555 . . . . 0.0 109.858 178.259 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.7 mtpt -66.7 -54.24 25.16 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-O 121.351 0.596 . . . . 0.0 111.784 177.563 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 20.1 mtpp -53.75 -38.65 64.61 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 124.659 1.184 . . . . 0.0 110.25 -179.413 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 54.1 t -76.07 -61.63 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.426 -1.632 0 C-N-CA 124.734 1.214 . . . . 0.0 110.051 177.715 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 11.4 t -134.52 13.47 3.77 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 114.166 1.173 . . . . 0.0 114.166 -162.753 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 76.17 -26.19 1.53 Allowed Glycine 0 CA--C 1.537 1.424 0 O-C-N 120.317 -1.489 . . . . 0.0 114.259 178.658 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.4 m -81.17 62.8 5.26 Favored 'General case' 0 C--O 1.223 -0.333 0 C-N-CA 125.451 1.5 . . . . 0.0 111.511 -162.621 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -66.73 49.44 0.22 Allowed Glycine 0 CA--C 1.54 1.647 0 N-CA-C 119.023 2.369 . . . . 0.0 119.023 -156.807 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -130.92 118.71 21.08 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 120.477 2.139 . . . . 0.0 109.945 -173.419 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -172.98 -164.95 29.21 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 111.357 -0.697 . . . . 0.0 111.357 -177.378 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 58.4 mttt -160.56 161.13 32.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 124.882 1.273 . . . . 0.0 108.582 169.531 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . 0.523 ' HB3' ' HA ' ' A' ' 11' ' ' SER . 0.1 OUTLIER -92.18 162.34 14.36 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 -177.674 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.7 tp-100 -133.55 133.72 42.47 Favored 'General case' 0 N--CA 1.444 -0.733 0 N-CA-C 106.069 -1.826 . . . . 0.0 106.069 166.407 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 63.55 -87.63 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 117.971 0.35 . . . . 0.0 111.64 168.084 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -161.02 63.94 0.29 Allowed 'General case' 0 C--O 1.227 -0.118 0 C-N-CA 129.681 3.192 . . . . 0.0 104.169 165.259 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -161.64 174.58 13.11 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 129.279 3.032 . . . . 0.0 103.007 -177.759 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.415 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.7 m -153.65 160.61 42.44 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 121.199 1.818 . . . . 0.0 111.075 -169.112 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 63.8 mtp180 -139.43 151.12 45.99 Favored 'General case' 0 CA--C 1.511 -0.554 0 C-N-CA 125.351 1.461 . . . . 0.0 108.812 178.559 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -154.5 154.32 32.95 Favored 'General case' 0 C--N 1.333 -0.124 0 O-C-N 124.117 0.886 . . . . 0.0 112.562 -178.885 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.243 0 CA-C-O 120.962 0.41 . . . . 0.0 111.037 -174.171 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 18.8 m-85 . . . . . 0 N--CA 1.451 -0.387 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -76.37 126.28 8.11 Favored Glycine 0 N--CA 1.445 -0.766 0 N-CA-C 108.272 -1.931 . . . . 0.0 108.272 173.6 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -141.76 130.93 23.38 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 118.776 1.288 . . . . 0.0 109.659 164.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -136.14 167.38 24.68 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.171 0 N-CA-C 106.563 -1.644 . . . . 0.0 106.563 -164.342 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -129.68 88.38 2.67 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 122.193 0.997 . . . . 0.0 108.718 162.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 99.1 t -133.23 137.9 52.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 159.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.4 mptt -41.04 107.66 0.08 Allowed 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 127.217 2.207 . . . . 0.0 112.746 178.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.501 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -68.16 133.57 49.11 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 167.231 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -93.62 -15.07 25.74 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 158.154 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 176.25 155.91 0.23 Allowed 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 125.902 1.681 . . . . 0.0 107.832 -175.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 40.6 m -51.46 -39.62 57.83 Favored 'General case' 0 C--O 1.227 -0.12 0 C-N-CA 123.006 0.522 . . . . 0.0 111.724 171.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.9 p -62.8 -20.21 64.79 Favored 'General case' 0 N--CA 1.445 -0.716 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -178.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.25 -49.2 36.87 Favored 'General case' 0 C--O 1.218 -0.569 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 175.107 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 20.3 m -46.63 -29.64 1.94 Allowed 'General case' 0 CA--C 1.503 -0.853 0 C-N-CA 126.106 1.762 . . . . 0.0 110.138 178.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 31.5 m0 -63.59 -66.06 0.59 Allowed 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 176.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -51.37 -35.95 40.98 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 118.455 -0.783 . . . . 0.0 111.75 174.776 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.08 -57.05 11.92 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 120.243 1.383 . . . . 0.0 111.376 177.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 17.7 m -58.8 -33.78 70.75 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 122.232 1.015 . . . . 0.0 110.895 -179.531 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.5 mtmt -69.23 -42.78 75.22 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-N 115.178 -0.919 . . . . 0.0 113.143 175.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 41.7 mttm -54.28 -53.8 48.83 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.519 0.328 . . . . 0.0 110.359 174.317 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -62.78 -57.14 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 178.339 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 60.2 p -116.4 -57.24 2.22 Favored 'General case' 0 CA--C 1.522 -0.117 0 CA-C-O 121.185 0.517 . . . . 0.0 110.897 -169.136 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 130.29 -15.19 5.57 Favored Glycine 0 CA--C 1.532 1.136 0 CA-C-N 114.874 -1.057 . . . . 0.0 112.07 -161.325 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 58.0 p -79.11 63.28 3.73 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 118.659 1.229 . . . . 0.0 111.049 -171.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -69.0 2.3 8.8 Favored Glycine 0 CA--C 1.533 1.187 0 O-C-N 121.517 -0.739 . . . . 0.0 114.916 -164.556 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 30.8 mt-30 -85.93 105.52 16.46 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 119.158 1.479 . . . . 0.0 107.375 -177.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -158.45 -172.81 26.06 Favored Glycine 0 CA--C 1.524 0.645 0 CA-C-O 121.148 0.304 . . . . 0.0 112.908 -172.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 4.4 ttmm -159.84 143.34 14.24 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 125.398 1.479 . . . . 0.0 107.658 -174.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.501 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -89.39 151.43 22.05 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 177.41 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 56.7 tp60 -125.31 116.9 22.66 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 105.079 -2.193 . . . . 0.0 105.079 172.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 66.04 -82.37 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 118.911 0.778 . . . . 0.0 111.481 168.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -157.9 43.29 0.31 Allowed 'General case' 0 N--CA 1.444 -0.727 0 C-N-CA 128.423 2.689 . . . . 0.0 109.649 171.214 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 26.5 mp0 -141.65 178.42 7.48 Favored 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 128.006 2.522 . . . . 0.0 105.091 172.802 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.408 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 0.9 OUTLIER -159.27 152.47 22.31 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 119.185 0.902 . . . . 0.0 110.16 -164.444 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 8.8 mtt180 -146.29 132.87 19.81 Favored 'General case' 0 C--O 1.227 -0.09 0 CA-C-O 118.415 -0.802 . . . . 0.0 110.087 -167.354 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -102.91 164.17 11.78 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 123.712 0.805 . . . . 0.0 111.225 168.273 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 71.4 t80 . . . . . 0 N--CA 1.451 -0.392 0 C-N-CA 126.816 2.046 . . . . 0.0 109.384 177.98 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 . . . . . 0 N--CA 1.452 -0.327 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -59.81 117.1 10.17 Favored Glycine 0 N--CA 1.443 -0.84 0 N-CA-C 111.847 -0.501 . . . . 0.0 111.847 163.306 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -132.07 130.42 41.25 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 157.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -136.87 178.25 5.08 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.018 0 N-CA-C 107.429 -1.322 . . . . 0.0 107.429 -166.421 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 49.6 t0 -130.19 102.29 6.16 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 154.301 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -130.97 148.31 33.06 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 N-CA-C 105.995 -1.854 . . . . 0.0 105.995 148.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 42.7 mttm -64.57 115.46 5.21 Favored 'General case' 0 N--CA 1.444 -0.735 0 C-N-CA 123.828 0.851 . . . . 0.0 110.866 -170.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.548 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -73.22 119.55 17.62 Favored 'General case' 0 CA--C 1.511 -0.536 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 175.296 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -79.79 -22.88 42.57 Favored 'General case' 0 N--CA 1.449 -0.496 0 O-C-N 125.495 1.747 . . . . 0.0 109.078 156.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 178.97 154.17 0.41 Allowed 'General case' 0 C--N 1.344 0.344 0 C-N-CA 125.405 1.482 . . . . 0.0 108.751 -175.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.514 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 19.0 m -52.79 -38.71 61.52 Favored 'General case' 0 C--O 1.231 0.105 0 C-N-CA 123.321 0.649 . . . . 0.0 112.38 171.655 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.31 -22.28 64.75 Favored 'General case' 0 N--CA 1.445 -0.68 0 C-N-CA 122.721 0.408 . . . . 0.0 111.925 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.07 -51.11 34.51 Favored 'General case' 0 C--O 1.22 -0.489 0 CA-C-O 121.329 0.585 . . . . 0.0 109.506 176.063 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 20.8 m -47.6 -28.61 2.41 Favored 'General case' 0 CA--C 1.51 -0.579 0 C-N-CA 126.361 1.864 . . . . 0.0 110.444 -179.122 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 27.0 m0 -61.79 -68.55 0.31 Allowed 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 173.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -50.99 -32.47 21.25 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 117.945 -1.026 . . . . 0.0 112.308 174.852 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.01 -51.19 67.78 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 120.88 1.673 . . . . 0.0 110.831 173.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 2.0 t -60.79 -35.84 77.48 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 121.444 0.64 . . . . 0.0 109.813 178.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.3 mtpt -63.19 -50.61 69.66 Favored 'General case' 0 N--CA 1.44 -0.941 0 O-C-N 121.477 -0.765 . . . . 0.0 110.331 176.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 39.6 tptt -52.12 -45.3 64.87 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 124.452 1.101 . . . . 0.0 111.205 178.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 43.6 t -75.01 -63.14 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.428 -1.561 0 C-N-CA 124.646 1.178 . . . . 0.0 109.732 -178.328 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -110.3 -35.12 6.16 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.817 0.847 . . . . 0.0 112.421 -166.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 108.76 -23.21 24.49 Favored Glycine 0 CA--C 1.532 1.106 0 N-CA-C 110.6 -1.0 . . . . 0.0 110.6 -170.321 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 13.6 m -81.91 66.63 7.57 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 125.595 1.558 . . . . 0.0 110.046 -167.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -67.49 47.61 0.29 Allowed Glycine 0 CA--C 1.54 1.64 0 N-CA-C 117.98 1.952 . . . . 0.0 117.98 -160.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -132.38 98.61 4.43 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 119.951 1.875 . . . . 0.0 110.594 -163.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -159.17 -163.6 13.36 Favored Glycine 0 CA--C 1.525 0.702 0 CA-C-O 119.838 -0.423 . . . . 0.0 113.339 -172.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -158.65 160.17 36.2 Favored 'General case' 0 C--O 1.232 0.184 0 C-N-CA 126.997 2.119 . . . . 0.0 107.636 169.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.548 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -91.13 160.89 15.33 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 178.406 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -136.96 126.02 24.44 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 173.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 6.2 m120 64.43 -82.64 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.647 1.179 . . . . 0.0 110.616 174.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -163.63 43.89 0.11 Allowed 'General case' 0 N--CA 1.441 -0.899 0 C-N-CA 127.47 2.308 . . . . 0.0 106.155 172.093 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 7.8 mp0 -139.79 -177.82 5.14 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 129.911 3.285 . . . . 0.0 103.84 175.278 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.442 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.5 m -150.11 160.41 43.68 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 120.328 1.422 . . . . 0.0 111.897 -171.57 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 51.3 mtp180 -144.94 147.96 33.3 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 124.139 0.975 . . . . 0.0 108.385 -172.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 48.0 t -133.95 159.71 39.9 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.45 -0.474 0 CA-C-N 118.464 0.574 . . . . 0.0 110.858 -173.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 25.1 p90 . . . . . 0 N--CA 1.452 -0.373 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -61.88 123.19 30.94 Favored Glycine 0 CA--C 1.522 0.511 0 CA-C-O 117.894 -1.504 . . . . 0.0 110.082 172.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -132.67 122.89 25.33 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 106.317 -1.735 . . . . 0.0 106.317 159.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.3 pt -145.35 151.47 15.04 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.48 0 N-CA-C 104.828 -2.286 . . . . 0.0 104.828 -152.024 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -108.65 86.91 2.37 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 170.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 19.6 m -121.16 135.84 60.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 114.052 -1.431 . . . . 0.0 108.249 157.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -73.03 95.44 2.01 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 124.082 0.953 . . . . 0.0 111.525 -167.62 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.489 ' HB3' ' HB2' ' A' ' 29' ' ' CYS . 1.6 p -64.92 131.04 45.6 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.706 -177.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -87.15 -25.72 23.95 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 124.26 0.975 . . . . 0.0 109.468 151.151 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -164.09 167.62 20.07 Favored 'General case' 0 C--O 1.223 -0.291 0 C-N-CA 123.748 0.819 . . . . 0.0 109.186 -178.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.445 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 1.7 p -59.13 -37.48 77.32 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 125.15 1.38 . . . . 0.0 112.179 174.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.5 p -56.25 -36.33 68.42 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 121.287 0.565 . . . . 0.0 111.581 -176.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -39.59 -53.37 2.13 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 125.37 1.468 . . . . 0.0 111.947 168.002 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.7 m -67.94 -31.07 70.56 Favored 'General case' 0 N--CA 1.439 -0.996 0 C-N-CA 127.76 2.424 . . . . 0.0 108.813 -173.365 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 33.3 m0 -65.1 -63.36 1.12 Allowed 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 106.227 -1.768 . . . . 0.0 106.227 176.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 1.3 p -53.69 -31.02 46.31 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 119.026 -0.512 . . . . 0.0 111.573 177.062 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.8 -57.54 10.52 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 119.371 0.987 . . . . 0.0 110.72 174.3 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -58.85 -34.77 71.97 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 122.171 0.986 . . . . 0.0 110.583 -178.739 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.9 mtpm? -62.54 -55.46 27.16 Favored 'General case' 0 N--CA 1.438 -1.037 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.912 176.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 85.1 mttt -48.22 -50.25 30.11 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 124.175 0.99 . . . . 0.0 111.481 -179.475 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -68.65 -71.34 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 118.58 0.627 . . . . 0.0 110.907 174.618 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 88.3 m -104.43 -35.79 7.79 Favored 'General case' 0 N--CA 1.435 -1.223 0 C-N-CA 123.96 0.904 . . . . 0.0 110.74 -159.191 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 112.02 -16.4 25.36 Favored Glycine 0 CA--C 1.532 1.126 0 C-N-CA 123.374 0.512 . . . . 0.0 111.982 -175.08 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.7 p -80.84 63.91 5.41 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 126.557 1.943 . . . . 0.0 110.031 -166.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -72.54 41.64 0.82 Allowed Glycine 0 CA--C 1.537 1.44 0 N-CA-C 117.57 1.788 . . . . 0.0 117.57 -155.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -120.87 135.17 55.25 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 119.955 1.877 . . . . 0.0 109.214 -177.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 175.52 -166.42 37.82 Favored Glycine 0 CA--C 1.524 0.633 0 N-CA-C 111.189 -0.764 . . . . 0.0 111.189 -177.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 4.3 mptt -157.89 156.2 30.94 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 125.363 1.465 . . . . 0.0 108.676 171.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.489 ' HB2' ' HB3' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -90.53 160.84 15.76 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 -179.746 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -137.88 131.2 30.64 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 105.518 -2.03 . . . . 0.0 105.518 170.543 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 31.4 t30 67.58 -93.05 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 118.984 0.811 . . . . 0.0 110.089 165.402 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 24.3 m120 -154.95 58.51 0.67 Allowed 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 127.888 2.475 . . . . 0.0 105.367 160.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 17.1 mp0 -149.25 178.37 8.81 Favored 'General case' 0 N--CA 1.444 -0.733 0 C-N-CA 129.762 3.225 . . . . 0.0 103.711 177.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.448 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.3 m -155.4 165.22 37.29 Favored 'General case' 0 CA--C 1.506 -0.726 0 O-C-N 120.899 -1.126 . . . . 0.0 110.055 -171.24 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -141.9 146.34 35.61 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 175.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 20.2 m -84.35 -129.65 0.03 OUTLIER 'General case' 0 N--CA 1.439 -1.0 0 N-CA-C 108.058 -1.09 . . . . 0.0 108.058 164.552 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 3.8 p90 . . . . . 0 N--CA 1.449 -0.508 0 C-N-CA 124.01 0.924 . . . . 0.0 108.853 -173.998 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 15.4 m-85 . . . . . 0 CA--C 1.532 0.282 0 CA-C-O 121.371 0.605 . . . . 0.0 111.804 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 125.33 -154.96 18.62 Favored Glycine 0 C--N 1.335 0.522 0 C-N-CA 124.768 1.175 . . . . 0.0 111.032 172.469 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.5 pp -91.55 150.54 21.15 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 123.219 0.608 . . . . 0.0 111.818 -172.018 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -130.09 -168.76 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.903 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 -174.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.5 t0 -135.5 105.44 6.22 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-O 120.745 0.307 . . . . 0.0 110.599 156.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -142.7 136.65 27.38 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.21 0 N-CA-C 109.295 -0.632 . . . . 0.0 109.295 152.235 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 55.1 pttt -46.31 114.52 0.82 Allowed 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 125.648 1.579 . . . . 0.0 112.001 176.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.503 ' HB3' ' HB2' ' A' ' 29' ' ' CYS . 5.2 p -88.39 134.73 33.75 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 118.004 0.365 . . . . 0.0 111.838 177.156 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -90.39 -21.33 22.01 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 153.67 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -164.89 166.68 19.37 Favored 'General case' 0 C--O 1.223 -0.303 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 -178.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.405 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 1.9 p -59.75 -39.24 84.14 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 124.519 1.127 . . . . 0.0 111.737 172.403 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.5 p -56.06 -36.29 67.9 Favored 'General case' 0 N--CA 1.451 -0.381 0 O-C-N 121.969 -0.457 . . . . 0.0 111.448 -176.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -39.18 -55.25 1.68 Allowed 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.159 1.384 . . . . 0.0 111.486 167.58 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 13.8 m -64.97 -31.45 72.69 Favored 'General case' 0 N--CA 1.438 -1.025 0 C-N-CA 128.186 2.595 . . . . 0.0 108.824 -173.268 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 33.2 m0 -64.02 -67.0 0.47 Allowed 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 105.837 -1.912 . . . . 0.0 105.837 178.501 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -52.44 -32.84 41.34 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 123.265 0.626 . . . . 0.0 111.843 177.732 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.95 -54.88 35.67 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 119.519 1.054 . . . . 0.0 110.147 175.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.7 t -59.94 -34.74 73.66 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-O 120.865 0.364 . . . . 0.0 110.643 179.312 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.413 ' CG ' ' HA3' ' A' ' 25' ' ' GLY . 4.8 mtpm? -63.36 -55.14 26.96 Favored 'General case' 0 N--CA 1.438 -1.046 0 O-C-N 122.314 -0.241 . . . . 0.0 110.833 176.571 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -53.22 -48.29 68.27 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 123.311 0.645 . . . . 0.0 111.079 178.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 40.8 t -70.79 -51.23 38.0 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.485 0 C-N-CA 123.997 0.919 . . . . 0.0 110.191 -176.355 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -129.03 -34.16 1.93 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.778 0.831 . . . . 0.0 112.341 -157.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 118.16 -31.94 5.46 Favored Glycine 0 CA--C 1.533 1.156 0 C-N-CA 124.588 1.09 . . . . 0.0 112.342 176.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 49.5 m -85.53 81.69 8.58 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 126.254 1.822 . . . . 0.0 110.253 -166.268 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.413 ' HA3' ' CG ' ' A' ' 19' ' ' LYS . . . -76.53 47.46 2.42 Favored Glycine 0 CA--C 1.536 1.363 0 CA-C-O 118.72 -1.045 . . . . 0.0 115.355 -164.482 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -119.52 122.57 41.94 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 119.341 1.571 . . . . 0.0 108.739 -178.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -173.35 -169.14 35.42 Favored Glycine 0 CA--C 1.522 0.522 0 CA-C-N 119.162 0.892 . . . . 0.0 112.233 -174.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -161.8 145.34 12.34 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 177.2 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.503 ' HB2' ' HB3' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -88.37 152.27 22.03 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 179.265 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 31.0 tp60 -127.59 108.69 10.99 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 105.67 -1.974 . . . . 0.0 105.67 -179.436 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 65.64 -79.69 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 119.233 0.924 . . . . 0.0 111.44 172.279 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -159.31 43.08 0.23 Allowed 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 129.327 3.051 . . . . 0.0 110.758 169.178 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -133.9 -171.56 2.76 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 105.97 -1.863 . . . . 0.0 105.97 157.226 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.458 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.2 m -145.03 162.35 37.16 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 119.254 0.934 . . . . 0.0 111.079 -172.52 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 41.3 mtp180 -142.9 153.36 43.03 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 -174.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 49.1 t -135.3 148.39 49.49 Favored 'General case' 0 C--N 1.33 -0.267 0 O-C-N 124.437 1.086 . . . . 0.0 110.891 -175.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 88.3 t80 . . . . . 0 C--O 1.234 0.276 0 C-N-CA 126.837 2.055 . . . . 0.0 109.433 -172.11 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.456 -0.169 0 CA-C-O 122.282 1.039 . . . . 0.0 109.366 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -87.32 138.53 15.42 Favored Glycine 0 N--CA 1.445 -0.728 0 C-N-CA 127.285 2.374 . . . . 0.0 108.18 172.051 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -142.03 131.17 23.32 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 118.403 1.102 . . . . 0.0 108.074 171.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -132.9 166.05 30.57 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.878 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 -161.465 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 22.0 p-10 -117.53 24.96 10.75 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 125.52 1.528 . . . . 0.0 112.115 -169.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 21.3 t -117.02 133.35 64.04 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 C-N-CA 123.811 0.844 . . . . 0.0 110.127 -179.702 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt -46.31 146.14 1.48 Allowed 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 126.853 2.061 . . . . 0.0 114.491 -176.416 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.532 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -104.56 129.49 52.64 Favored 'General case' 0 CA--C 1.511 -0.539 0 C-N-CA 123.034 0.533 . . . . 0.0 110.221 167.89 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -94.66 -10.74 30.9 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 157.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -174.98 168.75 3.47 Favored 'General case' 0 C--N 1.342 0.264 0 C-N-CA 126.154 1.782 . . . . 0.0 107.499 -179.436 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.456 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 2.6 p -64.82 -42.99 94.53 Favored 'General case' 0 C--N 1.333 -0.122 0 C-N-CA 125.81 1.644 . . . . 0.0 111.462 169.385 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.4 p -55.11 -38.88 68.72 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 122.094 -0.379 . . . . 0.0 110.824 -177.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -35.31 -55.91 0.63 Allowed 'General case' 0 C--O 1.222 -0.349 0 C-N-CA 125.329 1.451 . . . . 0.0 112.097 166.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 18.8 m -64.07 -31.2 72.31 Favored 'General case' 0 N--CA 1.439 -1.016 0 C-N-CA 127.986 2.514 . . . . 0.0 108.491 -170.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 29.8 m0 -66.41 -63.26 1.11 Allowed 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 106.927 -1.508 . . . . 0.0 106.927 178.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -53.8 -31.75 50.11 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.458 0.703 . . . . 0.0 111.533 175.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.72 -56.72 10.53 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 119.775 1.171 . . . . 0.0 109.862 178.117 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -57.49 -35.81 70.68 Favored 'General case' 0 CA--C 1.514 -0.421 0 CA-C-O 121.028 0.442 . . . . 0.0 110.758 179.654 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.455 ' CG ' ' HA3' ' A' ' 25' ' ' GLY . 18.9 mtmm -63.55 -58.14 7.93 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.416 175.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 7.4 mtpm? -54.0 -39.83 66.42 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 123.514 0.725 . . . . 0.0 111.825 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 42.6 t -73.93 -62.2 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.5 0 C-N-CA 123.953 0.901 . . . . 0.0 109.022 179.071 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.2 m -117.02 -43.55 2.85 Favored 'General case' 0 N--CA 1.439 -0.984 0 C-N-CA 124.083 0.953 . . . . 0.0 110.902 -161.312 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 124.13 -21.34 6.94 Favored Glycine 0 CA--C 1.534 1.241 0 C-N-CA 124.873 1.225 . . . . 0.0 112.376 -176.091 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 9.7 t -86.22 72.88 10.31 Favored 'General case' 0 C--O 1.227 -0.126 0 O-C-N 121.474 -1.015 . . . . 0.0 109.102 -164.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.455 ' HA3' ' CG ' ' A' ' 19' ' ' LYS . . . -73.72 38.45 0.9 Allowed Glycine 0 CA--C 1.533 1.184 0 N-CA-C 117.369 1.708 . . . . 0.0 117.369 -160.495 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 61.0 mt-30 -116.16 122.68 45.79 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 126.394 1.877 . . . . 0.0 108.625 -176.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -174.8 -166.47 32.72 Favored Glycine 0 CA--C 1.521 0.458 0 CA-C-N 119.298 0.954 . . . . 0.0 111.869 -177.414 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 78.1 tttt -166.69 150.3 7.03 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 175.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.532 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -88.23 161.35 17.25 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 -177.817 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -138.9 115.96 10.95 Favored 'General case' 0 N--CA 1.441 -0.876 0 N-CA-C 106.707 -1.59 . . . . 0.0 106.707 173.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 73.27 -75.58 0.07 Allowed 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.432 0.693 . . . . 0.0 111.493 165.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -168.48 46.94 0.04 OUTLIER 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 129.739 3.216 . . . . 0.0 109.418 167.316 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -144.01 -170.21 3.28 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 104.991 -2.225 . . . . 0.0 104.991 160.223 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.422 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 3.9 m -150.76 159.48 44.5 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 119.268 0.94 . . . . 0.0 110.235 -170.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 51.1 mtt-85 -136.11 152.38 50.78 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 124.599 1.159 . . . . 0.0 109.934 179.038 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 41.2 t -131.99 167.86 18.92 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 124.1 0.875 . . . . 0.0 111.281 -172.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 86.0 m-85 . . . . . 0 C--O 1.233 0.191 0 C-N-CA 127.132 2.173 . . . . 0.0 109.135 172.074 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 34.6 m-85 . . . . . 0 N--CA 1.45 -0.455 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -46.0 134.28 9.62 Favored Glycine 0 CA--C 1.53 1.023 0 C-N-CA 123.629 0.633 . . . . 0.0 112.228 173.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -147.71 132.89 18.34 Favored 'General case' 0 N--CA 1.447 -0.622 0 O-C-N 122.115 -0.638 . . . . 0.0 109.448 159.089 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -133.24 -175.29 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.974 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 -168.476 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -143.71 91.78 2.28 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 121.625 0.726 . . . . 0.0 110.179 162.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 94.8 t -135.73 140.95 43.38 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 161.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.22 104.29 0.08 Allowed 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 125.79 1.636 . . . . 0.0 113.183 -177.19 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.92 130.71 42.34 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 167.107 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 29.6 m-85 -88.7 -21.72 23.75 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 123.752 0.821 . . . . 0.0 109.438 150.4 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -167.55 168.6 12.69 Favored 'General case' 0 C--O 1.224 -0.283 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 -175.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.3 p -62.89 -41.98 99.61 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 125.478 1.511 . . . . 0.0 111.973 174.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.41 ' HA ' ' CD2' ' A' ' 15' ' ' TRP . 23.0 t -57.1 -35.57 69.59 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 121.683 -0.635 . . . . 0.0 111.376 -174.303 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -35.63 -55.48 0.69 Allowed 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.387 1.475 . . . . 0.0 112.645 163.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 11.6 m -65.94 -31.41 72.32 Favored 'General case' 0 N--CA 1.439 -1.011 0 C-N-CA 127.892 2.477 . . . . 0.0 109.01 -173.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.41 ' CD2' ' HA ' ' A' ' 12' ' ' SER . 35.4 m0 -64.87 -63.37 1.13 Allowed 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 106.421 -1.696 . . . . 0.0 106.421 177.471 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -53.65 -33.0 53.7 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 122.865 0.466 . . . . 0.0 111.685 176.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.86 -55.49 29.23 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 119.265 0.938 . . . . 0.0 110.267 175.34 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -60.13 -34.08 73.03 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 121.097 0.475 . . . . 0.0 110.373 178.586 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.45 ' CG ' ' HA3' ' A' ' 25' ' ' GLY . 30.1 mtmt -64.15 -50.81 66.73 Favored 'General case' 0 N--CA 1.44 -0.967 0 O-C-N 121.35 -0.844 . . . . 0.0 110.456 178.311 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 10.2 mtpm? -57.97 -39.73 78.88 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.795 178.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 38.3 t -72.32 -60.51 2.35 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.403 0 C-N-CA 123.802 0.841 . . . . 0.0 109.551 179.323 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.9 t -118.24 -39.96 3.0 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.171 0.988 . . . . 0.0 112.578 -165.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 120.52 -25.36 7.33 Favored Glycine 0 CA--C 1.532 1.128 0 C-N-CA 123.896 0.76 . . . . 0.0 111.648 -178.172 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.9 t -87.83 75.27 8.92 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 124.048 0.939 . . . . 0.0 108.996 -167.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.45 ' HA3' ' CG ' ' A' ' 19' ' ' LYS . . . -71.95 54.47 1.38 Allowed Glycine 0 CA--C 1.534 1.234 0 N-CA-C 116.891 1.516 . . . . 0.0 116.891 -161.009 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -129.62 123.03 30.26 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 120.278 2.039 . . . . 0.0 111.171 -173.013 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -175.55 -168.99 36.72 Favored Glycine 0 CA--C 1.527 0.837 0 CA-C-N 118.273 0.488 . . . . 0.0 112.256 -176.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -149.06 158.78 44.45 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 125.987 1.715 . . . . 0.0 107.651 165.097 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.427 ' HA ' ' HA ' ' A' ' 34' ' ' CYS . 0.4 OUTLIER -86.94 153.73 21.36 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 179.98 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 2.2 tp60 -124.5 106.8 10.45 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 176.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 73.88 -85.31 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.409 0 O-C-N 121.752 -0.593 . . . . 0.0 109.836 167.301 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 34.3 m120 -152.73 46.19 0.71 Allowed 'General case' 0 C--O 1.224 -0.266 0 C-N-CA 127.323 2.249 . . . . 0.0 107.289 161.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 5.2 mp0 -135.44 -175.84 4.07 Favored 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 128.597 2.759 . . . . 0.0 103.994 169.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.427 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 0.9 OUTLIER -153.41 154.33 34.24 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 119.947 1.249 . . . . 0.0 110.545 -170.151 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 66.6 mtp180 -144.05 111.74 6.09 Favored 'General case' 0 CA--C 1.506 -0.724 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.338 -168.022 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -76.39 168.31 20.28 Favored 'General case' 0 N--CA 1.438 -1.032 0 CA-C-O 121.798 0.809 . . . . 0.0 110.384 166.797 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 1.4 p90 . . . . . 0 N--CA 1.443 -0.8 0 C-N-CA 124.913 1.285 . . . . 0.0 111.25 177.674 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.451 -0.385 0 CA-C-O 121.265 0.555 . . . . 0.0 110.424 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -44.97 136.12 6.62 Favored Glycine 0 CA--C 1.527 0.782 0 C-N-CA 124.836 1.208 . . . . 0.0 110.992 156.08 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -137.46 126.58 24.45 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 107.294 -1.373 . . . . 0.0 107.294 147.433 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -136.53 158.28 37.48 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.25 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 -162.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -86.44 -17.92 33.04 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 125.061 1.344 . . . . 0.0 112.012 -171.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 63.2 t -70.09 134.44 30.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 C-N-CA 119.994 -0.682 . . . . 0.0 110.756 -159.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 56.8 pttt -53.6 102.2 0.05 Allowed 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.331 1.452 . . . . 0.0 112.611 -178.028 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.448 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -62.6 131.41 48.96 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 169.995 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -90.67 -17.2 27.23 Favored 'General case' 0 CA--C 1.535 0.402 0 O-C-N 124.684 1.24 . . . . 0.0 109.659 157.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 173.54 156.41 0.12 Allowed 'General case' 0 C--N 1.343 0.323 0 C-N-CA 126.41 1.884 . . . . 0.0 107.518 -175.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 35.4 m -47.6 -38.4 14.47 Favored 'General case' 0 CA--C 1.528 0.131 0 C-N-CA 124.151 0.98 . . . . 0.0 113.581 174.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.0 p -60.98 -28.59 69.12 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 121.892 -0.505 . . . . 0.0 112.005 -179.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 7.6 tm-20 -55.5 -52.89 62.16 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.178 0.591 . . . . 0.0 109.435 173.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 15.1 m -55.94 -28.17 55.7 Favored 'General case' 0 N--CA 1.442 -0.862 0 C-N-CA 127.726 2.41 . . . . 0.0 109.705 -176.216 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 37.4 m0 -66.68 -66.5 0.55 Allowed 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 107.039 -1.467 . . . . 0.0 107.039 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -50.89 -33.52 24.42 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 118.368 -0.825 . . . . 0.0 111.112 174.181 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.35 -58.75 5.12 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 120.056 1.298 . . . . 0.0 111.534 177.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -60.81 -30.26 69.97 Favored 'General case' 0 CA--C 1.519 -0.232 0 O-C-N 121.511 -0.743 . . . . 0.0 110.886 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -65.97 -48.73 70.31 Favored 'General case' 0 N--CA 1.442 -0.859 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.747 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.1 tmtt? -60.3 -37.64 81.15 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 124.453 1.101 . . . . 0.0 110.774 177.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 29.8 t -72.17 -62.0 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.428 -1.543 0 C-N-CA 124.05 0.94 . . . . 0.0 108.497 177.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.3 m -122.06 -49.87 2.06 Favored 'General case' 0 N--CA 1.431 -1.395 0 C-N-CA 123.922 0.889 . . . . 0.0 110.684 -163.196 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 134.18 -20.95 3.94 Favored Glycine 0 CA--C 1.536 1.389 0 C-N-CA 123.926 0.774 . . . . 0.0 112.253 -170.237 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 30.9 m -82.83 63.09 6.76 Favored 'General case' 0 C--O 1.228 -0.079 0 C-N-CA 125.205 1.402 . . . . 0.0 111.084 -164.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -65.99 1.26 4.92 Favored Glycine 0 CA--C 1.536 1.371 0 N-CA-C 116.297 1.279 . . . . 0.0 116.297 -162.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -89.56 105.48 17.82 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 119.629 1.714 . . . . 0.0 108.401 -173.432 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -158.85 -174.0 27.99 Favored Glycine 0 C--N 1.333 0.397 0 O-C-N 122.27 -0.269 . . . . 0.0 112.712 -171.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -151.33 154.98 37.77 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 124.753 1.221 . . . . 0.0 108.109 173.317 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.448 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -87.77 161.04 17.8 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 176.951 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 45.9 tt0 -136.01 127.63 28.89 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 105.164 -2.161 . . . . 0.0 105.164 170.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 68.71 -89.45 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 118.797 0.726 . . . . 0.0 110.555 168.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 36.6 m120 -161.27 55.28 0.28 Allowed 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 130.129 3.372 . . . . 0.0 104.065 165.011 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -145.99 175.47 10.42 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 130.855 3.662 . . . . 0.0 102.794 176.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.404 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.2 m -156.84 157.85 35.68 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-N 120.06 1.3 . . . . 0.0 110.809 -168.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 15.2 mtp180 -144.15 145.3 32.02 Favored 'General case' 0 CA--C 1.512 -0.497 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 -170.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 8.4 p -132.89 151.53 52.02 Favored 'General case' 0 CA--C 1.515 -0.384 0 O-C-N 124.244 0.965 . . . . 0.0 110.733 169.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.448 -0.526 0 C-N-CA 123.92 0.888 . . . . 0.0 112.322 -173.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 4.1 t80 . . . . . 0 N--CA 1.456 -0.148 0 CA-C-O 121.778 0.799 . . . . 0.0 110.061 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -54.83 162.71 4.23 Favored Glycine 0 CA--C 1.527 0.835 0 C-N-CA 125.893 1.711 . . . . 0.0 112.196 178.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -148.38 129.05 14.14 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 156.095 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -130.42 174.52 12.71 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.003 0 N-CA-C 106.574 -1.639 . . . . 0.0 106.574 -175.813 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -132.59 71.27 1.47 Allowed 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 122.163 0.982 . . . . 0.0 110.653 175.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 64.7 t -131.37 136.37 57.65 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 114.357 -1.292 . . . . 0.0 109.032 167.193 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 60.0 pttt -45.95 113.64 0.65 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 126.156 1.782 . . . . 0.0 112.618 179.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.415 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -74.09 136.67 43.02 Favored 'General case' 0 CA--C 1.516 -0.351 0 C-N-CA 120.103 -0.639 . . . . 0.0 109.859 170.123 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 7.2 t80 -100.73 -8.18 23.03 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 161.066 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 174.08 165.12 0.2 Allowed 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 126.941 2.096 . . . . 0.0 106.461 -175.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.6 m -62.33 -36.26 81.66 Favored 'General case' 0 C--O 1.226 -0.182 0 C-N-CA 122.73 0.412 . . . . 0.0 111.961 170.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.5 p -59.09 -37.75 77.89 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 122.131 -0.356 . . . . 0.0 110.652 -179.529 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -42.58 -55.3 3.57 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.165 0.986 . . . . 0.0 110.63 170.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 25.5 m -56.56 -31.11 63.88 Favored 'General case' 0 N--CA 1.444 -0.763 0 C-N-CA 127.174 2.19 . . . . 0.0 109.678 -173.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 34.2 m0 -65.74 -63.47 1.08 Allowed 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 -179.214 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -51.62 -36.37 45.58 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-O 118.691 -0.671 . . . . 0.0 111.031 173.565 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.74 -57.58 10.46 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 119.632 1.106 . . . . 0.0 110.863 -178.611 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -59.04 -35.31 73.1 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-O 121.37 0.605 . . . . 0.0 110.55 178.497 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.461 ' CG ' ' HA3' ' A' ' 25' ' ' GLY . 8.1 mtmt -62.55 -45.46 92.84 Favored 'General case' 0 N--CA 1.441 -0.909 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 178.621 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -54.91 -52.39 63.05 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 122.957 0.503 . . . . 0.0 111.231 176.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -67.38 -65.32 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 118.47 0.577 . . . . 0.0 112.093 178.713 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 62.2 p -105.25 -50.02 3.33 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 122.546 0.338 . . . . 0.0 110.703 -170.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 126.46 -10.36 7.24 Favored Glycine 0 CA--C 1.532 1.126 0 CA-C-N 115.464 -0.789 . . . . 0.0 112.224 -161.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.5 m -78.66 57.49 2.05 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 118.674 1.237 . . . . 0.0 112.347 -165.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.461 ' HA3' ' CG ' ' A' ' 19' ' ' LYS . . . -74.2 30.55 0.97 Allowed Glycine 0 CA--C 1.533 1.199 0 N-CA-C 117.093 1.597 . . . . 0.0 117.093 -154.075 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 -122.79 123.76 41.78 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 119.57 1.685 . . . . 0.0 108.069 -172.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -179.11 -170.86 41.59 Favored Glycine 0 CA--C 1.526 0.757 0 CA-C-N 118.921 0.782 . . . . 0.0 112.743 -175.101 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -147.49 159.47 43.69 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 125.526 1.53 . . . . 0.0 108.337 166.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 34' ' ' CYS . 0.1 OUTLIER -88.37 141.18 28.75 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.775 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 11.3 tp60 -102.58 99.54 9.55 Favored 'General case' 0 N--CA 1.445 -0.713 0 N-CA-C 105.595 -2.002 . . . . 0.0 105.595 171.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 69.4 -77.62 0.05 Allowed 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 119.182 0.901 . . . . 0.0 112.32 166.318 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -153.95 39.11 0.47 Allowed 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 128.458 2.703 . . . . 0.0 110.933 168.449 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -136.86 -177.77 4.89 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 104.219 -2.511 . . . . 0.0 104.219 166.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.1 m -151.1 153.7 35.55 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 119.861 1.209 . . . . 0.0 110.639 -167.53 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 75.9 mtp180 -144.67 110.85 5.5 Favored 'General case' 0 CA--C 1.507 -0.693 0 C-N-CA 123.666 0.787 . . . . 0.0 109.475 -163.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 4.6 m -91.15 -154.99 0.38 Allowed 'General case' 0 N--CA 1.441 -0.875 0 CA-C-N 114.685 -1.143 . . . . 0.0 110.484 -178.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.451 -0.409 0 C-N-CA 124.857 1.263 . . . . 0.0 109.481 -175.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 9.6 t80 . . . . . 0 N--CA 1.454 -0.259 0 CA-C-O 121.884 0.849 . . . . 0.0 109.217 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -58.24 128.74 48.3 Favored Glycine 0 N--CA 1.447 -0.576 0 N-CA-C 107.814 -2.114 . . . . 0.0 107.814 155.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -138.02 125.81 22.44 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 119.155 1.478 . . . . 0.0 109.218 168.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.411 HD11 HG12 ' A' ' 6' ' ' VAL . 0.7 OUTLIER -145.48 157.77 13.01 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.619 0 N-CA-C 105.978 -1.86 . . . . 0.0 105.978 -157.842 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -118.35 33.17 5.76 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 123.139 0.576 . . . . 0.0 110.759 -169.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.411 HG12 HD11 ' A' ' 4' ' ' ILE . 1.4 p -77.99 127.36 38.55 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.175 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 170.349 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 53.3 pttt -43.84 101.83 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.31 1.444 . . . . 0.0 111.287 171.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.454 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.1 OUTLIER -68.8 133.47 48.36 Favored 'General case' 0 CA--C 1.517 -0.306 0 C-N-CA 119.414 -0.914 . . . . 0.0 110.32 177.492 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -98.05 -8.14 28.39 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.416 158.274 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 176.24 166.24 0.43 Allowed 'General case' 0 C--O 1.225 -0.202 0 C-N-CA 126.137 1.775 . . . . 0.0 107.15 -177.273 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.8 m -61.58 -35.35 77.58 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 118.334 0.515 . . . . 0.0 112.041 172.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.8 p -58.79 -32.56 69.44 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 121.666 -0.646 . . . . 0.0 111.61 -179.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -44.26 -52.71 7.28 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 124.092 0.957 . . . . 0.0 111.136 169.257 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 8.9 m -67.04 -30.69 70.84 Favored 'General case' 0 N--CA 1.44 -0.962 0 C-N-CA 127.677 2.391 . . . . 0.0 108.514 -172.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 34.2 m0 -64.95 -65.55 0.66 Allowed 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 106.0 -1.852 . . . . 0.0 106.0 176.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 4.0 p -54.22 -31.32 52.84 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 123.006 0.522 . . . . 0.0 111.755 179.022 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.48 -55.03 20.1 Favored 'General case' 0 N--CA 1.457 -0.092 0 CA-C-N 119.394 0.997 . . . . 0.0 110.432 175.606 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -60.96 -31.8 71.35 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-O 120.952 0.406 . . . . 0.0 110.086 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.437 ' CG ' ' HA3' ' A' ' 25' ' ' GLY . 22.9 mtpp -65.79 -53.45 40.17 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-O 121.377 0.608 . . . . 0.0 110.967 174.795 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? -54.15 -38.77 65.86 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.385 179.006 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 78.8 t -77.7 -66.72 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.425 -1.689 0 C-N-CA 124.027 0.931 . . . . 0.0 109.622 176.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 29.3 p -95.36 -50.8 4.86 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 123.157 0.583 . . . . 0.0 111.557 -169.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 122.31 -28.28 5.84 Favored Glycine 0 CA--C 1.531 1.047 0 C-N-CA 125.264 1.412 . . . . 0.0 110.783 -166.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -89.28 80.22 6.91 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.895 1.278 . . . . 0.0 109.184 -165.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.437 ' HA3' ' CG ' ' A' ' 19' ' ' LYS . . . -76.14 40.22 1.46 Allowed Glycine 0 CA--C 1.532 1.151 0 N-CA-C 117.175 1.63 . . . . 0.0 117.175 -156.534 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 61.2 mt-30 -115.5 116.68 28.6 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 120.104 1.952 . . . . 0.0 110.814 -171.066 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -170.19 -169.88 33.87 Favored Glycine 0 C--N 1.339 0.709 0 N-CA-C 111.453 -0.659 . . . . 0.0 111.453 -178.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 45.2 mtpt -150.97 156.46 41.2 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 124.722 1.209 . . . . 0.0 108.732 169.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.454 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -88.83 162.91 15.92 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 178.345 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 -141.77 125.99 17.47 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 106.858 -1.534 . . . . 0.0 106.858 168.178 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 7.2 m120 66.03 -78.13 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.943 0.897 . . . . 0.0 111.589 169.211 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -165.26 44.43 0.08 Allowed 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 129.782 3.233 . . . . 0.0 109.64 168.655 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 93.8 mt-30 -134.4 179.98 5.94 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 127.611 2.364 . . . . 0.0 105.23 168.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.449 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.4 m -153.57 157.61 39.98 Favored 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 -177.704 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 8.1 mtt180 -146.12 128.6 15.98 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 118.022 -0.989 . . . . 0.0 109.502 -170.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -103.45 167.71 9.63 Favored 'General case' 0 C--N 1.343 0.306 0 CA-C-O 121.885 0.85 . . . . 0.0 112.209 171.545 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.451 -0.377 0 C-N-CA 126.076 1.75 . . . . 0.0 111.107 -176.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 59.8 m-85 . . . . . 0 CA--C 1.538 0.5 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -56.91 124.53 35.91 Favored Glycine 0 N--CA 1.447 -0.582 0 CA-C-O 118.612 -1.105 . . . . 0.0 110.622 176.488 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -139.22 130.74 27.15 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 118.164 0.982 . . . . 0.0 109.211 159.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -138.89 166.17 22.85 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.186 0 N-CA-C 106.794 -1.558 . . . . 0.0 106.794 -163.714 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 46.9 t0 -127.42 81.8 2.04 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 122.047 0.927 . . . . 0.0 109.055 166.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 93.3 t -122.13 133.89 67.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 N-CA-C 106.2 -1.778 . . . . 0.0 106.2 156.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -62.1 108.58 1.09 Allowed 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 124.514 1.126 . . . . 0.0 111.464 -174.082 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.491 ' HB3' ' HB2' ' A' ' 29' ' ' CYS . 11.4 p -63.54 128.24 34.93 Favored 'General case' 0 CA--C 1.516 -0.354 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.711 176.637 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -71.83 -38.14 70.22 Favored 'General case' 0 N--CA 1.45 -0.446 0 O-C-N 124.421 1.076 . . . . 0.0 108.108 153.499 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -169.17 160.31 9.62 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.666 1.187 . . . . 0.0 108.386 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.531 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 21.8 m -47.06 -40.52 15.14 Favored 'General case' 0 C--O 1.226 -0.16 0 C-N-CA 124.383 1.073 . . . . 0.0 112.378 173.401 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.08 -23.6 65.59 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-O 119.096 -0.478 . . . . 0.0 112.112 -177.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -69.9 -48.14 59.78 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 119.235 0.925 . . . . 0.0 109.674 174.414 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 21.3 m -47.84 -28.16 2.46 Favored 'General case' 0 CA--C 1.511 -0.522 0 C-N-CA 125.937 1.695 . . . . 0.0 110.596 -179.372 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 37.1 m0 -64.81 -65.85 0.62 Allowed 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 177.547 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -51.4 -31.95 24.48 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-O 117.918 -1.039 . . . . 0.0 111.464 172.173 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.42 -63.31 1.27 Allowed 'General case' 0 C--N 1.342 0.245 0 CA-C-N 121.018 1.735 . . . . 0.0 111.265 176.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -57.68 -30.94 65.86 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 121.906 0.86 . . . . 0.0 110.848 -178.5 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.7 mtmm -66.49 -49.45 66.56 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 173.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 67.4 mttt -51.98 -53.26 43.62 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.25 1.02 . . . . 0.0 109.95 177.434 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -63.04 -40.88 90.72 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 179.287 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -151.6 -49.15 0.11 Allowed 'General case' 0 N--CA 1.447 -0.613 0 O-C-N 121.419 -0.8 . . . . 0.0 111.768 -164.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 144.52 -15.14 2.04 Favored Glycine 0 CA--C 1.53 0.979 0 C-N-CA 120.721 -0.752 . . . . 0.0 114.154 -178.114 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 9.3 m -79.79 59.12 3.02 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 124.059 0.943 . . . . 0.0 111.682 -163.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -70.87 12.01 2.3 Favored Glycine 0 CA--C 1.532 1.152 0 N-CA-C 116.339 1.295 . . . . 0.0 116.339 -157.428 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -105.22 108.06 19.37 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 119.16 1.48 . . . . 0.0 107.042 -172.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -167.03 -170.37 31.82 Favored Glycine 0 C--N 1.336 0.575 0 N-CA-C 111.966 -0.454 . . . . 0.0 111.966 -168.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 78.2 mttt -156.22 154.91 31.51 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 124.922 1.289 . . . . 0.0 108.631 177.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.531 ' HB3' ' HA ' ' A' ' 11' ' ' SER . 0.5 OUTLIER -91.35 160.09 15.66 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 176.419 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -140.81 120.9 13.74 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 106.231 -1.766 . . . . 0.0 106.231 176.334 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 70.84 -84.96 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 118.25 0.477 . . . . 0.0 110.078 168.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -162.34 56.36 0.23 Allowed 'General case' 0 N--CA 1.462 0.131 0 C-N-CA 129.175 2.99 . . . . 0.0 104.793 162.079 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 5.6 mp0 -143.09 -178.96 6.1 Favored 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 128.882 2.873 . . . . 0.0 103.796 170.017 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.419 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.2 m -157.39 158.5 36.02 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 119.595 1.089 . . . . 0.0 109.998 -169.674 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 58.1 mtt-85 -144.81 153.32 41.51 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 124.555 1.142 . . . . 0.0 110.096 -176.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 8.7 p -139.07 163.33 32.7 Favored 'General case' 0 CA--C 1.521 -0.164 0 O-C-N 124.389 1.056 . . . . 0.0 111.088 170.609 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.533 0.294 0 C-N-CA 123.807 0.843 . . . . 0.0 112.194 -171.606 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 29.3 t80 . . . . . 0 N--CA 1.453 -0.304 0 CA-C-O 121.928 0.87 . . . . 0.0 109.562 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -61.8 138.41 46.48 Favored Glycine 0 CA--C 1.522 0.484 0 N-CA-C 109.201 -1.56 . . . . 0.0 109.201 160.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -140.01 126.87 20.69 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 118.825 1.312 . . . . 0.0 109.709 170.102 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -145.26 158.74 13.36 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.338 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 -158.464 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -123.5 41.62 3.43 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 121.881 0.848 . . . . 0.0 111.516 -174.726 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 97.5 t -87.19 129.14 39.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 166.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 52.8 pttt -49.53 101.48 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 126.211 1.805 . . . . 0.0 113.363 179.292 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.479 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -66.47 127.07 30.89 Favored 'General case' 0 CA--C 1.515 -0.378 0 C-N-CA 123.0 0.52 . . . . 0.0 110.591 170.358 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 87.2 m-85 -96.94 -12.43 23.41 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 125.198 1.561 . . . . 0.0 109.979 153.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -177.15 153.42 0.97 Allowed 'General case' 0 C--N 1.343 0.318 0 C-N-CA 124.483 1.113 . . . . 0.0 109.212 -177.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.444 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 1.9 p -54.52 -41.22 69.4 Favored 'General case' 0 N--CA 1.457 -0.12 0 C-N-CA 125.31 1.444 . . . . 0.0 111.199 171.513 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.5 p -59.3 -25.08 63.84 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -178.486 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -60.0 -57.38 13.11 Favored 'General case' 0 C--O 1.223 -0.312 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 173.63 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 11.7 m -48.56 -31.4 6.48 Favored 'General case' 0 CA--C 1.508 -0.646 0 C-N-CA 129.008 2.923 . . . . 0.0 109.964 -175.446 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 33.8 m0 -62.58 -63.82 1.11 Allowed 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 175.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -48.11 -39.77 21.45 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 123.263 0.625 . . . . 0.0 111.922 173.487 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.29 -56.72 18.14 Favored 'General case' 0 C--N 1.328 -0.327 0 O-C-N 121.681 -0.637 . . . . 0.0 110.546 178.553 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -59.75 -35.56 74.84 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.595 0.712 . . . . 0.0 110.549 179.076 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 4.3 mtmp? -64.5 -44.63 90.31 Favored 'General case' 0 N--CA 1.439 -1.011 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.438 177.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.43 -54.43 32.28 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 124.226 1.011 . . . . 0.0 109.785 178.791 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -67.58 -62.95 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.325 0 N-CA-C 112.087 0.402 . . . . 0.0 112.087 178.226 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 70.7 p -103.6 -49.51 3.66 Favored 'General case' 0 CA--C 1.522 -0.099 0 C-N-CA 122.779 0.431 . . . . 0.0 110.806 -167.199 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 118.65 -18.1 10.89 Favored Glycine 0 CA--C 1.532 1.1 0 CA-C-N 115.151 -0.932 . . . . 0.0 111.401 -163.692 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 24.5 m -79.56 67.31 5.28 Favored 'General case' 0 C--O 1.227 -0.123 0 C-N-CA 124.467 1.107 . . . . 0.0 110.285 -169.348 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -72.44 40.67 0.76 Allowed Glycine 0 CA--C 1.539 1.584 0 N-CA-C 117.036 1.574 . . . . 0.0 117.036 -160.207 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 63.1 mt-30 -117.09 120.53 38.6 Favored 'General case' 0 C--O 1.224 -0.282 0 C-N-CA 125.739 1.616 . . . . 0.0 108.942 -172.381 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -175.2 -168.39 35.67 Favored Glycine 0 C--N 1.335 0.524 0 CA-C-N 119.622 1.101 . . . . 0.0 111.508 -178.021 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 81.4 mttt -153.77 160.83 42.41 Favored 'General case' 0 CA--C 1.522 -0.101 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 165.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.479 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -89.18 165.57 14.38 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 177.051 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -141.32 141.58 33.87 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 106.264 -1.754 . . . . 0.0 106.264 165.323 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 18.9 t30 61.68 -93.43 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 118.591 0.632 . . . . 0.0 111.07 167.546 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.0 m120 -153.35 55.37 0.75 Allowed 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 127.632 2.373 . . . . 0.0 106.224 162.167 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 17.1 mp0 -148.12 176.82 9.9 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 129.966 3.306 . . . . 0.0 104.442 -176.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.461 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.4 m -156.81 155.1 30.96 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 119.54 1.064 . . . . 0.0 110.126 -171.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 -142.2 134.84 28.24 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 123.847 0.859 . . . . 0.0 109.248 -170.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 49.0 t -111.32 158.05 19.47 Favored 'General case' 0 C--N 1.341 0.228 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 -174.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 16.8 m-30 . . . . . 0 N--CA 1.454 -0.258 0 C-N-CA 125.481 1.512 . . . . 0.0 109.64 -175.302 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 10.7 t80 . . . . . 0 N--CA 1.453 -0.283 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -39.22 147.96 0.14 Allowed Glycine 0 CA--C 1.522 0.517 0 C-N-CA 126.637 2.065 . . . . 0.0 112.119 160.045 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -140.2 130.34 25.0 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 162.25 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -137.1 162.6 33.75 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.15 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 -167.128 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -90.56 -16.91 27.9 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 124.501 1.12 . . . . 0.0 112.621 -172.122 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 58.3 t -75.19 134.57 29.07 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 CA-C-N 118.795 0.725 . . . . 0.0 111.757 -157.294 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.2 tmtt? -37.7 106.31 0.05 OUTLIER 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 127.578 2.351 . . . . 0.0 112.104 173.04 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.499 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -75.28 135.22 40.95 Favored 'General case' 0 CA--C 1.515 -0.388 0 C-N-CA 120.332 -0.547 . . . . 0.0 109.915 168.907 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -95.12 -16.37 22.66 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 158.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 178.51 166.43 0.83 Allowed 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 106.099 -1.815 . . . . 0.0 106.099 -172.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.9 p -61.31 -39.37 90.22 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 124.06 0.944 . . . . 0.0 111.48 172.733 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.6 p -56.77 -40.94 76.78 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 122.773 0.429 . . . . 0.0 111.046 -177.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -40.66 -56.87 2.02 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.634 1.174 . . . . 0.0 111.078 170.546 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 23.7 m -57.95 -28.37 64.25 Favored 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 128.026 2.53 . . . . 0.0 109.73 -173.311 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 33.2 m0 -64.65 -66.15 0.58 Allowed 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 107.186 -1.413 . . . . 0.0 107.186 177.534 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -51.67 -33.14 32.54 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 118.085 -0.959 . . . . 0.0 111.696 174.409 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.82 -54.38 36.01 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 120.107 1.321 . . . . 0.0 110.709 175.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 5.1 t -58.12 -37.16 74.06 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.071 0.463 . . . . 0.0 110.46 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.42 ' CG ' ' HA3' ' A' ' 25' ' ' GLY . 40.3 mtmt -63.5 -58.71 6.15 Favored 'General case' 0 N--CA 1.44 -0.943 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.706 177.079 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 64.3 mmtt -49.53 -47.11 49.13 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.303 1.041 . . . . 0.0 111.835 178.076 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 44.0 t -70.87 -60.02 2.86 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.77 0 C-N-CA 123.962 0.905 . . . . 0.0 109.15 -178.102 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.2 m -118.58 -41.54 2.81 Favored 'General case' 0 N--CA 1.439 -1.004 0 C-N-CA 123.591 0.756 . . . . 0.0 110.987 -161.103 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 120.83 -21.42 8.41 Favored Glycine 0 CA--C 1.533 1.215 0 C-N-CA 124.908 1.242 . . . . 0.0 112.372 -177.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 21.5 m -88.17 61.08 6.09 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 124.709 1.204 . . . . 0.0 110.322 -160.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.42 ' HA3' ' CG ' ' A' ' 19' ' ' LYS . . . -64.13 23.39 0.09 OUTLIER Glycine 0 CA--C 1.54 1.623 0 N-CA-C 120.414 2.926 . . . . 0.0 120.414 -152.614 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -108.38 118.2 36.16 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 121.129 2.465 . . . . 0.0 109.903 -176.3 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -163.99 -170.49 28.98 Favored Glycine 0 CA--C 1.528 0.875 0 N-CA-C 112.157 -0.377 . . . . 0.0 112.157 -174.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -156.38 156.08 33.26 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 125.159 1.384 . . . . 0.0 107.879 174.073 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.499 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 0.0 OUTLIER -92.14 160.57 15.13 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 178.485 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.8 tp-100 -133.62 126.69 31.41 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 105.896 -1.89 . . . . 0.0 105.896 165.659 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.2 t30 69.04 -78.91 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 164.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -166.63 44.86 0.06 Allowed 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 130.411 3.484 . . . . 0.0 108.894 170.388 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -147.61 179.35 7.75 Favored 'General case' 0 N--CA 1.442 -0.825 0 C-N-CA 128.875 2.87 . . . . 0.0 104.167 177.453 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.432 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 5.0 m -153.94 164.75 37.9 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 119.894 1.224 . . . . 0.0 110.399 -169.422 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 73.4 mtp180 -140.0 152.93 46.68 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 125.651 1.58 . . . . 0.0 108.976 -178.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 36.8 t -132.59 162.63 30.8 Favored 'General case' 0 C--O 1.224 -0.26 0 O-C-N 124.652 1.22 . . . . 0.0 109.34 178.791 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.534 0.355 0 CA-C-N 118.651 0.66 . . . . 0.0 111.365 -177.294 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 . . . . . 0 CA--C 1.532 0.284 0 CA-C-O 121.158 0.504 . . . . 0.0 110.922 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 135.8 -118.4 1.85 Allowed Glycine 0 N--CA 1.449 -0.498 0 CA-C-O 117.949 -1.473 . . . . 0.0 110.664 173.221 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -130.78 147.16 52.4 Favored 'General case' 0 C--N 1.339 0.119 0 CA-C-N 118.512 1.156 . . . . 0.0 112.224 -173.581 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -140.42 160.67 25.02 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.373 0 N-CA-C 104.932 -2.247 . . . . 0.0 104.932 -171.487 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -123.33 41.88 3.36 Favored 'General case' 0 C--N 1.332 -0.19 0 C-N-CA 123.077 0.551 . . . . 0.0 110.677 -171.734 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 95.9 t -96.45 135.97 28.83 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 170.358 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.67 106.7 0.27 Allowed 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.815 1.246 . . . . 0.0 112.372 -177.748 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.432 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -65.19 127.29 31.08 Favored 'General case' 0 CA--C 1.515 -0.367 0 C-N-CA 122.587 0.355 . . . . 0.0 110.259 168.005 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -85.21 -19.19 32.06 Favored 'General case' 0 CA--C 1.538 0.519 0 O-C-N 124.403 1.064 . . . . 0.0 109.237 155.309 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -175.39 171.51 2.85 Favored 'General case' 0 C--O 1.221 -0.406 0 C-N-CA 125.486 1.515 . . . . 0.0 108.11 -179.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.44 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 20.0 m -62.86 -37.94 88.86 Favored 'General case' 0 N--CA 1.464 0.254 0 O-C-N 121.72 -0.612 . . . . 0.0 111.934 170.688 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.2 p -57.99 -34.36 69.9 Favored 'General case' 0 N--CA 1.452 -0.361 0 O-C-N 121.768 -0.582 . . . . 0.0 110.999 -178.138 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -40.24 -54.69 2.31 Favored 'General case' 0 C--O 1.225 -0.225 0 C-N-CA 124.42 1.088 . . . . 0.0 111.567 167.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 19.1 m -64.93 -30.06 71.03 Favored 'General case' 0 N--CA 1.44 -0.949 0 C-N-CA 127.394 2.278 . . . . 0.0 108.438 -171.019 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 28.9 m0 -64.9 -65.72 0.64 Allowed 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 106.178 -1.786 . . . . 0.0 106.178 176.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -51.46 -33.6 31.73 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 118.604 -0.712 . . . . 0.0 112.149 176.75 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.48 -54.88 25.57 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 119.902 1.228 . . . . 0.0 110.259 177.376 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -60.29 -34.1 73.29 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 120.794 0.33 . . . . 0.0 110.343 179.835 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 39.1 mtmt -65.16 -53.9 37.85 Favored 'General case' 0 N--CA 1.439 -0.999 0 C-N-CA 122.483 0.313 . . . . 0.0 110.839 176.267 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -48.32 -49.49 33.89 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 123.569 0.748 . . . . 0.0 110.71 176.786 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 65.3 t -73.15 -56.07 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.697 0 C-N-CA 124.289 1.036 . . . . 0.0 110.299 -175.477 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 11.9 t -138.91 18.85 2.65 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 113.588 0.959 . . . . 0.0 113.588 -162.517 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.09 -27.53 0.54 Allowed Glycine 0 CA--C 1.542 1.74 0 O-C-N 120.566 -1.334 . . . . 0.0 115.132 176.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 10.1 t -84.72 73.52 10.58 Favored 'General case' 0 C--O 1.226 -0.171 0 O-C-N 121.488 -1.007 . . . . 0.0 109.539 -162.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -72.04 35.77 0.63 Allowed Glycine 0 CA--C 1.536 1.398 0 N-CA-C 117.013 1.565 . . . . 0.0 117.013 -162.439 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -111.56 109.74 19.81 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 119.952 1.876 . . . . 0.0 109.454 -173.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -161.8 -169.19 24.78 Favored Glycine 0 CA--C 1.527 0.784 0 CA-C-N 118.736 0.698 . . . . 0.0 113.565 -173.558 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 19.2 ttmm -165.98 142.59 5.2 Favored 'General case' 0 CA--C 1.519 -0.246 0 C-N-CA 125.192 1.397 . . . . 0.0 107.748 -178.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.451 ' HA ' ' HA ' ' A' ' 34' ' ' CYS . 0.1 OUTLIER -86.08 149.04 25.42 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 109.217 -0.661 . . . . 0.0 109.217 -177.901 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 21.1 tp60 -116.22 111.3 19.98 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 105.056 -2.202 . . . . 0.0 105.056 174.555 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 63.32 -92.37 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 119.598 1.09 . . . . 0.0 109.731 172.002 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 21.8 m120 -147.68 55.18 1.07 Allowed 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 126.02 1.728 . . . . 0.0 107.891 165.193 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.4 mp0 -141.55 175.76 9.42 Favored 'General case' 0 N--CA 1.445 -0.715 0 C-N-CA 130.752 3.621 . . . . 0.0 103.177 171.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.451 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 0.8 OUTLIER -147.9 155.82 42.01 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-N 120.725 1.602 . . . . 0.0 110.759 -171.46 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 63.0 mtp180 -139.51 151.88 46.49 Favored 'General case' 0 CA--C 1.509 -0.619 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 -171.141 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 47.5 t -143.37 141.45 30.92 Favored 'General case' 0 C--N 1.332 -0.179 0 O-C-N 124.543 1.152 . . . . 0.0 110.817 -172.181 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 72.9 t80 . . . . . 0 N--CA 1.453 -0.298 0 C-N-CA 126.021 1.728 . . . . 0.0 109.834 -170.343 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 . . . . . 0 N--CA 1.449 -0.495 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 127.29 -127.85 5.99 Favored Glycine 0 C--N 1.332 0.307 0 CA-C-O 117.869 -1.517 . . . . 0.0 111.71 168.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -125.93 143.02 51.26 Favored 'General case' 0 C--N 1.342 0.279 0 CA-C-N 118.652 1.226 . . . . 0.0 112.514 -169.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.47 HD11 HG12 ' A' ' 6' ' ' VAL . 0.9 OUTLIER -139.39 162.05 27.34 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.184 0 C-N-CA 126.085 1.754 . . . . 0.0 106.702 -166.332 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -88.42 -15.82 34.47 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 124.03 0.932 . . . . 0.0 113.216 -169.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.47 HG12 HD11 ' A' ' 4' ' ' ILE . 0.8 OUTLIER -67.46 139.46 20.89 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 C-N-CA 119.369 -0.932 . . . . 0.0 112.31 -156.318 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 34.3 mttt -65.55 95.63 0.23 Allowed 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.758 1.223 . . . . 0.0 111.645 -174.093 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.496 ' HB3' ' HB2' ' A' ' 29' ' ' CYS . 1.4 p -67.09 133.21 49.41 Favored 'General case' 0 CA--C 1.517 -0.31 0 O-C-N 123.109 0.255 . . . . 0.0 111.12 176.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 52.8 m-85 -85.47 -27.79 25.45 Favored 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 124.047 0.842 . . . . 0.0 109.295 150.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -169.79 160.71 8.8 Favored 'General case' 0 C--O 1.223 -0.333 0 C-N-CA 123.813 0.845 . . . . 0.0 109.833 -179.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.439 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 66.8 m -46.56 -38.28 9.21 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 114.161 1.171 . . . . 0.0 114.161 175.069 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.8 p -58.02 -27.73 63.81 Favored 'General case' 0 N--CA 1.449 -0.475 0 O-C-N 121.634 -0.666 . . . . 0.0 112.161 -179.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -54.49 -47.05 73.5 Favored 'General case' 0 C--O 1.219 -0.503 0 C-N-CA 124.333 1.053 . . . . 0.0 111.345 170.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.412 ' SG ' ' CA ' ' A' ' 29' ' ' CYS . 6.3 m -67.47 -33.16 74.56 Favored 'General case' 0 CA--C 1.498 -1.027 0 C-N-CA 125.922 1.689 . . . . 0.0 107.614 -175.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 33.4 m0 -64.55 -65.79 0.63 Allowed 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 106.53 -1.656 . . . . 0.0 106.53 177.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 21.4 p -55.87 -29.76 60.43 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 118.583 -0.723 . . . . 0.0 111.999 -179.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.25 -54.76 18.0 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 119.298 0.953 . . . . 0.0 111.27 175.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.8 t -60.0 -36.92 78.23 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-O 121.55 0.691 . . . . 0.0 110.089 179.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 75.0 mttt -60.82 -54.39 45.69 Favored 'General case' 0 N--CA 1.436 -1.141 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.938 174.135 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -43.98 -53.89 5.85 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 124.198 0.999 . . . . 0.0 111.001 177.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 91.7 t -77.32 -60.43 2.31 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.836 0 C-N-CA 124.543 1.137 . . . . 0.0 109.775 -173.237 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 30.8 p -103.52 -42.13 5.77 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 122.788 0.435 . . . . 0.0 111.95 -167.76 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 110.29 -16.5 29.63 Favored Glycine 0 CA--C 1.536 1.365 0 C-N-CA 124.567 1.08 . . . . 0.0 111.234 -165.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 3.5 m -82.75 65.33 7.82 Favored 'General case' 0 C--O 1.224 -0.252 0 C-N-CA 124.276 1.03 . . . . 0.0 110.339 -165.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -74.27 34.86 0.94 Allowed Glycine 0 CA--C 1.538 1.508 0 N-CA-C 117.856 1.902 . . . . 0.0 117.856 -155.132 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 57.4 mt-30 -113.65 124.83 53.24 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 119.891 1.845 . . . . 0.0 109.428 -177.05 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -170.73 -168.21 32.17 Favored Glycine 0 CA--C 1.523 0.559 0 CA-C-N 119.161 0.891 . . . . 0.0 112.529 -175.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -159.81 142.03 13.33 Favored 'General case' 0 CA--C 1.52 -0.207 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 175.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.496 ' HB2' ' HB3' ' A' ' 8' ' ' CYS . 0.5 OUTLIER -86.54 157.52 19.73 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 108.188 -1.041 . . . . 0.0 108.188 -179.514 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 15.5 tt0 -136.67 123.93 21.86 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 105.383 -2.08 . . . . 0.0 105.383 176.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 22.2 t30 68.5 -92.75 0.03 OUTLIER 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 118.805 0.73 . . . . 0.0 109.795 167.244 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 24.3 m120 -154.46 57.05 0.7 Allowed 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 127.561 2.344 . . . . 0.0 105.691 160.486 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.7 mp0 -144.69 175.44 10.16 Favored 'General case' 0 N--CA 1.445 -0.68 0 C-N-CA 130.356 3.463 . . . . 0.0 103.097 175.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.2 m -149.91 161.85 41.48 Favored 'General case' 0 CA--C 1.504 -0.792 0 O-C-N 120.636 -1.29 . . . . 0.0 110.629 -173.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 49.6 mtp180 -139.63 150.72 45.29 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 -175.292 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 49.3 t -137.48 146.98 44.9 Favored 'General case' 0 N--CA 1.463 0.218 0 O-C-N 124.4 1.062 . . . . 0.0 110.398 -173.034 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 87.3 t80 . . . . . 0 N--CA 1.452 -0.328 0 C-N-CA 126.617 1.967 . . . . 0.0 109.344 -171.346 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 3.2 t80 . . . . . 0 N--CA 1.456 -0.157 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -57.61 171.91 3.12 Favored Glycine 0 CA--C 1.525 0.7 0 C-N-CA 126.708 2.099 . . . . 0.0 112.203 176.054 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -154.22 132.39 11.81 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 105.738 -1.949 . . . . 0.0 105.738 155.283 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -132.31 -176.45 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 N-CA-C 107.745 -1.205 . . . . 0.0 107.745 -175.226 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -137.39 84.92 2.09 Favored 'General case' 0 N--CA 1.457 -0.097 0 CA-C-O 121.89 0.852 . . . . 0.0 110.928 163.821 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 94.6 t -128.35 136.43 60.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 N-CA-C 105.382 -2.081 . . . . 0.0 105.382 156.313 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -70.42 115.74 9.95 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 123.765 0.826 . . . . 0.0 110.932 -168.381 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.493 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -68.69 125.38 26.37 Favored 'General case' 0 CA--C 1.514 -0.419 0 C-N-CA 122.661 0.385 . . . . 0.0 110.304 177.114 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -77.66 -27.13 50.82 Favored 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 124.61 1.194 . . . . 0.0 109.588 151.118 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -179.7 153.91 0.57 Allowed 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 124.417 1.087 . . . . 0.0 108.796 -172.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 36.7 m -49.51 -38.85 32.01 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 124.027 0.931 . . . . 0.0 113.04 173.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.3 p -62.12 -20.36 63.98 Favored 'General case' 0 N--CA 1.445 -0.71 0 C-N-CA 122.775 0.43 . . . . 0.0 112.127 -178.383 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.07 -50.74 18.3 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-N 118.509 0.595 . . . . 0.0 109.622 176.09 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 17.7 m -46.35 -28.65 1.39 Allowed 'General case' 0 CA--C 1.51 -0.575 0 C-N-CA 126.91 2.084 . . . . 0.0 110.52 -179.496 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 29.6 m0 -60.56 -71.43 0.14 Allowed 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 114.524 -1.217 . . . . 0.0 108.107 172.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -50.14 -31.04 12.5 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 124.109 0.964 . . . . 0.0 112.284 175.066 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.06 -54.77 32.81 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 120.273 1.397 . . . . 0.0 110.887 173.167 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 2.5 t -58.22 -35.72 72.09 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.863 0.84 . . . . 0.0 110.286 179.781 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 33.4 mtpt -63.22 -50.61 69.57 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.313 175.245 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -48.43 -55.41 10.96 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.91 0.884 . . . . 0.0 110.644 177.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -66.16 -61.35 1.73 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 179.05 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 81.9 p -107.78 -46.6 3.76 Favored 'General case' 0 C--N 1.338 0.107 0 CA-C-O 120.877 0.37 . . . . 0.0 111.16 -166.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 117.3 -16.94 12.71 Favored Glycine 0 CA--C 1.531 1.074 0 CA-C-N 115.295 -0.866 . . . . 0.0 111.303 -164.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 43.3 t -78.35 62.42 3.0 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 125.327 1.451 . . . . 0.0 110.683 -168.543 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -68.48 28.03 0.27 Allowed Glycine 0 CA--C 1.54 1.646 0 N-CA-C 118.369 2.108 . . . . 0.0 118.369 -157.642 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 58.2 mt-30 -113.06 108.07 16.82 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 120.584 2.192 . . . . 0.0 110.258 -173.473 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -157.44 -168.2 19.57 Favored Glycine 0 C--N 1.339 0.722 0 CA-C-O 119.872 -0.404 . . . . 0.0 112.599 -174.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -156.37 157.97 36.57 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 126.206 1.802 . . . . 0.0 107.718 170.872 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.493 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -89.51 162.82 15.5 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 108.725 -0.842 . . . . 0.0 108.725 178.108 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 20.4 tt0 -139.24 121.16 15.54 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 106.733 -1.58 . . . . 0.0 106.733 168.294 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 72.27 -88.22 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 123.051 0.54 . . . . 0.0 109.884 170.508 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.7 m120 -159.06 52.81 0.39 Allowed 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 128.55 2.74 . . . . 0.0 105.566 161.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 36.3 mt-30 -137.19 -175.19 3.97 Favored 'General case' 0 N--CA 1.444 -0.728 0 C-N-CA 128.933 2.893 . . . . 0.0 103.358 163.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.456 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.6 m -153.86 165.98 34.35 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 119.317 0.962 . . . . 0.0 110.321 -171.088 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 29.1 mtp180 -147.74 152.88 38.51 Favored 'General case' 0 CA--C 1.516 -0.357 0 C-N-CA 124.747 1.219 . . . . 0.0 108.326 -168.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 48.7 t -145.34 148.2 33.14 Favored 'General case' 0 C--N 1.328 -0.35 0 O-C-N 124.48 1.112 . . . . 0.0 109.491 -174.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.536 0.408 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -169.503 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 60.6 t80 . . . . . 0 N--CA 1.454 -0.263 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -48.52 160.75 0.6 Allowed Glycine 0 CA--C 1.525 0.715 0 C-N-CA 127.063 2.268 . . . . 0.0 112.416 177.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -143.65 130.79 20.7 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 119.022 1.411 . . . . 0.0 109.457 165.596 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -143.09 159.06 17.8 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.25 0 N-CA-C 106.298 -1.741 . . . . 0.0 106.298 -169.244 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -100.95 8.89 42.84 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 -164.014 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 93.3 t -78.7 136.2 24.36 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 O-C-N 121.687 -0.633 . . . . 0.0 110.68 -170.705 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -61.9 95.41 0.06 Allowed 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 125.419 1.488 . . . . 0.0 111.198 -177.177 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.48 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -61.38 120.18 9.96 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.557 170.851 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -83.18 -20.59 34.37 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 124.983 1.427 . . . . 0.0 109.941 151.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -178.83 150.19 0.48 Allowed 'General case' 0 C--N 1.341 0.239 0 C-N-CA 124.432 1.093 . . . . 0.0 109.123 -175.187 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.417 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 57.9 m -47.81 -35.61 10.42 Favored 'General case' 0 C--N 1.333 -0.129 0 C-N-CA 124.787 1.235 . . . . 0.0 113.754 173.079 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.0 p -61.24 -28.56 69.25 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 179.643 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -55.13 -54.65 40.46 Favored 'General case' 0 C--O 1.226 -0.175 0 C-N-CA 123.204 0.602 . . . . 0.0 109.507 174.563 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 11.4 m -55.02 -31.46 61.07 Favored 'General case' 0 N--CA 1.443 -0.811 0 C-N-CA 128.684 2.794 . . . . 0.0 109.253 -174.273 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 39.0 m0 -63.46 -68.34 0.35 Allowed 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 178.474 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -51.07 -32.23 21.43 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 118.345 -0.836 . . . . 0.0 112.163 175.483 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.54 -52.77 63.09 Favored 'General case' 0 C--N 1.339 0.136 0 CA-C-N 120.174 1.352 . . . . 0.0 110.326 174.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.8 t -62.46 -35.06 78.12 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 121.247 0.546 . . . . 0.0 110.434 179.3 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 41.7 mtpt -61.94 -51.92 66.15 Favored 'General case' 0 N--CA 1.44 -0.949 0 CA-C-O 121.788 0.804 . . . . 0.0 109.666 176.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.6 tptm -56.69 -42.41 79.04 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.19 -0.913 . . . . 0.0 111.493 -179.214 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 37.5 t -70.52 -59.49 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.357 0 C-N-CA 124.059 0.944 . . . . 0.0 109.447 179.195 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.7 t -117.63 -46.48 2.66 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.855 0.862 . . . . 0.0 111.966 -166.366 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 125.72 -25.04 5.68 Favored Glycine 0 CA--C 1.53 0.972 0 N-CA-C 111.162 -0.775 . . . . 0.0 111.162 -175.818 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 31.2 t -78.76 73.54 5.31 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 125.413 1.485 . . . . 0.0 108.821 -172.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -70.91 39.91 0.54 Allowed Glycine 0 CA--C 1.54 1.619 0 N-CA-C 116.294 1.278 . . . . 0.0 116.294 -168.451 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 64.2 mt-30 -114.79 115.75 27.52 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 126.217 1.807 . . . . 0.0 108.353 -174.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -170.93 -162.87 24.01 Favored Glycine 0 C--N 1.333 0.366 0 CA-C-N 119.524 1.056 . . . . 0.0 111.257 -176.74 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 4.6 pttp -167.06 164.81 15.91 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 165.319 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.48 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -87.39 172.11 10.07 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 119.999 -0.68 . . . . 0.0 110.153 -176.653 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -145.31 121.67 10.95 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 105.098 -2.186 . . . . 0.0 105.098 172.53 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 64.5 t30 68.86 -93.4 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 119.372 0.987 . . . . 0.0 110.23 169.723 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 26.1 m120 -153.8 52.03 0.69 Allowed 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 128.315 2.646 . . . . 0.0 106.002 161.532 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -139.17 177.58 7.8 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 131.07 3.748 . . . . 0.0 102.609 175.238 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.447 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.3 m -150.56 163.68 37.88 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-N 120.624 1.556 . . . . 0.0 111.647 -173.083 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 50.7 mtp180 -142.39 150.8 41.15 Favored 'General case' 0 CA--C 1.512 -0.518 0 C-N-CA 124.061 0.944 . . . . 0.0 109.686 -170.395 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 52.5 t -141.21 133.88 28.67 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 124.658 1.224 . . . . 0.0 112.694 -174.668 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 . . . . . 0 N--CA 1.451 -0.379 0 C-N-CA 126.573 1.949 . . . . 0.0 109.715 178.129 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 10.7 t80 . . . . . 0 N--CA 1.453 -0.283 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -39.39 148.04 0.15 Allowed Glycine 0 CA--C 1.522 0.521 0 C-N-CA 126.579 2.038 . . . . 0.0 112.139 160.126 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -140.2 130.34 25.0 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 162.339 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -137.07 162.57 33.87 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.18 0 N-CA-C 107.108 -1.441 . . . . 0.0 107.108 -167.095 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -90.56 -16.91 27.9 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 124.501 1.12 . . . . 0.0 112.621 -172.147 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 58.6 t -75.21 134.59 29.01 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 CA-C-N 118.795 0.725 . . . . 0.0 111.799 -157.321 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.2 tmtt? -37.7 106.31 0.05 OUTLIER 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 127.578 2.351 . . . . 0.0 112.104 173.067 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.499 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -75.28 135.22 40.95 Favored 'General case' 0 CA--C 1.515 -0.388 0 C-N-CA 120.332 -0.547 . . . . 0.0 109.915 168.907 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -95.12 -16.37 22.66 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 158.512 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 178.51 166.43 0.83 Allowed 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 106.099 -1.815 . . . . 0.0 106.099 -172.726 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.9 p -61.31 -39.33 90.09 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 124.06 0.944 . . . . 0.0 111.48 172.733 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.6 p -56.83 -40.96 76.99 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 122.86 0.464 . . . . 0.0 111.0 -177.455 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -40.66 -56.87 2.02 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.634 1.174 . . . . 0.0 111.078 170.546 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 23.7 m -57.95 -28.37 64.25 Favored 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 128.026 2.53 . . . . 0.0 109.73 -173.311 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 33.2 m0 -64.65 -66.15 0.58 Allowed 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 107.186 -1.413 . . . . 0.0 107.186 177.534 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -51.67 -33.14 32.54 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 118.085 -0.959 . . . . 0.0 111.696 174.409 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.85 -54.33 36.69 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 120.107 1.321 . . . . 0.0 110.742 175.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 5.1 t -58.12 -37.16 74.06 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.071 0.463 . . . . 0.0 110.46 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.419 ' CG ' ' HA3' ' A' ' 25' ' ' GLY . 40.3 mtmt -63.5 -58.71 6.15 Favored 'General case' 0 N--CA 1.44 -0.943 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.706 177.079 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 64.3 mmtt -49.55 -47.12 49.3 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.324 1.05 . . . . 0.0 111.772 178.11 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 43.7 t -70.87 -60.02 2.86 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.77 0 C-N-CA 123.962 0.905 . . . . 0.0 109.15 -178.08 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.2 m -118.58 -41.54 2.81 Favored 'General case' 0 N--CA 1.439 -1.004 0 C-N-CA 123.591 0.756 . . . . 0.0 110.987 -161.103 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 120.81 -21.36 8.44 Favored Glycine 0 CA--C 1.534 1.24 0 C-N-CA 124.925 1.25 . . . . 0.0 112.336 -177.778 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 21.5 m -88.22 61.12 6.09 Favored 'General case' 0 C--O 1.223 -0.297 0 C-N-CA 124.709 1.204 . . . . 0.0 110.331 -160.653 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.419 ' HA3' ' CG ' ' A' ' 19' ' ' LYS . . . -64.15 23.39 0.09 OUTLIER Glycine 0 CA--C 1.54 1.623 0 N-CA-C 120.414 2.926 . . . . 0.0 120.414 -152.626 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -108.38 118.2 36.16 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 121.129 2.465 . . . . 0.0 109.903 -176.3 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -164.04 -170.51 29.06 Favored Glycine 0 CA--C 1.528 0.876 0 N-CA-C 112.195 -0.362 . . . . 0.0 112.195 -174.589 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -156.34 156.08 33.33 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 125.138 1.375 . . . . 0.0 107.879 174.121 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.499 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 0.0 OUTLIER -92.14 160.57 15.13 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 178.485 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.8 tp-100 -133.62 126.69 31.41 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 105.896 -1.89 . . . . 0.0 105.896 165.659 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.2 t30 69.04 -78.91 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 164.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -166.63 44.86 0.06 Allowed 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 130.411 3.484 . . . . 0.0 108.894 170.388 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -147.61 179.35 7.75 Favored 'General case' 0 N--CA 1.442 -0.825 0 C-N-CA 128.875 2.87 . . . . 0.0 104.167 177.453 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.432 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 5.0 m -153.94 164.75 37.9 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 119.894 1.224 . . . . 0.0 110.399 -169.422 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 73.4 mtp180 -140.0 152.93 46.68 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 125.651 1.58 . . . . 0.0 108.976 -178.685 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 36.8 t -132.59 162.63 30.8 Favored 'General case' 0 C--O 1.224 -0.26 0 O-C-N 124.652 1.22 . . . . 0.0 109.34 178.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.534 0.355 0 CA-C-N 118.651 0.66 . . . . 0.0 111.365 -177.294 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 7.2 m-85 . . . . . 0 CA--C 1.534 0.346 0 CA-C-O 120.805 0.336 . . . . 0.0 110.983 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 138.65 -152.7 22.21 Favored Glycine 0 C--N 1.334 0.448 0 C-N-CA 124.409 1.004 . . . . 0.0 111.035 172.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -89.84 149.76 22.53 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 117.427 0.614 . . . . 0.0 111.992 -172.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -126.1 167.09 21.13 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.995 0 N-CA-C 105.843 -1.91 . . . . 0.0 105.843 176.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -127.72 57.04 1.54 Allowed 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 122.0 0.905 . . . . 0.0 109.892 -177.197 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 43.6 t -128.37 143.8 39.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 N-CA-C 108.231 -1.025 . . . . 0.0 108.231 167.187 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -55.37 132.77 48.94 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 125.19 1.396 . . . . 0.0 113.312 -174.351 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.459 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -86.2 139.1 31.36 Favored 'General case' 0 CA--C 1.516 -0.363 0 C-N-CA 123.12 0.568 . . . . 0.0 109.672 164.107 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -91.01 -20.65 21.87 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 124.171 0.92 . . . . 0.0 109.543 154.497 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -178.91 173.47 1.2 Allowed 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 126.972 2.109 . . . . 0.0 106.273 -172.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 31.3 m -64.15 -32.86 74.6 Favored 'General case' 0 N--CA 1.462 0.135 0 C-N-CA 123.668 0.787 . . . . 0.0 112.631 173.332 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -54.12 -54.62 37.0 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 122.134 0.969 . . . . 0.0 110.723 -172.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.5 mp0 -32.57 -57.64 0.34 Allowed 'General case' 0 N--CA 1.429 -1.514 0 C-N-CA 128.07 2.548 . . . . 0.0 114.285 168.577 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 14.5 m -54.17 -29.28 45.04 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 126.376 1.87 . . . . 0.0 109.679 -175.839 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 30.9 m0 -66.92 -66.54 0.54 Allowed 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 106.214 -1.772 . . . . 0.0 106.214 -179.694 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -50.36 -32.34 17.08 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 124.018 0.927 . . . . 0.0 111.392 174.815 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.85 -56.42 19.54 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 119.578 1.081 . . . . 0.0 109.732 175.056 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -60.15 -34.05 73.02 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-O 121.048 0.451 . . . . 0.0 111.057 179.478 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 32.6 mtpt -63.72 -54.58 33.2 Favored 'General case' 0 N--CA 1.442 -0.847 0 O-C-N 121.618 -0.676 . . . . 0.0 111.103 176.793 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -57.19 -39.27 75.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.521 178.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 31.8 t -73.32 -67.89 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.431 -1.4 0 C-N-CA 124.293 1.037 . . . . 0.0 109.218 179.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -107.29 -40.23 5.45 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 122.956 0.502 . . . . 0.0 112.063 -170.481 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 117.61 -15.97 12.64 Favored Glycine 0 CA--C 1.532 1.152 0 C-N-CA 124.608 1.099 . . . . 0.0 110.822 -166.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 30.4 t -82.22 64.82 7.07 Favored 'General case' 0 CA--C 1.527 0.094 0 C-N-CA 124.353 1.061 . . . . 0.0 110.092 -166.568 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -70.97 38.38 0.52 Allowed Glycine 0 CA--C 1.535 1.339 0 N-CA-C 117.916 1.926 . . . . 0.0 117.916 -160.06 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 -121.04 114.07 20.96 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 120.071 1.936 . . . . 0.0 108.58 -179.189 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -158.22 -177.69 31.55 Favored Glycine 0 CA--C 1.523 0.534 0 N-CA-C 111.52 -0.632 . . . . 0.0 111.52 -175.498 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -153.35 145.29 23.62 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 106.922 -1.51 . . . . 0.0 106.922 177.637 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.459 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -88.51 165.88 14.57 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 178.663 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -138.77 118.33 12.98 Favored 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 105.656 -1.979 . . . . 0.0 105.656 171.749 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 63.46 -89.32 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.455 0.702 . . . . 0.0 110.556 172.549 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.2 m120 -153.25 53.65 0.75 Allowed 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 127.001 2.121 . . . . 0.0 107.07 168.142 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -143.62 166.17 25.58 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 103.036 -2.949 . . . . 0.0 103.036 173.038 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.427 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.2 m -143.12 158.31 43.73 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 120.853 1.66 . . . . 0.0 110.257 -174.436 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 33.5 mtp180 -142.82 154.12 43.87 Favored 'General case' 0 CA--C 1.514 -0.433 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 -172.024 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 41.8 t -133.4 140.71 47.49 Favored 'General case' 0 C--N 1.328 -0.331 0 O-C-N 124.16 0.913 . . . . 0.0 110.15 -172.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 82.8 t80 . . . . . 0 N--CA 1.455 -0.222 0 C-N-CA 125.568 1.547 . . . . 0.0 109.81 -163.258 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 5.8 m-30 . . . . . 0 CA--C 1.532 0.285 0 CA-C-O 121.04 0.447 . . . . 0.0 111.034 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 123.14 -151.34 16.87 Favored Glycine 0 C--N 1.333 0.37 0 C-N-CA 124.461 1.029 . . . . 0.0 111.749 169.463 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.535 ' HA ' ' HG3' ' A' ' 35' ' ' ARG . 2.5 pt? -109.49 133.74 52.72 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 114.926 1.454 . . . . 0.0 114.926 -159.471 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -138.98 154.2 25.7 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.495 0 N-CA-C 104.348 -2.464 . . . . 0.0 104.348 -165.559 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -122.89 35.16 4.94 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 119.635 1.107 . . . . 0.0 111.089 -171.252 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.3 p -77.43 136.98 23.22 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-N 116.141 -0.481 . . . . 0.0 109.774 172.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 37.5 mtpt -66.16 96.01 0.31 Allowed 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.453 1.101 . . . . 0.0 112.221 -175.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.526 ' HB3' ' HB2' ' A' ' 29' ' ' CYS . 1.9 p -61.95 131.42 49.64 Favored 'General case' 0 CA--C 1.519 -0.213 0 O-C-N 123.789 0.681 . . . . 0.0 110.847 176.571 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 81.8 m-85 -88.36 -26.64 22.09 Favored 'General case' 0 N--CA 1.444 -0.771 0 C-N-CA 125.627 1.571 . . . . 0.0 108.749 155.194 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -165.87 160.27 16.73 Favored 'General case' 0 C--N 1.344 0.364 0 C-N-CA 123.548 0.739 . . . . 0.0 109.815 179.622 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.513 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 1.9 p -58.26 -41.24 83.81 Favored 'General case' 0 C--N 1.333 -0.118 0 C-N-CA 123.924 0.889 . . . . 0.0 111.404 173.713 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.39 -24.98 63.89 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 122.81 0.444 . . . . 0.0 111.672 -178.332 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 45.1 tt0 -61.85 -44.56 96.58 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 121.708 -0.62 . . . . 0.0 111.204 172.428 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 29.0 m -59.6 -27.91 66.71 Favored 'General case' 0 N--CA 1.439 -0.993 0 C-N-CA 125.687 1.595 . . . . 0.0 108.871 -177.079 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 36.5 m0 -65.98 -67.5 0.44 Allowed 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 107.444 -1.317 . . . . 0.0 107.444 178.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -53.26 -28.32 27.03 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.921 0.889 . . . . 0.0 111.57 175.019 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.02 -55.65 17.71 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 119.549 1.068 . . . . 0.0 110.23 174.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.2 t -61.08 -32.82 72.47 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 110.439 -0.208 . . . . 0.0 110.439 -179.434 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.6 mtmp? -63.41 -61.39 2.38 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-O 121.156 0.503 . . . . 0.0 110.853 174.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 17.1 pttm -59.52 -31.31 69.27 Favored 'General case' 0 N--CA 1.44 -0.964 0 N-CA-C 112.403 0.52 . . . . 0.0 112.403 -174.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 53.9 t -79.42 -57.57 5.03 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.514 0 C-N-CA 124.281 1.032 . . . . 0.0 109.865 176.309 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 13.2 t -140.64 25.34 2.19 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 113.753 1.02 . . . . 0.0 113.753 -162.844 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.35 -24.19 0.27 Allowed Glycine 0 CA--C 1.537 1.465 0 O-C-N 120.902 -1.123 . . . . 0.0 115.247 177.219 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 47.4 m -87.92 64.98 8.12 Favored 'General case' 0 C--O 1.223 -0.324 0 O-C-N 121.122 -1.223 . . . . 0.0 110.603 -155.803 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -66.79 23.49 0.18 Allowed Glycine 0 CA--C 1.538 1.513 0 N-CA-C 119.589 2.596 . . . . 0.0 119.589 -154.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -111.7 121.91 46.39 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 120.736 2.268 . . . . 0.0 109.709 -175.078 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -170.82 -166.08 29.15 Favored Glycine 0 C--N 1.337 0.613 0 CA-C-N 118.742 0.701 . . . . 0.0 111.832 -177.675 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.63 155.54 21.94 Favored 'General case' 0 CA--C 1.52 -0.177 0 C-N-CA 124.8 1.24 . . . . 0.0 108.586 174.51 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.526 ' HB2' ' HB3' ' A' ' 8' ' ' CYS . 0.2 OUTLIER -91.37 166.15 13.04 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 -178.594 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -148.79 121.64 8.73 Favored 'General case' 0 C--O 1.22 -0.483 0 N-CA-C 105.345 -2.095 . . . . 0.0 105.345 -179.197 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 57.65 -94.94 0.05 Allowed 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.913 1.233 . . . . 0.0 109.717 178.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 21.0 m120 -147.22 61.47 1.17 Allowed 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 126.509 1.924 . . . . 0.0 106.926 165.348 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 21.4 mp0 -147.09 173.64 12.3 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 129.5 3.12 . . . . 0.0 105.062 177.547 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.468 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.7 m -150.52 157.08 42.59 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 -176.683 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.535 ' HG3' ' HA ' ' A' ' 3' ' ' LEU . 0.0 OUTLIER -148.06 143.26 27.07 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 124.213 1.005 . . . . 0.0 109.036 -174.053 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 40.7 t -131.45 148.25 52.63 Favored 'General case' 0 C--N 1.338 0.09 0 O-C-N 123.853 0.72 . . . . 0.0 110.47 -164.385 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 87.7 t80 . . . . . 0 N--CA 1.455 -0.218 0 C-N-CA 125.901 1.68 . . . . 0.0 109.722 -168.276 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 . . . . . 0 N--CA 1.451 -0.4 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 110.59 -152.5 17.39 Favored Glycine 0 CA--C 1.521 0.412 0 C-N-CA 124.071 0.843 . . . . 0.0 112.021 169.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.533 ' HA ' ' HG3' ' A' ' 35' ' ' ARG . 2.5 pt? -103.95 136.34 43.78 Favored 'General case' 0 C--N 1.343 0.285 0 N-CA-C 115.184 1.55 . . . . 0.0 115.184 -156.177 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -136.17 159.2 38.78 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.66 0 N-CA-C 103.984 -2.598 . . . . 0.0 103.984 -170.589 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -137.27 47.53 2.1 Favored 'General case' 0 C--N 1.328 -0.354 0 O-C-N 120.901 -1.124 . . . . 0.0 109.234 -173.085 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 87.7 t -97.6 139.35 20.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 171.534 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.72 105.91 0.18 Allowed 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -175.22 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.526 ' HB3' ' HB2' ' A' ' 29' ' ' CYS . 1.2 p -67.64 133.84 50.08 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 169.437 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -78.86 -33.33 45.95 Favored 'General case' 0 N--CA 1.454 -0.236 0 O-C-N 124.335 1.022 . . . . 0.0 109.003 151.613 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -172.76 156.86 3.59 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 124.213 1.005 . . . . 0.0 108.374 -175.33 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.472 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 58.8 m -46.94 -45.88 21.03 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 124.488 1.115 . . . . 0.0 112.617 175.523 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.3 m -63.83 -11.7 29.61 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 -177.464 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.9 -48.41 31.03 Favored 'General case' 0 C--O 1.215 -0.74 0 CA-C-N 119.29 0.95 . . . . 0.0 109.271 168.427 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 18.4 m -48.71 -29.91 4.97 Favored 'General case' 0 CA--C 1.513 -0.473 0 C-N-CA 125.944 1.698 . . . . 0.0 110.1 -178.606 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 42.2 m0 -62.31 -68.09 0.36 Allowed 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 107.01 -1.478 . . . . 0.0 107.01 175.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -52.89 -28.51 23.54 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 117.789 -1.101 . . . . 0.0 112.444 173.931 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.3 -53.46 52.49 Favored 'General case' 0 C--O 1.228 -0.065 0 CA-C-N 121.306 1.866 . . . . 0.0 109.903 174.7 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -61.95 -34.14 75.56 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.122 178.535 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 40.8 mtmt -65.31 -52.15 55.93 Favored 'General case' 0 N--CA 1.445 -0.695 0 O-C-N 121.835 -0.541 . . . . 0.0 111.502 176.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 65.6 mttt -49.76 -45.95 50.05 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.243 1.417 . . . . 0.0 109.938 177.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 95.1 t -76.79 -69.84 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.424 -1.732 0 C-N-CA 124.252 1.021 . . . . 0.0 109.887 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 47.0 p -98.31 -49.04 4.83 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 122.457 0.303 . . . . 0.0 111.445 -169.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 123.35 -17.52 7.91 Favored Glycine 0 CA--C 1.533 1.207 0 C-N-CA 124.961 1.267 . . . . 0.0 111.193 -163.434 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 5.0 m -81.9 64.66 6.69 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 124.483 1.113 . . . . 0.0 110.612 -165.387 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -71.77 38.93 0.63 Allowed Glycine 0 CA--C 1.539 1.539 0 N-CA-C 118.26 2.064 . . . . 0.0 118.26 -155.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -123.27 133.03 54.21 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 120.312 2.056 . . . . 0.0 109.171 -175.605 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 179.01 -164.31 32.51 Favored Glycine 0 CA--C 1.524 0.647 0 CA-C-N 119.24 0.927 . . . . 0.0 111.181 -177.375 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.75 158.07 32.9 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 123.946 0.898 . . . . 0.0 109.108 166.806 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.526 ' HB2' ' HB3' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -91.98 165.32 13.27 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 -178.95 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 -146.42 115.8 7.09 Favored 'General case' 0 N--CA 1.444 -0.761 0 N-CA-C 105.644 -1.984 . . . . 0.0 105.644 179.184 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 71.48 -83.3 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 118.743 0.701 . . . . 0.0 110.325 170.059 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 36.3 m120 -162.35 55.58 0.23 Allowed 'General case' 0 N--CA 1.463 0.181 0 C-N-CA 130.026 3.33 . . . . 0.0 104.639 164.102 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -143.93 174.44 10.84 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 129.278 3.031 . . . . 0.0 103.431 177.009 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.448 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.2 m -154.41 158.67 40.37 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-N 120.525 1.511 . . . . 0.0 108.952 -173.456 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.533 ' HG3' ' HA ' ' A' ' 3' ' ' LEU . 0.0 OUTLIER -147.56 140.58 25.03 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 123.594 0.758 . . . . 0.0 109.684 -173.519 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 41.1 t -122.58 148.55 45.09 Favored 'General case' 0 C--N 1.34 0.195 0 C-N-CA 123.816 0.846 . . . . 0.0 110.49 -168.283 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 90.9 t80 . . . . . 0 N--CA 1.452 -0.359 0 C-N-CA 126.101 1.76 . . . . 0.0 109.846 -173.747 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 2.6 t80 . . . . . 0 N--CA 1.453 -0.297 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -57.59 137.17 49.93 Favored Glycine 0 N--CA 1.445 -0.721 0 N-CA-C 110.212 -1.155 . . . . 0.0 110.212 151.858 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.442 ' HA ' ' HG2' ' A' ' 35' ' ' ARG . 2.4 pt? -145.22 130.8 18.85 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 118.362 1.081 . . . . 0.0 110.49 165.738 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -145.05 160.21 13.67 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.219 0 N-CA-C 106.403 -1.702 . . . . 0.0 106.403 -163.131 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -120.42 32.58 5.95 Favored 'General case' 0 C--N 1.332 -0.159 0 C-N-CA 123.542 0.737 . . . . 0.0 110.737 -173.378 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 97.0 t -82.88 133.87 28.15 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 N-CA-C 108.115 -1.069 . . . . 0.0 108.115 171.681 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.1 mtpp -65.26 94.24 0.16 Allowed 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 125.701 1.6 . . . . 0.0 112.057 -173.606 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.498 ' HB3' ' HB2' ' A' ' 29' ' ' CYS . 1.7 p -58.44 136.02 57.38 Favored 'General case' 0 N--CA 1.464 0.238 0 O-C-N 123.436 0.46 . . . . 0.0 110.616 173.517 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 82.0 m-85 -91.09 -27.25 18.7 Favored 'General case' 0 N--CA 1.445 -0.697 0 C-N-CA 126.592 1.957 . . . . 0.0 108.306 152.666 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -158.68 162.05 37.17 Favored 'General case' 0 C--N 1.344 0.329 0 CA-C-N 118.605 0.639 . . . . 0.0 110.834 179.087 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.502 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 1.8 p -61.88 -45.07 95.36 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 124.875 1.27 . . . . 0.0 111.234 173.003 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.9 p -55.04 -32.25 61.72 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 121.178 0.513 . . . . 0.0 111.092 -178.147 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 48.7 tt0 -51.98 -48.78 64.23 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 123.607 0.763 . . . . 0.0 111.937 172.493 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 32.9 m -56.62 -30.42 63.25 Favored 'General case' 0 N--CA 1.444 -0.774 0 C-N-CA 126.606 1.962 . . . . 0.0 109.006 -177.985 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 32.2 m0 -64.56 -64.08 0.97 Allowed 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 107.494 -1.299 . . . . 0.0 107.494 179.832 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -51.6 -35.41 41.39 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 118.385 -0.817 . . . . 0.0 111.463 173.563 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.66 -56.15 18.0 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 119.872 1.214 . . . . 0.0 110.559 -179.038 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -57.71 -36.55 72.14 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.37 0.605 . . . . 0.0 110.472 179.32 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.452 ' CG ' ' HA3' ' A' ' 25' ' ' GLY . 1.7 mtmp? -62.8 -50.74 69.8 Favored 'General case' 0 N--CA 1.435 -1.202 0 CA-C-N 115.589 -0.732 . . . . 0.0 112.442 177.507 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 65.9 mmtt -50.22 -52.99 31.29 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 123.66 0.784 . . . . 0.0 111.024 178.272 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -67.93 -63.95 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 CA-C-N 118.177 0.444 . . . . 0.0 111.651 177.537 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.9 m -116.92 -37.79 3.54 Favored 'General case' 0 N--CA 1.442 -0.838 0 C-N-CA 123.581 0.753 . . . . 0.0 110.465 -155.652 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 116.94 -14.83 13.92 Favored Glycine 0 CA--C 1.531 1.055 0 C-N-CA 123.196 0.427 . . . . 0.0 113.183 -178.757 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.7 t -82.04 67.29 7.98 Favored 'General case' 0 N--CA 1.465 0.313 0 O-C-N 121.601 -0.94 . . . . 0.0 109.621 -166.663 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.452 ' HA3' ' CG ' ' A' ' 19' ' ' LYS . . . -74.08 37.08 0.93 Allowed Glycine 0 CA--C 1.537 1.457 0 N-CA-C 116.964 1.546 . . . . 0.0 116.964 -159.407 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -122.65 126.71 48.16 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 125.814 1.645 . . . . 0.0 107.522 -175.481 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -179.37 -172.43 43.54 Favored Glycine 0 CA--C 1.525 0.663 0 CA-C-N 119.246 0.93 . . . . 0.0 111.922 -176.091 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.28 157.13 42.73 Favored 'General case' 0 C--O 1.232 0.135 0 C-N-CA 125.62 1.568 . . . . 0.0 107.457 166.878 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.502 ' HB3' ' HA ' ' A' ' 11' ' ' SER . 0.5 OUTLIER -89.74 151.63 21.73 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 178.474 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 54.7 tp60 -124.09 112.88 17.65 Favored 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 105.923 -1.88 . . . . 0.0 105.923 177.85 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 62.95 -89.77 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 119.256 0.934 . . . . 0.0 110.099 174.567 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -150.28 56.22 0.94 Allowed 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 126.713 2.005 . . . . 0.0 107.916 164.128 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -135.55 179.75 6.14 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 129.313 3.045 . . . . 0.0 103.953 166.047 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.455 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.2 m -150.43 147.44 27.55 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-N 119.457 1.026 . . . . 0.0 109.319 -178.265 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.442 ' HG2' ' HA ' ' A' ' 3' ' ' LEU . 41.7 mtt180 -140.18 136.59 33.61 Favored 'General case' 0 CA--C 1.513 -0.464 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 -173.407 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.8 t -126.16 167.46 15.38 Favored 'General case' 0 C--O 1.225 -0.187 0 O-C-N 124.577 1.173 . . . . 0.0 110.103 -162.929 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 28.6 t80 . . . . . 0 N--CA 1.452 -0.333 0 C-N-CA 124.394 1.078 . . . . 0.0 109.429 166.65 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 . . . . . 0 N--CA 1.45 -0.434 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 124.64 -135.7 9.64 Favored Glycine 0 C--N 1.335 0.477 0 CA-C-O 118.742 -1.032 . . . . 0.0 111.581 167.957 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -110.25 144.2 39.29 Favored 'General case' 0 CA--C 1.519 -0.219 0 C-N-CA 124.224 1.009 . . . . 0.0 112.759 -165.781 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -132.15 171.13 18.57 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.208 0 N-CA-C 106.17 -1.789 . . . . 0.0 106.17 -170.382 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -133.42 83.44 2.05 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-O 122.26 1.028 . . . . 0.0 110.249 168.451 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 93.5 t -125.78 138.67 53.74 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 CA-C-N 113.956 -1.474 . . . . 0.0 107.374 160.819 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -68.58 106.25 2.52 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 124.495 1.118 . . . . 0.0 111.32 -169.34 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.522 ' HB3' ' HB2' ' A' ' 29' ' ' CYS . 5.8 p -66.67 130.44 43.18 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 120.784 0.326 . . . . 0.0 110.965 174.301 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -78.95 -36.21 41.99 Favored 'General case' 0 N--CA 1.442 -0.832 0 C-N-CA 125.351 1.46 . . . . 0.0 108.124 148.069 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -161.47 154.71 21.17 Favored 'General case' 0 C--O 1.222 -0.359 0 CA-C-N 118.44 0.563 . . . . 0.0 112.008 -177.451 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.507 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 27.9 m -50.75 -41.08 56.19 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 123.862 0.865 . . . . 0.0 112.583 173.606 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.31 -20.08 57.82 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 123.058 0.543 . . . . 0.0 112.292 -179.0 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 70.7 tt0 -72.03 -44.03 64.03 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 124.083 0.953 . . . . 0.0 110.79 176.05 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 20.8 m -55.16 -29.48 57.87 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 126.635 1.974 . . . . 0.0 108.874 179.21 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 36.1 m0 -64.83 -68.42 0.36 Allowed 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 179.288 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -54.71 -26.51 34.21 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 123.909 0.884 . . . . 0.0 111.557 175.938 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.14 -55.5 18.33 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 119.943 1.247 . . . . 0.0 109.806 174.003 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 3.8 t -55.16 -38.68 68.59 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.974 0.892 . . . . 0.0 110.278 178.579 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.9 mtmt -63.23 -53.6 50.5 Favored 'General case' 0 N--CA 1.434 -1.235 0 CA-C-N 115.159 -0.928 . . . . 0.0 110.519 177.133 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -52.98 -40.96 64.13 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 116.924 -1.512 . . . . 0.0 113.119 -179.007 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -67.98 -60.74 2.18 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 CA-C-N 119.314 0.961 . . . . 0.0 111.318 169.665 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 47.5 p -113.54 -65.96 1.13 Allowed 'General case' 0 N--CA 1.458 -0.065 0 CA-C-O 121.306 0.575 . . . . 0.0 110.45 -168.168 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 148.17 -23.05 1.41 Allowed Glycine 0 CA--C 1.529 0.963 0 CA-C-N 115.137 -0.938 . . . . 0.0 113.171 -170.757 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.2 p -82.44 72.36 9.51 Favored 'General case' 0 C--N 1.333 -0.139 0 O-C-N 121.553 -0.969 . . . . 0.0 109.666 -168.875 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -70.51 50.91 0.83 Allowed Glycine 0 CA--C 1.537 1.452 0 N-CA-C 117.034 1.574 . . . . 0.0 117.034 -163.057 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -131.53 101.9 5.7 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 125.421 1.488 . . . . 0.0 109.788 -165.188 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -161.82 -165.85 19.49 Favored Glycine 0 CA--C 1.525 0.681 0 CA-C-N 118.242 0.474 . . . . 0.0 113.467 -170.798 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 20.6 ttmm -162.98 144.91 10.14 Favored 'General case' 0 C--O 1.232 0.164 0 N-CA-C 107.403 -1.332 . . . . 0.0 107.403 178.853 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.522 ' HB2' ' HB3' ' A' ' 8' ' ' CYS . 0.5 OUTLIER -87.64 162.19 17.27 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 -179.54 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.4 tp-100 -143.27 132.71 23.47 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 106.929 -1.508 . . . . 0.0 106.929 171.221 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 64.08 -91.26 0.03 OUTLIER 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 123.214 0.606 . . . . 0.0 109.975 170.065 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 23.2 m120 -155.42 62.92 0.61 Allowed 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 127.608 2.363 . . . . 0.0 105.781 158.234 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 17.2 mp0 -147.69 179.46 7.68 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 130.951 3.701 . . . . 0.0 103.983 174.267 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.444 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.5 m -152.84 161.17 42.89 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 121.11 -0.994 . . . . 0.0 109.572 -174.598 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.8 mtt85 -138.05 152.83 49.2 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 124.416 1.086 . . . . 0.0 109.26 179.406 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 53.5 t -136.45 137.72 40.72 Favored 'General case' 0 CA--C 1.522 -0.132 0 C-N-CA 124.317 1.047 . . . . 0.0 108.314 179.828 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.141 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 -153.933 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 13.8 t80 . . . . . 0 CA--C 1.533 0.311 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -47.35 -178.08 0.01 OUTLIER Glycine 0 CA--C 1.531 1.053 0 C-N-CA 128.813 3.101 . . . . 0.0 112.862 166.423 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -155.57 128.45 8.03 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 106.592 -1.633 . . . . 0.0 106.592 150.424 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -139.41 159.21 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.176 0 N-CA-C 106.432 -1.692 . . . . 0.0 106.432 -174.212 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -92.89 -9.67 39.33 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.253 1.021 . . . . 0.0 112.244 -171.5 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 59.2 t -72.09 134.37 30.01 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 C-N-CA 119.953 -0.699 . . . . 0.0 110.55 -160.777 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -58.08 101.2 0.07 Allowed 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 125.568 1.547 . . . . 0.0 111.531 -174.385 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.464 ' HB3' ' HB2' ' A' ' 29' ' ' CYS . 0.5 OUTLIER -68.25 129.13 39.0 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 109.265 -0.642 . . . . 0.0 109.265 168.869 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -91.7 -16.8 26.41 Favored 'General case' 0 N--CA 1.454 -0.258 0 O-C-N 124.353 1.033 . . . . 0.0 109.316 150.437 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -169.7 148.15 3.59 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 123.701 0.801 . . . . 0.0 109.069 -178.698 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.517 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 27.1 m -47.37 -39.64 15.65 Favored 'General case' 0 N--CA 1.46 0.034 0 C-N-CA 124.551 1.14 . . . . 0.0 112.092 170.899 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.2 p -61.37 -22.93 65.41 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-O 118.889 -0.577 . . . . 0.0 112.25 -177.933 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.86 -47.88 56.9 Favored 'General case' 0 C--O 1.216 -0.678 0 CA-C-N 119.437 1.017 . . . . 0.0 109.283 174.372 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 27.5 m -47.9 -28.32 2.6 Favored 'General case' 0 CA--C 1.512 -0.513 0 C-N-CA 126.227 1.811 . . . . 0.0 110.441 -177.486 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 39.0 m0 -64.34 -67.79 0.4 Allowed 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.339 -1.3 . . . . 0.0 107.735 176.633 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -52.24 -27.95 16.81 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-O 118.164 -0.922 . . . . 0.0 111.725 172.878 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.07 -61.57 1.97 Allowed 'General case' 0 C--N 1.339 0.151 0 CA-C-N 121.035 1.743 . . . . 0.0 110.986 175.929 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -57.81 -30.41 65.68 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.249 0.547 . . . . 0.0 110.533 179.295 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.7 mtmt -67.89 -49.72 60.36 Favored 'General case' 0 N--CA 1.443 -0.79 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 172.742 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 51.6 mttt -50.21 -49.64 52.07 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 124.695 1.198 . . . . 0.0 109.789 178.771 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -67.45 -67.21 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 CA-C-N 118.146 0.43 . . . . 0.0 111.412 173.762 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 18.5 m -114.26 -49.46 2.84 Favored 'General case' 0 N--CA 1.438 -1.046 0 C-N-CA 123.255 0.622 . . . . 0.0 110.425 -158.045 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 133.16 -15.79 4.74 Favored Glycine 0 CA--C 1.533 1.189 0 C-N-CA 123.013 0.339 . . . . 0.0 112.829 -171.729 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.0 m -79.27 61.74 3.44 Favored 'General case' 0 C--O 1.225 -0.191 0 C-N-CA 124.393 1.077 . . . . 0.0 111.868 -164.624 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -70.67 1.6 21.16 Favored Glycine 0 CA--C 1.536 1.36 0 N-CA-C 116.159 1.223 . . . . 0.0 116.159 -158.71 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 60.0 mt-30 -90.66 110.81 21.98 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 119.846 1.823 . . . . 0.0 108.14 -176.631 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -164.44 -161.93 14.45 Favored Glycine 0 C--N 1.337 0.638 0 CA-C-N 118.741 0.701 . . . . 0.0 114.672 -170.879 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 6.9 mttp -169.29 150.58 4.35 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 123.935 0.894 . . . . 0.0 109.175 -175.179 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.517 ' HB3' ' HA ' ' A' ' 11' ' ' SER . 0.1 OUTLIER -94.32 160.47 14.66 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.932 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.0 tt0 -134.6 131.69 38.14 Favored 'General case' 0 N--CA 1.444 -0.767 0 N-CA-C 105.296 -2.113 . . . . 0.0 105.296 165.974 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 21.1 t30 67.22 -90.81 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 118.713 0.688 . . . . 0.0 110.574 163.522 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 31.1 m120 -156.16 53.83 0.56 Allowed 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 127.968 2.507 . . . . 0.0 106.107 164.032 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 25.0 mp0 -151.05 176.9 10.7 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 129.391 3.076 . . . . 0.0 103.818 -179.802 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.6 m -160.41 167.84 26.46 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 120.21 1.368 . . . . 0.0 111.137 -165.47 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 33.6 mtp180 -146.58 160.83 41.66 Favored 'General case' 0 CA--C 1.518 -0.266 0 C-N-CA 125.054 1.342 . . . . 0.0 109.255 179.809 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 29.0 p -131.32 177.89 7.13 Favored 'General case' 0 CA--C 1.513 -0.445 0 O-C-N 124.507 1.129 . . . . 0.0 109.88 162.399 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 3.8 p90 . . . . . 0 N--CA 1.446 -0.633 0 C-N-CA 124.197 0.999 . . . . 0.0 111.879 -172.356 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 79.5 t80 . . . . . 0 N--CA 1.453 -0.319 0 CA-C-O 122.021 0.915 . . . . 0.0 110.357 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -63.31 139.68 44.32 Favored Glycine 0 N--CA 1.449 -0.484 0 N-CA-C 108.236 -1.946 . . . . 0.0 108.236 167.169 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -145.62 127.97 15.87 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 119.208 1.504 . . . . 0.0 110.582 163.889 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -143.61 158.92 16.74 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.205 0 N-CA-C 106.063 -1.828 . . . . 0.0 106.063 -160.551 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -120.39 30.22 7.06 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 121.745 0.783 . . . . 0.0 112.352 -174.226 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 52.4 t -85.79 134.42 27.26 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 171.787 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.6 mptt -69.82 107.29 3.46 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 125.443 1.497 . . . . 0.0 112.056 -165.181 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.501 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -63.3 126.16 26.51 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 123.896 0.878 . . . . 0.0 109.968 171.219 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -82.73 -21.55 34.72 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 124.873 1.358 . . . . 0.0 109.173 153.128 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -175.64 179.24 1.45 Allowed 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 126.174 1.79 . . . . 0.0 106.588 -176.156 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 39.7 m -70.98 -34.02 70.99 Favored 'General case' 0 N--CA 1.461 0.104 0 C-N-CA 125.497 1.519 . . . . 0.0 113.093 173.779 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -52.88 -56.3 16.84 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-O 122.065 0.936 . . . . 0.0 110.963 -172.36 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . 0.269 8.4 mp0 -20.97 -59.44 0.03 OUTLIER 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 128.93 2.892 . . . . 0.0 115.761 159.4 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 31.6 m -61.08 -27.29 68.25 Favored 'General case' 0 N--CA 1.442 -0.828 0 C-N-CA 125.706 1.602 . . . . 0.0 109.09 -172.295 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 35.9 m0 -69.7 -64.85 0.8 Allowed 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 -179.007 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -52.78 -30.79 34.96 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 124.049 0.939 . . . . 0.0 110.869 174.76 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.22 -57.98 8.71 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 119.385 0.993 . . . . 0.0 110.329 173.615 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -59.21 -32.21 69.73 Favored 'General case' 0 CA--C 1.521 -0.15 0 O-C-N 121.989 -0.444 . . . . 0.0 111.063 -179.461 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.465 ' CG ' ' HA3' ' A' ' 25' ' ' GLY . 30.6 mtmt -64.95 -57.09 9.65 Favored 'General case' 0 N--CA 1.437 -1.122 0 CA-C-O 120.797 0.332 . . . . 0.0 111.1 176.2 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.2 mtpt -56.46 -38.27 71.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.591 -179.858 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 40.6 t -70.03 -61.94 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.427 -1.615 0 C-N-CA 123.848 0.859 . . . . 0.0 109.172 176.948 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.2 m -120.6 -45.69 2.4 Favored 'General case' 0 N--CA 1.436 -1.137 0 C-N-CA 123.628 0.771 . . . . 0.0 111.16 -162.877 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 126.26 -20.05 6.3 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 124.636 1.112 . . . . 0.0 111.997 -173.376 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 31.0 t -84.23 65.58 8.89 Favored 'General case' 0 C--N 1.333 -0.145 0 C-N-CA 124.691 1.197 . . . . 0.0 109.636 -166.136 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.465 ' HA3' ' CG ' ' A' ' 19' ' ' LYS . . . -71.03 40.27 0.55 Allowed Glycine 0 CA--C 1.533 1.183 0 N-CA-C 117.539 1.776 . . . . 0.0 117.539 -160.084 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -129.19 123.95 33.34 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 120.093 1.947 . . . . 0.0 109.261 -175.186 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -177.05 -166.22 33.64 Favored Glycine 0 C--N 1.335 0.507 0 N-CA-C 110.109 -1.196 . . . . 0.0 110.109 -175.543 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 6.7 mtmp? -153.89 166.02 34.26 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 124.492 1.117 . . . . 0.0 108.074 164.435 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.501 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -85.58 165.06 17.37 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 176.845 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -136.95 128.81 29.09 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 105.703 -1.962 . . . . 0.0 105.703 165.117 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 67.68 -89.9 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 123.238 0.615 . . . . 0.0 110.397 166.577 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 31.9 m120 -154.58 58.38 0.69 Allowed 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 127.314 2.246 . . . . 0.0 105.899 161.256 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 19.7 mp0 -151.15 176.45 11.17 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 129.288 3.035 . . . . 0.0 104.18 179.121 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.455 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.7 m -154.83 153.99 32.05 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-N 120.324 1.42 . . . . 0.0 110.73 -169.743 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 17.4 mtt180 -145.11 128.26 16.67 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 124.048 0.939 . . . . 0.0 110.204 -168.731 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -99.79 161.71 13.45 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 123.332 0.653 . . . . 0.0 111.453 178.039 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.454 -0.232 0 C-N-CA 123.811 0.844 . . . . 0.0 111.284 -171.272 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 . . . . . 0 C--O 1.233 0.219 0 CA-C-O 120.321 0.105 . . . . 0.0 110.966 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -42.35 142.95 1.33 Allowed Glycine 0 C--N 1.337 0.613 0 CA-C-O 118.796 -1.002 . . . . 0.0 111.325 172.282 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -141.9 129.2 21.1 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 106.439 -1.689 . . . . 0.0 106.439 167.016 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -131.73 -175.63 1.49 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.726 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 -165.742 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -141.58 83.81 1.88 Allowed 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 122.081 0.943 . . . . 0.0 110.86 161.07 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 80.5 t -130.14 134.57 62.51 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 N-CA-C 105.6 -2.0 . . . . 0.0 105.6 160.554 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.0 mptt -68.91 111.19 4.8 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 124.642 1.177 . . . . 0.0 110.263 -169.333 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.503 ' HB2' ' HB2' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -61.23 126.96 29.26 Favored 'General case' 0 CA--C 1.515 -0.376 0 C-N-CA 122.725 0.41 . . . . 0.0 110.191 175.518 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -89.67 -15.77 31.91 Favored 'General case' 0 N--CA 1.449 -0.488 0 O-C-N 125.003 1.439 . . . . 0.0 109.598 157.51 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 179.33 153.05 0.42 Allowed 'General case' 0 C--N 1.344 0.359 0 C-N-CA 125.485 1.514 . . . . 0.0 108.604 -177.146 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.523 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 24.4 m -54.95 -37.48 66.51 Favored 'General case' 0 N--CA 1.462 0.165 0 C-N-CA 123.056 0.542 . . . . 0.0 112.162 171.906 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.45 -23.18 64.22 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-O 119.427 -0.32 . . . . 0.0 111.765 179.076 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -67.46 -50.78 57.66 Favored 'General case' 0 C--O 1.217 -0.627 0 CA-C-N 118.655 0.661 . . . . 0.0 109.562 175.071 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 23.7 m -49.32 -27.31 3.79 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 126.108 1.763 . . . . 0.0 110.655 -177.108 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 31.2 m0 -63.36 -65.96 0.61 Allowed 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 114.821 -1.081 . . . . 0.0 108.192 173.271 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -52.95 -31.51 40.85 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-O 117.716 -1.135 . . . . 0.0 111.585 174.084 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.47 -55.46 27.43 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 121.686 2.039 . . . . 0.0 110.477 173.801 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 2.0 t -54.53 -37.46 65.41 Favored 'General case' 0 CA--C 1.527 0.087 0 C-N-CA 123.088 0.555 . . . . 0.0 109.858 178.259 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.7 mtpt -66.7 -54.24 25.16 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-O 121.351 0.596 . . . . 0.0 111.784 177.563 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 20.1 mtpp -53.75 -38.65 64.61 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 124.659 1.184 . . . . 0.0 110.25 -179.413 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 54.1 t -76.07 -61.63 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.426 -1.632 0 C-N-CA 124.734 1.214 . . . . 0.0 110.051 177.715 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 11.4 t -134.52 13.47 3.77 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 114.166 1.173 . . . . 0.0 114.166 -162.753 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 76.17 -26.19 1.53 Allowed Glycine 0 CA--C 1.537 1.424 0 O-C-N 120.317 -1.489 . . . . 0.0 114.259 178.658 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.4 m -81.17 62.8 5.26 Favored 'General case' 0 C--O 1.223 -0.333 0 C-N-CA 125.451 1.5 . . . . 0.0 111.511 -162.621 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -66.73 49.44 0.22 Allowed Glycine 0 CA--C 1.54 1.647 0 N-CA-C 119.023 2.369 . . . . 0.0 119.023 -156.807 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -130.92 118.71 21.08 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 120.477 2.139 . . . . 0.0 109.945 -173.419 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -172.98 -164.95 29.21 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 111.357 -0.697 . . . . 0.0 111.357 -177.378 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 58.4 mttt -160.56 161.13 32.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 124.882 1.273 . . . . 0.0 108.582 169.531 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.523 ' HB3' ' HA ' ' A' ' 11' ' ' SER . 0.1 OUTLIER -92.18 162.34 14.36 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 -177.674 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.7 tp-100 -133.55 133.72 42.47 Favored 'General case' 0 N--CA 1.444 -0.733 0 N-CA-C 106.069 -1.826 . . . . 0.0 106.069 166.407 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 63.55 -87.63 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 117.971 0.35 . . . . 0.0 111.64 168.084 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -161.02 63.94 0.29 Allowed 'General case' 0 C--O 1.227 -0.118 0 C-N-CA 129.681 3.192 . . . . 0.0 104.169 165.259 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -161.64 174.58 13.11 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 129.279 3.032 . . . . 0.0 103.007 -177.759 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.415 ' HA ' ' HA ' ' A' ' 29' ' ' CYS . 1.7 m -153.65 160.61 42.44 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 121.199 1.818 . . . . 0.0 111.075 -169.112 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 63.8 mtp180 -139.43 151.12 45.99 Favored 'General case' 0 CA--C 1.511 -0.554 0 C-N-CA 125.351 1.461 . . . . 0.0 108.812 178.559 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -154.5 154.32 32.95 Favored 'General case' 0 C--N 1.333 -0.124 0 O-C-N 124.117 0.886 . . . . 0.0 112.562 -178.885 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.243 0 CA-C-O 120.962 0.41 . . . . 0.0 111.037 -174.171 . . . . . . . . 1 1 . 1 stop_ save_